#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nqo s VAL 1 N 0.00 4.86 0.01 0.00 0.11 -0.58 -4.82 120.40 119.97 1nqo s VAL 1 Ca 0.00 1.37 -0.30 0.00 -2.93 0.00 0.00 61.98 60.12 1nqo s VAL 1 Cb 0.00 -3.99 -0.04 0.00 -1.53 0.00 0.00 36.38 30.82 1nqo s VAL 1 CO 0.00 0.39 1.04 -0.54 -3.33 0.00 0.00 175.10 172.67 1nqo s LYS 2 N -0.11 4.51 0.03 1.54 1.02 -1.26 -0.76 119.74 124.72 1nqo s LYS 2 Ca 0.34 1.51 0.08 0.00 0.02 0.00 0.00 55.97 57.92 1nqo s LYS 2 Cb -0.19 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.66 1nqo s LYS 2 CO 0.19 -0.14 -0.24 0.08 -0.92 0.00 0.00 175.35 174.33 1nqo s VAL 3 N 1.14 1.91 -0.04 3.17 1.01 0.15 -1.90 120.40 125.83 1nqo s VAL 3 Ca 0.54 -1.23 0.06 0.00 0.00 0.00 0.00 61.98 61.35 1nqo s VAL 3 Cb -0.23 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 1nqo s VAL 3 CO 0.27 0.35 -0.24 -0.83 0.00 0.00 0.00 175.10 174.66 1nqo s GLY 4 N -1.05 1.19 -0.26 4.51 0.00 -0.21 -1.41 107.32 110.09 1nqo s GLY 4 Ca 0.10 -1.00 -0.05 0.00 0.00 0.00 0.00 44.72 43.77 1nqo s GLY 4 CO 0.01 -0.71 0.02 -0.42 0.00 0.00 0.00 173.10 172.00 1nqo s ILE 5 N -0.32 3.62 -0.40 0.90 1.01 -0.33 -0.61 121.20 125.07 1nqo s ILE 5 Ca 0.02 -0.65 -0.14 0.00 0.00 0.00 0.00 60.65 59.89 1nqo s ILE 5 Cb -0.11 -2.79 0.02 0.00 0.01 0.00 0.00 42.46 39.59 1nqo s ILE 5 CO 0.01 0.23 0.27 0.21 0.00 0.00 0.00 174.94 175.66 1nqo s ASN 6 N 1.47 5.99 0.00 3.58 2.47 -0.32 0.05 114.94 128.17 1nqo s ASN 6 Ca 0.03 -0.95 0.00 0.00 0.42 0.00 0.00 52.86 52.36 1nqo s ASN 6 Cb -0.16 -2.11 0.00 0.00 -1.45 0.00 0.00 41.25 37.53 1nqo s ASN 6 CO -0.00 -0.44 0.00 0.61 -3.72 0.00 0.00 177.10 173.55 1nqo n GLY 7 N 5.11 -0.05 2.48 1.21 0.00 0.58 -0.69 105.19 113.82 1nqo n GLY 7 Ca -0.11 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 1nqo n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqo n PHE 8 N -0.00 2.26 -0.43 1.61 7.35 -1.20 -3.87 117.46 123.18 1nqo n PHE 8 Ca 0.00 -2.54 0.00 0.00 -0.76 0.00 0.00 57.45 54.15 1nqo n PHE 8 Cb 0.00 -1.69 0.00 0.00 0.35 0.00 0.00 39.48 38.14 1nqo n PHE 8 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nqo n GLY 9 N 1.47 1.86 0.14 7.13 0.00 -1.26 -4.41 105.19 110.11 1nqo n GLY 9 Ca 0.58 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.71 1nqo n GLY 9 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1nqo h ARG 10 N 0.00 -0.11 0.01 1.61 2.47 -1.92 0.30 114.38 116.74 1nqo h ARG 10 Ca 0.00 0.01 -0.24 0.00 -1.26 0.00 0.00 59.98 58.49 1nqo h ARG 10 Cb 0.00 0.02 0.02 0.00 -1.65 0.00 0.00 29.97 28.36 1nqo h ARG 10 CO 0.00 -0.07 -0.93 0.82 0.56 0.00 0.00 179.97 180.34 1nqo h ILE 11 N -0.11 1.32 -0.24 2.04 1.08 -1.90 -2.30 117.51 117.40 1nqo h ILE 11 Ca 0.07 -2.21 0.04 0.00 -0.39 0.00 0.00 64.86 62.37 1nqo h ILE 11 Cb 0.21 2.46 -0.04 0.00 -3.07 0.00 0.00 36.82 36.38 1nqo h ILE 11 CO -0.16 0.67 0.00 1.23 -0.69 0.00 0.00 178.15 179.21 1nqo h GLY 12 N 0.25 0.24 1.51 5.37 0.00 -1.63 0.36 103.07 109.16 1nqo h GLY 12 Ca -0.12 0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 1nqo h GLY 12 CO 0.18 -0.04 -0.50 3.21 0.00 0.00 0.00 176.54 179.39 1nqo h ARG 13 N 0.08 0.53 0.00 4.80 3.08 -0.49 -1.79 114.38 120.59 1nqo h ARG 13 Ca 0.12 -0.31 -0.12 0.00 0.07 0.00 0.00 59.98 59.74 1nqo h ARG 13 Cb 0.14 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1nqo h ARG 13 CO -0.19 0.90 -0.58 -0.91 -1.07 0.00 0.00 179.97 178.12 1nqo h ASN 14 N 0.41 0.00 -0.52 7.04 2.35 -1.06 -0.97 115.58 122.85 1nqo h ASN 14 Ca 0.02 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.68 1nqo h ASN 14 Cb 1.02 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 1nqo h ASN 14 CO 0.09 0.58 -0.01 0.58 -1.65 0.00 0.00 177.43 177.03 1nqo h VAL 15 N 0.00 1.26 -0.32 2.81 2.07 -0.09 -2.04 116.25 119.94 1nqo h VAL 15 Ca -0.01 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.42 1nqo h VAL 15 Cb 1.03 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1nqo h VAL 15 CO 0.08 0.39 0.21 0.15 0.02 0.00 0.00 177.57 178.41 1nqo h PHE 16 N 0.78 0.39 -0.72 1.57 3.57 -0.91 0.62 116.94 122.24 1nqo h PHE 16 Ca 0.15 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.74 1nqo h PHE 16 Cb 0.53 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.08 1nqo h PHE 16 CO 0.04 0.24 0.37 0.00 -2.23 0.00 0.00 178.31 176.73 1nqo h ARG 17 N 0.42 0.62 -0.17 1.11 3.08 -0.91 -0.47 114.38 118.07 1nqo h ARG 17 Ca 0.12 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 1nqo h ARG 17 Cb -0.04 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 1nqo h ARG 17 CO -0.03 0.41 -0.39 0.00 -1.07 0.00 0.00 179.97 178.88 1nqo h ALA 18 N 1.42 1.01 -0.83 0.04 0.00 -0.92 -2.97 119.26 117.01 1nqo h ALA 18 Ca 0.35 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1nqo h ALA 18 Cb 0.33 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1nqo h ALA 18 CO -0.25 0.61 0.41 0.00 0.00 0.00 0.00 179.25 180.02 1nqo h ALA 19 N 1.27 1.16 0.00 0.00 0.00 0.67 -1.88 119.26 120.48 1nqo h ALA 19 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1nqo h ALA 19 Cb 0.84 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1nqo h ALA 19 CO 0.07 0.64 0.07 -0.07 0.00 0.00 0.00 179.25 179.96 1nqo h LEU 20 N 1.18 0.00 -1.33 0.00 3.38 -1.07 0.71 115.31 118.17 1nqo h LEU 20 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1nqo h LEU 20 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1nqo h LEU 20 CO -0.04 0.00 -0.24 0.29 0.09 0.00 0.00 178.44 178.54 1nqo n LYS 21 N -2.99 1.66 -4.00 1.13 5.02 -0.71 -4.76 118.16 113.51 1nqo n LYS 21 Ca -0.03 -1.33 -0.31 0.00 -2.02 0.00 0.00 58.31 54.62 1nqo n LYS 21 Cb 0.13 -1.47 -0.15 0.00 -0.02 0.00 0.00 35.03 33.52 1nqo n LYS 21 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1nqo s ASN 22 N -2.26 4.56 0.35 4.39 3.84 0.24 -4.98 114.94 121.08 1nqo s ASN 22 Ca 0.24 -1.87 0.25 0.00 0.21 0.00 0.00 52.86 51.69 1nqo s ASN 22 Cb 0.19 -1.50 1.26 0.00 -0.55 0.00 0.00 41.25 40.64 1nqo s ASN 22 CO 0.45 -0.33 1.77 1.55 -2.79 0.00 0.00 177.10 177.74 1nqo h PRO 23 N 7.72 0.00 0.00 0.43 0.13 -1.86 -2.59 132.00 135.83 1nqo h PRO 23 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1nqo h PRO 23 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1nqo h PRO 23 CO 0.49 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.01 1nqo n ASP 24 N -2.39 0.00 -4.24 1.44 8.00 -1.26 -2.84 116.55 115.26 1nqo n ASP 24 Ca -0.00 0.50 -0.31 0.00 0.71 0.00 0.00 54.79 55.69 1nqo n ASP 24 Cb 0.11 -0.50 -0.17 0.00 -0.02 0.00 0.00 41.12 40.55 1nqo n ASP 24 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1nqo s ILE 25 N -3.00 1.98 -0.27 0.53 -5.25 -0.98 -1.53 121.20 112.69 1nqo s ILE 25 Ca 0.12 -1.01 0.02 0.00 -0.99 0.00 0.00 60.65 58.79 1nqo s ILE 25 Cb 0.16 -1.69 0.06 0.00 2.95 0.00 0.00 42.46 43.94 1nqo s ILE 25 CO 0.46 0.55 -0.09 -0.70 -1.79 0.00 0.00 174.94 173.37 1nqo s GLU 26 N 0.03 2.28 -0.57 0.37 2.12 0.06 -4.58 118.70 118.42 1nqo s GLU 26 Ca -0.09 -1.33 -0.28 0.00 0.36 0.00 0.00 54.97 53.63 1nqo s GLU 26 Cb -0.15 -2.96 0.03 0.00 0.26 0.00 0.00 34.13 31.32 1nqo s GLU 26 CO 0.05 -0.58 1.16 0.08 -0.54 0.00 0.00 175.26 175.43 1nqo s VAL 27 N 1.13 4.07 -0.36 3.70 1.01 -1.26 0.31 120.40 129.00 1nqo s VAL 27 Ca -0.08 0.87 0.23 0.00 0.00 0.00 0.00 61.98 63.00 1nqo s VAL 27 Cb -0.20 -4.70 -0.10 0.00 0.00 0.00 0.00 36.38 31.38 1nqo s VAL 27 CO -0.04 -1.29 0.95 1.33 0.00 0.00 0.00 175.10 176.04 1nqo n VAL 28 N 6.64 0.32 -3.47 2.92 0.24 -0.50 -4.83 118.33 119.65 1nqo n VAL 28 Ca 0.08 -0.41 -0.14 0.00 -2.04 0.00 0.00 64.34 61.83 1nqo n VAL 28 Cb 0.49 -0.06 -0.04 0.00 -1.47 0.00 0.00 33.84 32.76 1nqo n VAL 28 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nqo s ALA 29 N -3.32 -1.70 0.03 2.33 0.00 -1.23 -1.26 121.76 116.62 1nqo s ALA 29 Ca 0.00 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.85 1nqo s ALA 29 Cb 0.12 0.45 -0.02 0.00 0.00 0.00 0.00 23.12 23.67 1nqo s ALA 29 CO 0.81 -0.60 -0.05 0.14 0.00 0.00 0.00 175.76 176.06 1nqo s VAL 30 N -2.67 0.29 -0.01 0.00 -7.23 0.08 -1.19 120.40 109.67 1nqo s VAL 30 Ca -0.03 -1.05 0.04 0.00 -1.81 0.00 0.00 61.98 59.13 1nqo s VAL 30 Cb -0.01 -0.50 -0.01 0.00 0.56 0.00 0.00 36.38 36.42 1nqo s VAL 30 CO -0.04 -0.50 -0.14 0.21 -0.31 0.00 0.00 175.10 174.33 1nqo s ASN 31 N -1.63 1.62 0.00 4.85 2.47 0.11 -0.65 114.94 121.70 1nqo s ASN 31 Ca -0.12 -0.25 0.00 0.00 0.42 0.00 0.00 52.86 52.91 1nqo s ASN 31 Cb -0.09 -0.18 0.00 0.00 -1.45 0.00 0.00 41.25 39.54 1nqo s ASN 31 CO -0.01 0.17 0.00 -0.67 -3.72 0.00 0.00 177.10 172.87 1nqo n ASP 32 N 2.73 0.00 -0.75 -4.21 -0.08 -0.72 -0.31 116.55 113.21 1nqo n ASP 32 Ca -0.14 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.19 1nqo n ASP 32 Cb 0.55 0.00 0.14 0.00 2.34 0.00 0.00 41.12 44.15 1nqo n ASP 32 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1nqo n LEU 33 N 0.00 2.04 0.00 -2.67 4.77 -1.26 -3.82 117.00 116.06 1nqo n LEU 33 Ca 0.00 -3.11 0.00 0.00 -0.03 0.00 0.00 56.01 52.87 1nqo n LEU 33 Cb 0.00 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1nqo n LEU 33 CO 0.00 1.00 0.00 1.07 -1.33 0.00 0.00 177.39 178.13 1nqo n THR 34 N -0.67 0.00 -3.35 -5.08 5.66 -1.26 -5.10 114.28 104.48 1nqo n THR 34 Ca 0.14 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.94 1nqo n THR 34 Cb 0.80 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.58 1nqo n THR 34 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 1nqo s ASP 36 N 0.52 5.22 0.39 1.09 1.47 -1.26 -4.76 116.67 119.33 1nqo s ASP 36 Ca 0.00 -0.70 0.07 0.00 1.18 0.00 0.00 52.55 53.10 1nqo s ASP 36 Cb 0.00 -0.41 0.78 0.00 -0.34 0.00 0.00 42.92 42.95 1nqo s ASP 36 CO 0.00 -0.81 1.98 0.00 0.68 0.00 0.00 175.17 177.02 1nqo h ALA 37 N 0.77 1.58 -0.60 2.11 0.00 -1.94 -2.26 119.26 118.93 1nqo h ALA 37 Ca -0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1nqo h ALA 37 Cb 1.28 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1nqo h ALA 37 CO 0.51 0.33 0.35 -0.91 0.00 0.00 0.00 179.25 179.53 1nqo h ASN 38 N 0.47 0.72 -0.21 0.00 -0.26 -1.93 0.08 115.58 114.46 1nqo h ASN 38 Ca 0.11 -0.07 -0.06 0.00 -0.56 0.00 0.00 56.30 55.73 1nqo h ASN 38 Cb 0.13 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.20 1nqo h ASN 38 CO -0.01 0.58 -0.09 0.74 -1.06 0.00 0.00 177.43 177.60 1nqo h THR 39 N 0.81 1.30 -0.40 2.81 2.02 -1.88 -1.76 112.91 115.81 1nqo h THR 39 Ca 0.21 -1.13 -0.04 0.00 0.77 0.00 0.00 66.41 66.22 1nqo h THR 39 Cb -0.00 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1nqo h THR 39 CO -0.04 0.34 0.06 -0.07 0.37 0.00 0.00 175.52 176.19 1nqo h LEU 40 N 0.13 0.57 -0.66 2.58 3.38 -1.30 -1.17 115.31 118.84 1nqo h LEU 40 Ca 0.05 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1nqo h LEU 40 Cb 0.57 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1nqo h LEU 40 CO 0.03 0.59 0.23 0.00 0.09 0.00 0.00 178.44 179.38 1nqo h ALA 41 N 1.48 0.86 -0.26 1.53 0.00 -0.82 0.20 119.26 122.26 1nqo h ALA 41 Ca 0.13 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1nqo h ALA 41 Cb 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1nqo h ALA 41 CO 0.00 0.52 -0.11 1.25 0.00 0.00 0.00 179.25 180.91 1nqo h HIS 42 N 0.95 0.61 -0.55 0.00 -0.00 -0.79 -1.83 115.15 113.54 1nqo h HIS 42 Ca 0.22 -0.15 -0.03 0.00 -0.00 0.00 0.00 60.37 60.41 1nqo h HIS 42 Cb 0.26 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 27.50 1nqo h HIS 42 CO 0.02 0.78 0.21 -0.07 -0.00 0.00 0.00 177.93 178.87 1nqo h LEU 43 N 0.26 0.73 -0.32 0.26 3.38 -1.07 -1.87 115.31 116.67 1nqo h LEU 43 Ca 0.06 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1nqo h LEU 43 Cb 0.61 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1nqo h LEU 43 CO 0.04 0.66 -0.05 0.25 0.09 0.00 0.00 178.44 179.42 1nqo h LEU 44 N 0.79 0.60 -0.31 1.67 5.85 -0.82 -3.30 115.31 119.79 1nqo h LEU 44 Ca 0.19 -0.35 -0.12 0.00 0.84 0.00 0.00 57.88 58.44 1nqo h LEU 44 Cb 0.17 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1nqo h LEU 44 CO -0.02 0.81 -0.27 0.11 -0.34 0.00 0.00 178.44 178.73 1nqo h LYS 45 N 0.38 0.73 -4.94 1.25 1.57 -1.05 -3.37 116.57 111.14 1nqo h LYS 45 Ca 0.08 -0.37 -0.67 0.00 -1.87 0.00 0.00 60.65 57.82 1nqo h LYS 45 Cb 0.53 0.01 -0.33 0.00 0.08 0.00 0.00 32.23 32.52 1nqo h LYS 45 CO 0.03 0.99 -0.78 0.71 -0.57 0.00 0.00 179.45 179.83 1nqo s TYR 46 N -4.41 3.04 -0.18 -1.35 2.02 -0.73 -2.01 117.35 113.73 1nqo s TYR 46 Ca -0.12 -1.70 -0.00 0.00 -0.37 0.00 0.00 57.07 54.88 1nqo s TYR 46 Cb 0.09 -2.01 0.01 0.00 -0.40 0.00 0.00 41.96 39.65 1nqo s TYR 46 CO 0.83 -0.77 -0.16 0.34 -1.57 0.00 0.00 175.55 174.22 1nqo s ASP 47 N 1.28 3.47 0.63 2.29 -1.08 -1.14 -4.62 116.67 117.50 1nqo s ASP 47 Ca -0.00 -0.56 0.41 0.00 -0.52 0.00 0.00 52.55 51.88 1nqo s ASP 47 Cb -0.16 -1.55 2.12 0.00 -1.46 0.00 0.00 42.92 41.87 1nqo s ASP 47 CO -0.06 0.02 2.26 0.28 0.52 0.00 0.00 175.17 178.19 1nqo h SER 48 N 7.80 0.00 0.00 -0.34 0.02 -1.93 -0.79 113.55 118.31 1nqo h SER 48 Ca -0.41 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.08 1nqo h SER 48 Cb 1.16 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.63 1nqo h SER 48 CO 0.61 0.00 -2.51 0.52 -1.14 0.00 0.00 176.83 174.31 1nqo n VAL 49 N -3.11 1.48 -0.12 2.27 0.31 -1.26 -4.70 118.33 113.20 1nqo n VAL 49 Ca -0.02 -0.38 0.10 0.00 -0.01 0.00 0.00 64.34 64.03 1nqo n VAL 49 Cb 0.14 -1.85 0.25 0.00 -0.91 0.00 0.00 33.84 31.46 1nqo n VAL 49 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1nqo n HIS 50 N -4.18 0.71 -3.82 3.52 8.25 -1.23 -5.02 115.22 113.45 1nqo n HIS 50 Ca -0.53 -0.41 0.00 0.00 -0.26 0.00 0.00 57.72 56.52 1nqo n HIS 50 Cb 0.88 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.99 1nqo n HIS 50 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nqo n GLY 51 N 1.34 -2.00 3.73 -1.41 0.00 -0.30 -4.86 105.19 101.69 1nqo n GLY 51 Ca 0.20 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 1nqo n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nqo s ARG 52 N -0.08 4.38 0.13 1.61 0.52 -1.26 -2.90 118.95 121.35 1nqo s ARG 52 Ca 0.00 2.05 -0.31 0.00 -0.52 0.00 0.00 55.73 56.95 1nqo s ARG 52 Cb 0.00 -3.21 -0.09 0.00 0.52 0.00 0.00 34.95 32.17 1nqo s ARG 52 CO 0.00 -0.29 1.51 -1.17 0.02 0.00 0.00 175.30 175.36 1nqo s LEU 53 N 0.17 4.37 -1.30 2.53 2.96 -0.85 -4.89 118.68 121.68 1nqo s LEU 53 Ca 0.58 2.48 -0.13 0.00 -0.22 0.00 0.00 54.13 56.84 1nqo s LEU 53 Cb -0.36 -3.59 0.12 0.00 0.50 0.00 0.00 46.19 42.86 1nqo s LEU 53 CO 0.36 -0.76 1.77 -0.67 -1.32 0.00 0.00 176.35 175.73 1nqo n ASP 54 N 4.16 4.88 -3.59 3.68 2.03 -1.26 -4.83 116.55 121.61 1nqo n ASP 54 Ca 0.13 -2.98 -0.07 0.00 0.52 0.00 0.00 54.79 52.39 1nqo n ASP 54 Cb 0.40 -1.60 -0.04 0.00 -0.72 0.00 0.00 41.12 39.16 1nqo n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nqo s ALA 55 N 2.09 -1.99 -0.31 -1.67 0.00 -1.26 -5.13 121.76 113.48 1nqo s ALA 55 Ca 0.45 1.65 -0.29 0.00 0.00 0.00 0.00 51.96 53.77 1nqo s ALA 55 Cb 0.05 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.35 1nqo s ALA 55 CO 0.00 -0.33 1.19 -2.00 0.00 0.00 0.00 175.76 174.62 1nqo s GLU 56 N -1.30 3.99 -0.07 0.00 2.12 -1.26 -4.93 118.70 117.25 1nqo s GLU 56 Ca 0.03 1.15 0.04 0.00 0.36 0.00 0.00 54.97 56.55 1nqo s GLU 56 Cb -0.01 -3.81 -0.00 0.00 0.26 0.00 0.00 34.13 30.57 1nqo s GLU 56 CO -0.02 -1.01 -0.21 0.08 -0.54 0.00 0.00 175.26 173.56 1nqo s VAL 57 N 4.00 1.77 0.37 3.70 1.01 -1.26 -0.42 120.40 129.58 1nqo s VAL 57 Ca 0.51 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1nqo s VAL 57 Cb -0.14 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.74 1nqo s VAL 57 CO 0.20 0.50 0.63 -1.54 0.00 0.00 0.00 175.10 174.88 1nqo n SER 58 N 3.33 -1.80 -4.17 3.32 3.41 -0.40 -5.01 113.62 112.29 1nqo n SER 58 Ca -0.19 -2.77 -0.27 0.00 -0.26 0.00 0.00 58.87 55.38 1nqo n SER 58 Cb 0.52 3.15 -0.16 0.00 -0.26 0.00 0.00 64.21 67.47 1nqo n SER 58 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1nqo s VAL 59 N -2.50 1.55 -0.26 -3.33 1.01 -1.26 -0.75 120.40 114.85 1nqo s VAL 59 Ca 0.23 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1nqo s VAL 59 Cb -0.03 -1.31 0.07 0.00 0.00 0.00 0.00 36.38 35.11 1nqo s VAL 59 CO 0.17 0.44 -0.04 0.21 0.00 0.00 0.00 175.10 175.88 1nqo s ASN 60 N -0.13 4.16 1.59 3.32 3.04 -0.17 -4.93 114.94 121.81 1nqo s ASN 60 Ca -0.00 -1.43 0.00 0.00 0.04 0.00 0.00 52.86 51.47 1nqo s ASN 60 Cb -0.11 -1.32 0.00 0.00 -1.54 0.00 0.00 41.25 38.29 1nqo s ASN 60 CO 0.02 -0.26 0.00 0.61 -3.04 0.00 0.00 177.10 174.42 1nqo n GLY 61 N 4.56 3.45 0.87 1.21 0.00 -1.26 -1.51 105.19 112.51 1nqo n GLY 61 Ca -0.09 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 45.89 1nqo n GLY 61 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nqo n ASN 62 N 8.85 3.30 -4.69 1.61 4.13 -1.26 -4.97 115.26 122.23 1nqo n ASN 62 Ca 0.00 -2.05 -0.24 0.00 1.68 0.00 0.00 54.58 53.97 1nqo n ASN 62 Cb 0.00 -0.32 -0.08 0.00 -1.54 0.00 0.00 39.78 37.84 1nqo n ASN 62 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1nqo s ASN 63 N -1.03 4.39 0.09 6.41 0.02 -0.57 -4.19 114.94 120.06 1nqo s ASN 63 Ca 0.32 -0.96 -0.03 0.00 -1.02 0.00 0.00 52.86 51.17 1nqo s ASN 63 Cb 0.17 -0.57 -0.05 0.00 0.02 0.00 0.00 41.25 40.82 1nqo s ASN 63 CO 0.20 -0.34 0.29 -0.76 0.02 0.00 0.00 177.10 176.51 1nqo s LEU 64 N -3.81 4.32 -0.22 0.60 1.43 -0.08 -1.00 118.68 119.92 1nqo s LEU 64 Ca 0.37 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 1nqo s LEU 64 Cb 0.01 -3.07 0.06 0.00 0.03 0.00 0.00 46.19 43.22 1nqo s LEU 64 CO 0.21 0.13 -0.04 -0.69 0.23 0.00 0.00 176.35 176.19 1nqo s VAL 65 N -1.54 1.36 -0.25 -1.59 1.01 0.07 0.82 120.40 120.27 1nqo s VAL 65 Ca 0.36 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1nqo s VAL 65 Cb -0.13 -1.65 0.04 0.00 0.00 0.00 0.00 36.38 34.64 1nqo s VAL 65 CO 0.24 -0.10 -0.09 -0.69 0.00 0.00 0.00 175.10 174.47 1nqo s VAL 66 N 1.48 2.54 -1.28 2.92 1.01 -0.10 -1.28 120.40 125.69 1nqo s VAL 66 Ca -0.05 -1.28 -0.04 0.00 0.00 0.00 0.00 61.98 60.62 1nqo s VAL 66 Cb -0.18 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 1nqo s VAL 66 CO -0.07 0.12 0.68 0.59 0.00 0.00 0.00 175.10 176.43 1nqo n ASN 67 N 4.57 -1.99 0.00 3.32 3.02 0.44 -2.00 115.26 122.62 1nqo n ASN 67 Ca -0.16 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1nqo n ASN 67 Cb 0.45 -3.87 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1nqo n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nqo n GLY 68 N -1.63 2.47 3.80 7.41 0.00 -1.26 -5.00 105.19 110.98 1nqo n GLY 68 Ca -0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 1nqo n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nqo s LYS 69 N 0.00 3.77 0.03 1.61 1.02 -0.85 -5.07 119.74 120.25 1nqo s LYS 69 Ca 0.00 -0.19 -0.21 0.00 0.02 0.00 0.00 55.97 55.59 1nqo s LYS 69 Cb 0.00 -3.28 -0.06 0.00 -0.52 0.00 0.00 37.83 33.98 1nqo s LYS 69 CO 0.00 0.55 0.63 -2.00 -0.92 0.00 0.00 175.35 173.61 1nqo s GLU 70 N -0.37 4.34 -0.17 1.68 2.12 -1.26 -0.92 118.70 124.12 1nqo s GLU 70 Ca 0.11 0.82 0.01 0.00 0.36 0.00 0.00 54.97 56.27 1nqo s GLU 70 Cb -0.12 -3.32 0.01 0.00 0.26 0.00 0.00 34.13 30.97 1nqo s GLU 70 CO 0.01 0.42 -0.19 0.42 -0.54 0.00 0.00 175.26 175.38 1nqo s ILE 71 N -0.40 2.23 0.10 -3.70 -1.09 0.24 -4.90 121.20 113.69 1nqo s ILE 71 Ca 0.32 -0.90 -0.31 0.00 -2.23 0.00 0.00 60.65 57.54 1nqo s ILE 71 Cb -0.19 -1.93 -0.08 0.00 -1.58 0.00 0.00 42.46 38.68 1nqo s ILE 71 CO 0.19 0.53 1.39 -0.63 -1.23 0.00 0.00 174.94 175.19 1nqo s ILE 72 N 1.15 3.36 -0.21 2.92 1.01 -0.38 -0.90 121.20 128.14 1nqo s ILE 72 Ca 0.01 0.96 -0.08 0.00 0.00 0.00 0.00 60.65 61.55 1nqo s ILE 72 Cb -0.14 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 1nqo s ILE 72 CO -0.08 0.07 0.08 -0.69 0.00 0.00 0.00 174.94 174.31 1nqo s VAL 73 N 1.23 4.67 0.22 2.92 1.01 -1.26 -0.75 120.40 128.45 1nqo s VAL 73 Ca 0.64 -0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.65 1nqo s VAL 73 Cb -0.36 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1nqo s VAL 73 CO 0.30 0.40 -0.07 -0.54 0.00 0.00 0.00 175.10 175.20 1nqo s LYS 74 N 0.89 2.13 -0.37 2.72 1.02 0.17 -4.89 119.74 121.41 1nqo s LYS 74 Ca 0.04 -1.37 0.13 0.00 0.02 0.00 0.00 55.97 54.79 1nqo s LYS 74 Cb -0.14 -2.13 0.39 0.00 -0.52 0.00 0.00 37.83 35.44 1nqo s LYS 74 CO 0.03 0.40 0.84 0.00 -0.92 0.00 0.00 175.35 175.69 1nqo n ALA 75 N -0.41 2.83 -2.93 5.17 0.00 -1.26 -1.76 120.51 122.15 1nqo n ALA 75 Ca -0.08 -3.44 -0.40 0.00 0.00 0.00 0.00 53.44 49.52 1nqo n ALA 75 Cb 0.57 -0.90 -0.11 0.00 0.00 0.00 0.00 19.45 19.01 1nqo n ALA 75 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1nqo s GLU 76 N -2.80 2.81 0.37 0.00 0.41 -1.25 -4.92 118.70 113.32 1nqo s GLU 76 Ca 0.36 -1.08 0.10 0.00 -0.41 0.00 0.00 54.97 53.95 1nqo s GLU 76 Cb 0.39 -3.65 0.72 0.00 -1.78 0.00 0.00 34.13 29.81 1nqo s GLU 76 CO -0.05 -0.67 1.86 -0.09 -0.49 0.00 0.00 175.26 175.82 1nqo h ARG 77 N 8.38 0.15 -4.92 1.61 2.43 -1.98 -3.40 114.38 116.64 1nqo h ARG 77 Ca -0.25 -0.05 -0.66 0.00 -0.81 0.00 0.00 59.98 58.21 1nqo h ARG 77 Cb 1.10 -0.01 -0.17 0.00 -0.42 0.00 0.00 29.97 30.46 1nqo h ARG 77 CO 0.65 0.40 -0.33 0.34 -1.51 0.00 0.00 179.97 179.52 1nqo s ASP 78 N -6.91 6.16 0.55 -3.80 -1.08 -1.26 -4.97 116.67 105.36 1nqo s ASP 78 Ca -0.04 -0.23 0.27 0.00 -0.52 0.00 0.00 52.55 52.03 1nqo s ASP 78 Cb 0.15 -2.18 1.45 0.00 -1.46 0.00 0.00 42.92 40.88 1nqo s ASP 78 CO 0.73 -0.30 1.97 -0.65 0.52 0.00 0.00 175.17 177.44 1nqo h PRO 79 N 8.45 0.00 0.00 4.34 0.11 -1.94 -1.41 132.00 141.55 1nqo h PRO 79 Ca -0.30 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 1nqo h PRO 79 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1nqo h PRO 79 CO 0.67 0.00 -0.06 0.93 -0.21 0.00 0.00 178.00 179.34 1nqo h GLU 80 N 0.00 0.00 -0.28 1.05 5.08 -1.93 -2.70 114.58 115.79 1nqo h GLU 80 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1nqo h GLU 80 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1nqo h GLU 80 CO -0.00 0.06 0.00 0.09 -1.00 0.00 0.00 179.01 178.15 1nqo n ASN 81 N -3.29 2.41 0.22 1.42 5.03 -0.53 -4.43 115.26 116.10 1nqo n ASN 81 Ca -0.01 -1.85 0.10 0.00 0.87 0.00 0.00 54.58 53.69 1nqo n ASN 81 Cb 0.24 -0.18 0.44 0.00 -1.02 0.00 0.00 39.78 39.26 1nqo n ASN 81 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1nqo h LEU 82 N 3.09 0.00 -1.82 3.41 3.38 -1.62 -3.48 115.31 118.28 1nqo h LEU 82 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 1nqo h LEU 82 Cb 0.68 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.35 1nqo h LEU 82 CO 0.00 0.23 -0.89 0.00 0.09 0.00 0.00 178.44 177.87 1nqo n ALA 83 N -2.22 -1.92 -0.22 1.53 0.00 -1.26 -4.84 120.51 111.59 1nqo n ALA 83 Ca 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 53.44 53.21 1nqo n ALA 83 Cb 0.44 -1.68 0.26 0.00 0.00 0.00 0.00 19.45 18.47 1nqo n ALA 83 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1nqo h TRP 84 N -1.80 0.92 -0.61 0.00 -0.00 -1.46 -2.32 115.95 110.68 1nqo h TRP 84 Ca -0.63 0.02 0.07 0.00 -0.00 0.00 0.00 58.89 58.35 1nqo h TRP 84 Cb 1.38 -0.31 -0.04 0.00 -0.00 0.00 0.00 29.16 30.19 1nqo h TRP 84 CO 0.51 0.56 0.41 0.78 -0.00 0.00 0.00 178.44 180.70 1nqo h GLY 85 N 0.98 0.72 2.00 1.49 0.00 -1.40 -1.89 103.07 104.97 1nqo h GLY 85 Ca 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 1nqo h GLY 85 CO -0.07 0.16 -0.08 0.83 0.00 0.00 0.00 176.54 177.38 1nqo h GLU 86 N 0.56 0.00 -0.19 4.80 5.08 -1.68 -2.86 114.58 120.29 1nqo h GLU 86 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1nqo h GLU 86 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1nqo h GLU 86 CO -0.08 0.08 0.00 0.44 -1.00 0.00 0.00 179.01 178.45 1nqo n ILE 87 N -3.35 2.02 -1.32 3.13 -5.35 -0.76 -4.98 119.36 108.75 1nqo n ILE 87 Ca -0.01 -1.87 -0.11 0.00 -0.27 0.00 0.00 62.75 60.50 1nqo n ILE 87 Cb 0.26 -0.15 -0.05 0.00 -1.74 0.00 0.00 39.64 37.96 1nqo n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nqo n GLY 88 N -0.66 1.21 3.65 3.28 0.00 -1.08 -4.97 105.19 106.62 1nqo n GLY 88 Ca 0.18 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1nqo n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nqo s VAL 89 N -2.36 4.05 -0.14 1.61 1.01 -0.90 -4.57 120.40 119.11 1nqo s VAL 89 Ca 0.00 1.23 -0.01 0.00 0.00 0.00 0.00 61.98 63.21 1nqo s VAL 89 Cb 0.00 -3.93 -0.24 0.00 0.00 0.00 0.00 36.38 32.21 1nqo s VAL 89 CO 0.00 -0.26 0.27 0.47 0.00 0.00 0.00 175.10 175.58 1nqo n ASP 90 N 7.32 1.80 -4.21 3.32 8.00 -0.80 -4.14 116.55 127.84 1nqo n ASP 90 Ca 0.15 0.16 -0.30 0.00 0.71 0.00 0.00 54.79 55.51 1nqo n ASP 90 Cb 0.45 -0.55 -0.17 0.00 -0.02 0.00 0.00 41.12 40.84 1nqo n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1nqo s ILE 91 N -2.55 1.87 -0.16 0.53 1.01 -1.06 -0.41 121.20 120.43 1nqo s ILE 91 Ca -0.22 -0.94 -0.00 0.00 0.00 0.00 0.00 60.65 59.49 1nqo s ILE 91 Cb 0.07 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.93 1nqo s ILE 91 CO 0.75 0.52 -0.13 -0.69 0.00 0.00 0.00 174.94 175.38 1nqo s VAL 92 N 0.12 2.84 -0.51 2.92 1.01 -0.37 -1.04 120.40 125.38 1nqo s VAL 92 Ca -0.10 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 60.96 1nqo s VAL 92 Cb -0.15 -2.21 0.05 0.00 0.00 0.00 0.00 36.38 34.07 1nqo s VAL 92 CO 0.05 0.51 0.73 -0.69 0.00 0.00 0.00 175.10 175.70 1nqo s VAL 93 N 0.78 4.72 -0.77 2.92 1.01 0.22 -0.41 120.40 128.87 1nqo s VAL 93 Ca -0.05 -0.15 -0.23 0.00 0.00 0.00 0.00 61.98 61.55 1nqo s VAL 93 Cb -0.15 -4.36 0.07 0.00 0.00 0.00 0.00 36.38 31.94 1nqo s VAL 93 CO 0.01 -0.87 1.10 -0.70 0.00 0.00 0.00 175.10 174.64 1nqo s GLU 94 N 3.07 3.27 -0.20 2.72 2.56 0.19 -1.18 118.70 129.14 1nqo s GLU 94 Ca 0.21 -0.95 0.14 0.00 0.00 0.00 0.00 54.97 54.37 1nqo s GLU 94 Cb -0.16 -4.48 0.45 0.00 2.00 0.00 0.00 34.13 31.93 1nqo s GLU 94 CO 0.15 -1.91 1.19 -1.13 -0.56 0.00 0.00 175.26 173.00 1nqo n SER 95 N 7.88 2.44 0.05 -1.70 3.41 0.13 -1.42 113.62 124.40 1nqo n SER 95 Ca 0.07 -3.23 -0.05 0.00 -0.26 0.00 0.00 58.87 55.39 1nqo n SER 95 Cb 0.47 -0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.90 1nqo n SER 95 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1nqo h THR 96 N 3.13 1.19 0.00 6.66 1.35 -1.72 -3.43 112.91 120.09 1nqo h THR 96 Ca 0.04 -2.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.04 1nqo h THR 96 Cb 1.36 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 70.34 1nqo h THR 96 CO 0.25 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.81 1nqo n GLY 97 N 1.39 0.98 0.02 5.82 0.00 -1.26 -4.90 105.19 107.25 1nqo n GLY 97 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1nqo n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nqo n ARG 98 N -2.00 0.43 -2.49 1.61 5.12 -1.26 -4.61 116.66 113.46 1nqo n ARG 98 Ca 0.00 -0.08 -0.26 0.00 -1.93 0.00 0.00 57.85 55.58 1nqo n ARG 98 Cb 0.00 -1.56 0.00 0.00 -1.16 0.00 0.00 32.46 29.74 1nqo n ARG 98 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1nqo n PHE 99 N -2.07 3.23 0.80 -1.55 3.72 -1.26 -4.75 117.46 115.59 1nqo n PHE 99 Ca -0.01 -3.08 0.13 0.00 -0.05 0.00 0.00 57.45 54.45 1nqo n PHE 99 Cb 0.49 -0.11 0.51 0.00 -0.94 0.00 0.00 39.48 39.43 1nqo n PHE 99 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1nqo n THR 100 N -0.45 0.31 -2.85 4.37 -2.24 -1.26 -3.56 114.28 108.59 1nqo n THR 100 Ca 0.37 -0.13 -0.37 0.00 -2.27 0.00 0.00 64.05 61.64 1nqo n THR 100 Cb 0.68 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.29 1nqo n THR 100 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1nqo s LYS 101 N -3.05 4.54 0.16 -0.78 1.02 -1.26 -2.27 119.74 118.09 1nqo s LYS 101 Ca 0.12 1.24 -0.19 0.00 0.02 0.00 0.00 55.97 57.16 1nqo s LYS 101 Cb 0.16 -2.87 0.07 0.00 -0.52 0.00 0.00 37.83 34.66 1nqo s LYS 101 CO 0.56 0.34 1.65 -0.09 -0.92 0.00 0.00 175.35 176.88 1nqo h ARG 102 N 3.35 -0.10 -0.87 1.68 2.43 -1.69 -1.30 114.38 117.88 1nqo h ARG 102 Ca -0.47 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 58.88 1nqo h ARG 102 Cb 1.19 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.70 1nqo h ARG 102 CO 0.65 -0.07 0.57 1.05 -1.51 0.00 0.00 179.97 180.67 1nqo h GLU 103 N -0.10 0.48 0.10 0.20 4.11 -1.94 0.27 114.58 117.71 1nqo h GLU 103 Ca 0.17 -0.03 -0.13 0.00 0.07 0.00 0.00 59.36 59.44 1nqo h GLU 103 Cb 0.37 -0.11 0.02 0.00 0.50 0.00 0.00 28.75 29.52 1nqo h GLU 103 CO -0.41 0.32 -0.59 -0.44 0.07 0.00 0.00 179.01 177.96 1nqo h ASP 104 N 0.49 0.34 0.09 3.06 3.32 -1.64 -3.34 116.42 118.75 1nqo h ASP 104 Ca 0.45 -0.97 -0.10 0.00 0.02 0.00 0.00 57.03 56.43 1nqo h ASP 104 Cb 0.98 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1nqo h ASP 104 CO -0.18 1.28 -0.35 0.00 -1.72 0.00 0.00 179.24 178.27 1nqo h ALA 105 N 0.06 1.09 -0.03 3.45 0.00 -0.82 -2.75 119.26 120.25 1nqo h ALA 105 Ca -0.10 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.43 1nqo h ALA 105 Cb 1.46 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1nqo h ALA 105 CO 0.11 0.58 0.05 0.00 0.00 0.00 0.00 179.25 179.99 1nqo h ALA 106 N 1.33 1.35 0.00 0.00 0.00 -0.60 -1.45 119.26 119.89 1nqo h ALA 106 Ca 0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1nqo h ALA 106 Cb 0.76 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1nqo h ALA 106 CO 0.06 -0.06 -0.02 0.87 0.00 0.00 0.00 179.25 180.09 1nqo h LYS 107 N 0.00 0.00 -0.08 0.00 1.57 -1.60 0.33 116.57 116.78 1nqo h LYS 107 Ca 0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1nqo h LYS 107 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1nqo h LYS 107 CO -0.00 0.02 -0.10 0.45 -0.57 0.00 0.00 179.45 179.25 1nqo h HIS 108 N 0.00 0.13 -0.03 -1.35 3.86 -1.45 -0.23 115.15 116.08 1nqo h HIS 108 Ca -0.00 -0.01 -0.24 0.00 -1.16 0.00 0.00 60.37 58.96 1nqo h HIS 108 Cb 0.04 -0.04 0.01 0.00 1.06 0.00 0.00 27.41 28.48 1nqo h HIS 108 CO 0.00 0.23 -0.95 -0.07 0.86 0.00 0.00 177.93 178.01 1nqo h LEU 109 N 0.12 0.74 -1.44 2.43 3.38 -1.10 -1.71 115.31 117.73 1nqo h LEU 109 Ca 0.03 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.39 1nqo h LEU 109 Cb 0.27 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1nqo h LEU 109 CO 0.02 1.37 -0.02 -0.33 0.09 0.00 0.00 178.44 179.56 1nqo h GLU 110 N 0.34 0.34 -0.07 1.13 5.08 -0.79 -2.03 114.58 118.59 1nqo h GLU 110 Ca -0.09 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1nqo h GLU 110 Cb 1.59 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1nqo h GLU 110 CO 0.18 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.57 1nqo n ALA 111 N -2.49 2.53 0.00 3.43 0.00 -0.17 -4.89 120.51 118.92 1nqo n ALA 111 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1nqo n ALA 111 Cb 0.21 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1nqo n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nqo n GLY 112 N 0.76 1.83 3.80 0.00 0.00 -0.76 -1.13 105.19 109.69 1nqo n GLY 112 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1nqo n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqo s ALA 113 N -2.21 2.57 -0.20 4.61 0.00 -0.65 -3.98 121.76 121.90 1nqo s ALA 113 Ca 0.00 0.24 0.14 0.00 0.00 0.00 0.00 51.96 52.34 1nqo s ALA 113 Cb 0.00 -3.22 -0.23 0.00 0.00 0.00 0.00 23.12 19.66 1nqo s ALA 113 CO 0.00 -1.27 0.07 1.63 0.00 0.00 0.00 175.76 176.18 1nqo n LYS 114 N -2.93 0.68 -3.99 0.00 4.76 0.45 -4.38 118.16 112.75 1nqo n LYS 114 Ca 0.08 0.05 -0.10 0.00 -2.87 0.00 0.00 58.31 55.47 1nqo n LYS 114 Cb 0.53 -1.54 -0.11 0.00 -1.84 0.00 0.00 35.03 32.07 1nqo n LYS 114 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1nqo s LYS 115 N -2.50 0.34 -0.07 1.97 -0.14 -0.06 -4.86 119.74 114.42 1nqo s LYS 115 Ca -0.14 -0.62 0.02 0.00 -1.36 0.00 0.00 55.97 53.86 1nqo s LYS 115 Cb 0.07 0.04 0.02 0.00 -1.68 0.00 0.00 37.83 36.27 1nqo s LYS 115 CO 0.79 -0.03 -0.10 0.08 -0.76 0.00 0.00 175.35 175.32 1nqo s VAL 116 N -1.42 1.04 -0.39 3.17 1.01 -0.34 -1.23 120.40 122.24 1nqo s VAL 116 Ca -0.15 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1nqo s VAL 116 Cb -0.10 -0.98 0.07 0.00 0.00 0.00 0.00 36.38 35.36 1nqo s VAL 116 CO -0.01 0.34 0.20 -0.63 0.00 0.00 0.00 175.10 175.00 1nqo s ILE 117 N 0.93 3.99 -0.20 2.22 1.01 0.46 -0.64 121.20 128.96 1nqo s ILE 117 Ca -0.10 -1.35 -0.29 0.00 0.00 0.00 0.00 60.65 58.91 1nqo s ILE 117 Cb -0.15 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 38.93 1nqo s ILE 117 CO 0.01 -0.40 1.04 -0.63 0.00 0.00 0.00 174.94 174.95 1nqo s ILE 118 N 1.39 4.70 0.00 2.92 1.01 0.18 -0.63 121.20 130.76 1nqo s ILE 118 Ca 0.02 2.03 -0.02 0.00 0.00 0.00 0.00 60.65 62.67 1nqo s ILE 118 Cb -0.22 -4.31 -0.11 0.00 0.01 0.00 0.00 42.46 37.84 1nqo s ILE 118 CO 0.02 -0.14 2.53 -1.54 0.00 0.00 0.00 174.94 175.81 1nqo n SER 119 N 6.06 4.96 -3.67 3.58 3.41 -0.51 -1.49 113.62 125.96 1nqo n SER 119 Ca 0.11 -2.36 0.04 0.00 -0.26 0.00 0.00 58.87 56.40 1nqo n SER 119 Cb 0.47 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 1nqo n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nqo s ALA 120 N 0.56 -2.54 0.49 7.33 0.00 -1.17 -4.93 121.76 121.50 1nqo s ALA 120 Ca 0.27 0.73 -0.23 0.00 0.00 0.00 0.00 51.96 52.72 1nqo s ALA 120 Cb 0.13 0.42 -0.07 0.00 0.00 0.00 0.00 23.12 23.59 1nqo s ALA 120 CO 0.00 -1.09 1.28 -2.30 0.00 0.00 0.00 175.76 173.66 1nqo n PRO 121 N -0.61 1.76 -4.66 0.00 -0.02 -1.23 -4.08 135.00 126.15 1nqo n PRO 121 Ca -0.06 0.64 -0.30 0.00 -2.02 0.00 0.00 63.50 61.76 1nqo n PRO 121 Cb 0.62 -2.45 -0.08 0.00 -0.02 0.00 0.00 33.50 31.57 1nqo n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nqo s ALA 122 N -1.27 3.61 -0.10 3.55 0.00 -1.26 -4.89 121.76 121.39 1nqo s ALA 122 Ca 0.67 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1nqo s ALA 122 Cb -0.46 0.32 0.02 0.00 0.00 0.00 0.00 23.12 23.00 1nqo s ALA 122 CO 0.53 -0.15 -0.12 0.15 0.00 0.00 0.00 175.76 176.18 1nqo s LYS 122 N -3.81 1.86 -1.41 0.00 3.01 -0.96 -4.76 119.74 113.68 1nqo s LYS 122 Ca 0.14 -0.42 0.00 0.00 -1.01 0.00 0.00 55.97 54.68 1nqo s LYS 122 Cb 0.02 -1.68 0.00 0.00 -1.01 0.00 0.00 37.83 35.16 1nqo s LYS 122 CO 0.08 -0.12 0.00 0.09 0.51 0.00 0.00 175.35 175.91 1nqo n ASN 123 N 4.39 -4.59 -4.74 2.83 3.02 -1.26 -1.98 115.26 112.93 1nqo n ASN 123 Ca -0.18 0.21 -0.30 0.00 -0.03 0.00 0.00 54.58 54.29 1nqo n ASN 123 Cb 0.51 -3.51 0.13 0.00 -0.61 0.00 0.00 39.78 36.29 1nqo n ASN 123 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1nqo s GLU 124 N -3.80 1.48 0.14 3.52 1.03 -1.26 -4.75 118.70 115.06 1nqo s GLU 124 Ca 0.00 0.78 -0.08 0.00 0.03 0.00 0.00 54.97 55.70 1nqo s GLU 124 Cb 0.00 -1.84 -0.04 0.00 -0.80 0.00 0.00 34.13 31.45 1nqo s GLU 124 CO 0.00 -2.08 1.39 -0.44 -1.33 0.00 0.00 175.26 172.81 1nqo h ASP 125 N -1.43 0.79 -4.32 0.83 3.32 -1.39 -3.47 116.42 110.75 1nqo h ASP 125 Ca -0.49 -0.48 0.02 0.00 0.02 0.00 0.00 57.03 56.10 1nqo h ASP 125 Cb 1.28 -0.23 -0.22 0.00 0.22 0.00 0.00 39.33 40.38 1nqo h ASP 125 CO 0.56 1.25 0.37 -0.51 -1.72 0.00 0.00 179.24 179.19 1nqo s ILE 126 N -3.83 0.00 -0.14 0.35 2.07 -1.23 -4.97 121.20 113.45 1nqo s ILE 126 Ca -0.09 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.14 1nqo s ILE 126 Cb 0.10 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.67 1nqo s ILE 126 CO 0.88 0.00 -0.09 -0.89 -1.91 0.00 0.00 174.94 172.93 1nqo s THR 127 N -0.85 3.44 0.00 4.00 2.01 -1.26 -1.28 115.64 121.70 1nqo s THR 127 Ca -0.04 -0.52 0.06 0.00 0.31 0.00 0.00 61.69 61.49 1nqo s THR 127 Cb -0.01 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 1nqo s THR 127 CO 0.04 0.51 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.67 1nqo s ILE 128 N 0.36 1.40 -0.25 1.82 1.01 0.44 -4.66 121.20 121.31 1nqo s ILE 128 Ca -0.08 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 59.74 1nqo s ILE 128 Cb -0.15 -1.18 0.06 0.00 0.01 0.00 0.00 42.46 41.19 1nqo s ILE 128 CO 0.04 0.31 -0.10 -0.69 0.00 0.00 0.00 174.94 174.50 1nqo s VAL 129 N -0.53 2.04 0.04 2.92 1.01 -1.26 -4.15 120.40 120.46 1nqo s VAL 129 Ca 0.06 -1.54 -0.36 0.00 0.00 0.00 0.00 61.98 60.14 1nqo s VAL 129 Cb -0.07 -2.17 -0.15 0.00 0.00 0.00 0.00 36.38 33.99 1nqo s VAL 129 CO 0.00 -0.03 1.58 0.80 0.00 0.00 0.00 175.10 177.44 1nqo n MET 130 N 4.48 1.71 -0.10 2.72 1.56 -1.26 -0.48 117.12 125.74 1nqo n MET 130 Ca -0.14 0.62 0.00 0.00 -0.27 0.00 0.00 57.70 57.91 1nqo n MET 130 Cb 0.43 -2.35 0.00 0.00 2.15 0.00 0.00 33.22 33.44 1nqo n MET 130 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1nqo n GLY 131 N 3.40 0.77 0.65 -5.12 0.00 -1.26 -4.86 105.19 98.78 1nqo n GLY 131 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 1nqo n GLY 131 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nqo n VAL 132 N -2.00 0.04 -2.09 1.61 0.31 0.36 -4.97 118.33 111.59 1nqo n VAL 132 Ca 0.00 -0.01 -0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1nqo n VAL 132 Cb 0.00 -1.19 -0.01 0.00 -0.91 0.00 0.00 33.84 31.74 1nqo n VAL 132 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1nqo n ASN 133 N -2.87 0.05 0.33 4.52 6.94 -0.92 -4.88 115.26 118.43 1nqo n ASN 133 Ca -0.01 -1.71 0.22 0.00 -0.02 0.00 0.00 54.58 53.05 1nqo n ASN 133 Cb 0.51 -0.09 1.13 0.00 -2.36 0.00 0.00 39.78 38.97 1nqo n ASN 133 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1nqo h GLN 134 N 0.19 0.00 0.00 -3.83 -0.00 -1.94 -0.20 115.11 109.32 1nqo h GLN 134 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.53 1nqo h GLN 134 Cb 1.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.86 1nqo h GLN 134 CO -0.02 0.00 0.00 0.38 -0.00 0.00 0.00 178.83 179.19 1nqo h ASP 135 N 0.00 0.00 0.92 0.06 2.03 -1.95 -1.19 116.42 116.29 1nqo h ASP 135 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1nqo h ASP 135 Cb 0.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.57 1nqo h ASP 135 CO 0.00 0.00 -0.05 0.29 -1.03 0.00 0.00 179.24 178.45 1nqo n LYS 136 N -2.61 0.03 -1.71 4.15 4.76 -0.09 -4.84 118.16 117.85 1nqo n LYS 136 Ca 0.00 -0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.02 1nqo n LYS 136 Cb 0.19 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.85 1nqo n LYS 136 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1nqo s TYR 137 N -2.97 1.96 -0.33 2.13 5.04 -0.45 -4.97 117.35 117.76 1nqo s TYR 137 Ca 0.15 -0.11 -0.01 0.00 -2.44 0.00 0.00 57.07 54.66 1nqo s TYR 137 Cb 0.19 -4.19 0.07 0.00 0.35 0.00 0.00 41.96 38.38 1nqo s TYR 137 CO 0.54 -4.99 0.05 0.34 -1.34 0.00 0.00 175.55 170.15 1nqo s ASP 138 N 3.08 4.95 0.50 4.32 -1.08 -1.26 -5.00 116.67 122.18 1nqo s ASP 138 Ca 0.82 -1.59 0.24 0.00 -0.52 0.00 0.00 52.55 51.50 1nqo s ASP 138 Cb -0.45 -1.72 1.30 0.00 -1.46 0.00 0.00 42.92 40.59 1nqo s ASP 138 CO 0.37 -0.35 1.94 1.55 0.52 0.00 0.00 175.17 179.20 1nqo h PRO 138 N 7.95 0.13 0.03 4.34 0.13 -1.89 0.21 132.00 142.91 1nqo h PRO 138 Ca -0.17 -0.01 -0.22 0.00 -0.87 0.00 0.00 66.00 64.74 1nqo h PRO 138 Cb 1.05 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1nqo h PRO 138 CO 0.57 0.09 -1.00 -0.22 -0.23 0.00 0.00 178.00 177.21 1nqo h LYS 139 N 0.14 0.16 0.00 0.86 3.64 -1.94 -3.38 116.57 116.05 1nqo h LYS 139 Ca 0.34 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1nqo h LYS 139 Cb 1.15 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1nqo h LYS 139 CO -0.05 1.03 -1.38 0.00 -2.27 0.00 0.00 179.45 176.78 1nqo n ALA 140 N -2.45 2.85 -2.87 5.00 0.00 -0.82 -4.93 120.51 117.29 1nqo n ALA 140 Ca -0.04 -0.35 -0.41 0.00 0.00 0.00 0.00 53.44 52.65 1nqo n ALA 140 Cb 0.90 -0.48 -0.11 0.00 0.00 0.00 0.00 19.45 19.75 1nqo n ALA 140 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1nqo s HIS 141 N -2.80 3.25 -0.01 0.00 3.76 0.67 -4.87 115.29 115.30 1nqo s HIS 141 Ca -0.02 -1.03 0.01 0.00 -0.15 0.00 0.00 55.06 53.86 1nqo s HIS 141 Cb 0.09 -2.51 -0.01 0.00 1.11 0.00 0.00 32.58 31.26 1nqo s HIS 141 CO 0.58 -0.68 0.01 0.72 -0.85 0.00 0.00 174.74 174.51 1nqo n HIS 142 N 5.00 0.00 -3.81 1.40 8.25 -1.26 -4.75 115.22 120.05 1nqo n HIS 142 Ca -0.12 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.99 1nqo n HIS 142 Cb 0.46 -0.04 -0.12 0.00 1.12 0.00 0.00 29.99 31.41 1nqo n HIS 142 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1nqo s VAL 143 N -2.03 3.14 -0.07 1.59 1.01 -1.26 -1.20 120.40 121.59 1nqo s VAL 143 Ca -0.00 -2.09 -0.00 0.00 0.00 0.00 0.00 61.98 59.88 1nqo s VAL 143 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1nqo s VAL 143 CO 0.04 -0.67 -0.03 -0.63 0.00 0.00 0.00 175.10 173.80 1nqo s ILE 144 N 1.11 4.00 -0.14 2.22 1.09 0.18 -0.89 121.20 128.78 1nqo s ILE 144 Ca 0.08 -0.38 -0.03 0.00 -1.10 0.00 0.00 60.65 59.23 1nqo s ILE 144 Cb -0.22 -2.67 -0.03 0.00 -1.06 0.00 0.00 42.46 38.48 1nqo s ILE 144 CO -0.05 0.59 -0.03 -0.55 -0.10 0.00 0.00 174.94 174.80 1nqo s SER 145 N -0.88 4.85 -0.09 3.58 0.15 -0.41 0.47 113.70 121.37 1nqo s SER 145 Ca 0.13 -0.08 0.10 0.00 0.70 0.00 0.00 55.95 56.79 1nqo s SER 145 Cb -0.11 -1.69 0.43 0.00 -1.71 0.00 0.00 66.02 62.94 1nqo s SER 145 CO 0.02 0.21 1.24 -3.20 1.20 0.00 0.00 173.24 172.71 1nqo n ASN 146 N 3.24 3.14 0.00 5.45 4.05 -0.56 -0.42 115.26 130.16 1nqo n ASN 146 Ca -0.18 -2.33 0.00 0.00 0.45 0.00 0.00 54.58 52.52 1nqo n ASN 146 Cb 0.53 -0.49 0.00 0.00 1.23 0.00 0.00 39.78 41.05 1nqo n ASN 146 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nqo n ALA 147 N 0.48 0.00 -2.50 5.20 0.00 -1.26 -4.79 120.51 117.65 1nqo n ALA 147 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.37 1nqo n ALA 147 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.03 1nqo n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nqo s SER 148 N -4.00 5.09 0.30 0.00 1.04 -1.26 -3.04 113.70 111.83 1nqo s SER 148 Ca 0.00 -0.59 0.05 0.00 0.48 0.00 0.00 55.95 55.89 1nqo s SER 148 Cb 0.00 -0.88 0.46 0.00 0.10 0.00 0.00 66.02 65.70 1nqo s SER 148 CO 0.00 -0.35 1.73 0.77 0.98 0.00 0.00 173.24 176.37 1nqo h SER 149 N 1.33 0.34 -0.46 7.02 4.64 -1.89 -1.39 113.55 123.15 1nqo h SER 149 Ca -0.44 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 60.69 1nqo h SER 149 Cb 1.25 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 1nqo h SER 149 CO 0.60 0.66 0.07 0.74 -0.87 0.00 0.00 176.83 178.02 1nqo h THR 150 N 0.29 1.25 -0.37 2.95 2.02 -1.95 -1.11 112.91 116.00 1nqo h THR 150 Ca 0.04 -0.92 -0.11 0.00 0.77 0.00 0.00 66.41 66.19 1nqo h THR 150 Cb 0.72 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1nqo h THR 150 CO 0.05 0.32 -0.21 0.74 0.37 0.00 0.00 175.52 176.80 1nqo h THR 151 N 0.63 1.27 0.00 3.16 2.02 -1.76 -0.34 112.91 117.88 1nqo h THR 151 Ca 0.14 -1.29 -0.03 0.00 0.77 0.00 0.00 66.41 65.99 1nqo h THR 151 Cb 0.40 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1nqo h THR 151 CO 0.01 0.43 -0.15 0.78 0.37 0.00 0.00 175.52 176.96 1nqo h ASN 152 N 0.63 0.00 0.10 4.18 2.35 -0.97 0.14 115.58 122.02 1nqo h ASN 152 Ca 0.09 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.67 1nqo h ASN 152 Cb 0.70 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.07 1nqo h ASN 152 CO 0.05 0.15 -0.83 0.00 -1.65 0.00 0.00 177.43 175.14 1nqo h LEU 154 N -0.51 0.06 -0.71 0.00 5.85 -0.85 -3.37 115.31 115.78 1nqo h LEU 154 Ca -0.17 -0.62 0.16 0.00 0.84 0.00 0.00 57.88 58.09 1nqo h LEU 154 Cb 1.54 -0.02 -0.12 0.00 0.37 0.00 0.00 40.66 42.43 1nqo h LEU 154 CO 0.08 0.67 0.01 0.00 -0.34 0.00 0.00 178.44 178.86 1nqo h ALA 155 N 0.39 0.73 -0.05 1.25 0.00 -0.93 -1.62 119.26 119.03 1nqo h ALA 155 Ca -0.00 0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1nqo h ALA 155 Cb 0.66 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1nqo h ALA 155 CO 0.01 -0.41 -0.11 -1.35 0.00 0.00 0.00 179.25 177.39 1nqo h PRO 156 N 0.12 -0.16 0.00 0.00 0.11 -1.74 -1.00 132.00 129.32 1nqo h PRO 156 Ca 0.38 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1nqo h PRO 156 Cb 0.65 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1nqo h PRO 156 CO -0.61 -0.11 -0.09 0.27 -0.21 0.00 0.00 178.00 177.25 1nqo h PHE 157 N -0.17 0.00 -0.13 0.65 -0.00 -1.70 -2.95 116.94 112.64 1nqo h PHE 157 Ca 0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.97 57.87 1nqo h PHE 157 Cb 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.19 1nqo h PHE 157 CO -0.20 0.00 -0.60 0.00 -0.00 0.00 0.00 178.31 177.51 1nqo h ALA 158 N 2.30 0.71 0.29 12.09 0.00 -1.06 -0.57 119.26 133.02 1nqo h ALA 158 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1nqo h ALA 158 Cb 0.85 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1nqo h ALA 158 CO 0.00 0.71 -0.16 -0.22 0.00 0.00 0.00 179.25 179.58 1nqo h LYS 159 N 0.33 -0.40 -0.10 0.00 3.64 -1.06 0.26 116.57 119.24 1nqo h LYS 159 Ca -0.00 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1nqo h LYS 159 Cb 1.14 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 1nqo h LYS 159 CO 0.11 -0.27 -0.07 0.28 -2.27 0.00 0.00 179.45 177.23 1nqo h VAL 160 N -0.42 0.79 -0.43 2.00 2.07 -1.35 -0.26 116.25 118.65 1nqo h VAL 160 Ca -0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1nqo h VAL 160 Cb 0.34 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1nqo h VAL 160 CO 0.04 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.74 1nqo h LEU 161 N -0.08 0.21 -0.16 2.57 3.38 -0.95 -0.38 115.31 119.90 1nqo h LEU 161 Ca 0.06 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1nqo h LEU 161 Cb 0.17 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1nqo h LEU 161 CO -0.15 0.16 -0.00 -0.74 0.09 0.00 0.00 178.44 177.79 1nqo h HIS 162 N 0.35 0.31 -0.53 1.13 2.76 -0.66 0.21 115.15 118.73 1nqo h HIS 162 Ca 0.20 -0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 58.26 1nqo h HIS 162 Cb 0.16 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 1nqo h HIS 162 CO -0.13 0.51 0.12 0.93 -1.30 0.00 0.00 177.93 178.06 1nqo h GLU 163 N 0.03 0.81 0.05 5.26 5.08 -0.89 0.15 114.58 125.06 1nqo h GLU 163 Ca 0.05 -0.17 -0.31 0.00 -1.00 0.00 0.00 59.36 57.93 1nqo h GLU 163 Cb 0.39 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1nqo h GLU 163 CO 0.01 0.73 -1.73 1.96 -1.00 0.00 0.00 179.01 178.99 1nqo h GLN 164 N 0.78 0.10 0.00 2.33 1.08 -1.04 -3.43 115.11 114.94 1nqo h GLN 164 Ca 0.17 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1nqo h GLN 164 Cb 0.30 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1nqo h GLN 164 CO -0.00 0.78 -0.32 1.19 -0.95 0.00 0.00 178.83 179.52 1nqo n PHE 165 N -3.22 0.00 -0.76 2.96 3.72 0.69 -4.99 117.46 115.85 1nqo n PHE 165 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 1nqo n PHE 165 Cb 1.04 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.58 1nqo n PHE 165 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nqo n GLY 166 N 1.09 -3.44 3.62 1.37 0.00 0.54 -2.09 105.19 106.27 1nqo n GLY 166 Ca 0.00 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 1nqo n GLY 166 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqo s ILE 167 N -0.03 5.13 -0.14 -0.61 1.01 -1.26 -0.87 121.20 124.43 1nqo s ILE 167 Ca 0.00 0.73 -0.27 0.00 0.00 0.00 0.00 60.65 61.11 1nqo s ILE 167 Cb 0.00 -3.76 -0.26 0.00 0.01 0.00 0.00 42.46 38.45 1nqo s ILE 167 CO 0.00 0.13 0.72 0.58 0.00 0.00 0.00 174.94 176.37 1nqo h VAL 168 N 5.37 1.66 -1.99 2.92 2.07 -0.73 -3.48 116.25 122.07 1nqo h VAL 168 Ca -0.31 -2.36 0.15 0.00 0.82 0.00 0.00 66.70 65.01 1nqo h VAL 168 Cb 1.15 3.24 -0.17 0.00 -1.52 0.00 0.00 31.29 33.99 1nqo h VAL 168 CO 0.68 0.59 0.59 0.00 0.02 0.00 0.00 177.57 179.46 1nqo s ARG 169 N -2.27 0.65 -0.03 1.57 1.70 -1.20 -4.85 118.95 114.52 1nqo s ARG 169 Ca -0.19 -0.21 -0.29 0.00 -0.47 0.00 0.00 55.73 54.57 1nqo s ARG 169 Cb -0.01 0.30 0.10 0.00 -0.57 0.00 0.00 34.95 34.77 1nqo s ARG 169 CO 0.70 -0.28 0.84 0.20 -1.08 0.00 0.00 175.30 175.67 1nqo s GLY 170 N -2.27 -0.46 -0.03 3.88 0.00 -0.38 -0.26 107.32 107.81 1nqo s GLY 170 Ca 0.06 1.28 0.04 0.00 0.00 0.00 0.00 44.72 46.09 1nqo s GLY 170 CO -0.07 0.63 -0.13 1.06 0.00 0.00 0.00 173.10 174.59 1nqo s MET 171 N -2.27 1.26 0.27 2.90 -1.94 0.80 -2.72 119.30 117.60 1nqo s MET 171 Ca -0.01 -0.46 0.08 0.00 -1.71 0.00 0.00 55.69 53.59 1nqo s MET 171 Cb -0.01 -1.16 -0.05 0.00 2.01 0.00 0.00 34.83 35.62 1nqo s MET 171 CO -0.03 0.22 -0.11 0.00 -0.01 0.00 0.00 175.02 175.09 1nqo s MET 172 N -0.04 1.56 -0.04 2.03 0.23 -0.66 -0.56 119.30 121.83 1nqo s MET 172 Ca -0.00 -1.76 -0.02 0.00 -1.03 0.00 0.00 55.69 52.88 1nqo s MET 172 Cb -0.08 -1.34 0.02 0.00 -1.53 0.00 0.00 34.83 31.91 1nqo s MET 172 CO 0.01 0.14 0.08 0.99 -2.03 0.00 0.00 175.02 174.21 1nqo s THR 173 N -2.85 -0.03 -0.23 3.16 2.01 -0.38 -1.82 115.64 115.49 1nqo s THR 173 Ca 0.28 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 62.38 1nqo s THR 173 Cb 0.01 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.38 1nqo s THR 173 CO 0.12 0.05 -0.05 0.28 -0.69 0.00 0.00 174.62 174.33 1nqo s THR 174 N 0.74 3.16 -0.52 -0.82 -1.32 -0.83 -1.10 115.64 114.94 1nqo s THR 174 Ca -0.06 -0.70 -0.27 0.00 -1.21 0.00 0.00 61.69 59.45 1nqo s THR 174 Cb -0.08 -2.49 0.03 0.00 -1.51 0.00 0.00 72.50 68.45 1nqo s THR 174 CO -0.03 0.34 1.06 -0.69 -2.21 0.00 0.00 174.62 173.10 1nqo s VAL 175 N 1.42 4.25 -0.06 5.08 1.01 -0.59 -0.74 120.40 130.77 1nqo s VAL 175 Ca 0.04 0.83 0.04 0.00 0.00 0.00 0.00 61.98 62.89 1nqo s VAL 175 Cb -0.15 -4.59 -0.02 0.00 0.00 0.00 0.00 36.38 31.62 1nqo s VAL 175 CO -0.04 -1.09 -0.18 -2.28 0.00 0.00 0.00 175.10 171.51 1nqo s HIS 176 N 4.33 2.61 0.83 5.22 5.04 0.01 -1.30 115.29 132.03 1nqo s HIS 176 Ca 0.40 -0.41 -0.12 0.00 -1.54 0.00 0.00 55.06 53.39 1nqo s HIS 176 Cb -0.09 -1.64 0.10 0.00 0.04 0.00 0.00 32.58 30.98 1nqo s HIS 176 CO 0.26 -0.01 1.17 -1.12 -2.34 0.00 0.00 174.74 172.70 1nqo s SER 177 N -0.40 3.56 0.77 9.88 0.01 -1.22 -1.14 113.70 125.16 1nqo s SER 177 Ca 0.04 2.23 -0.11 0.00 1.31 0.00 0.00 55.95 59.42 1nqo s SER 177 Cb -0.12 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.59 1nqo s SER 177 CO 0.02 -2.68 1.08 -0.72 0.41 0.00 0.00 173.24 171.35 1nqo s TYR 178 N -2.41 2.73 0.32 2.43 -0.85 -0.48 -4.71 117.35 114.37 1nqo s TYR 178 Ca 0.69 1.43 0.05 0.00 -0.52 0.00 0.00 57.07 58.72 1nqo s TYR 178 Cb -0.25 -3.02 -0.03 0.00 0.38 0.00 0.00 41.96 39.04 1nqo s TYR 178 CO 0.53 -1.71 0.20 0.95 -1.52 0.00 0.00 175.55 174.01 1nqo s THR 179 N -2.98 0.17 -1.38 -3.49 -4.23 -1.26 -4.71 115.64 97.76 1nqo s THR 179 Ca 0.60 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.26 1nqo s THR 179 Cb -0.16 -2.48 0.24 0.00 1.34 0.00 0.00 72.50 71.43 1nqo s THR 179 CO 0.56 0.00 1.40 0.59 -0.54 0.00 0.00 174.62 176.62 1nqo n ASN 180 N -1.17 0.00 0.09 3.99 3.02 -1.26 -1.79 115.26 118.15 1nqo n ASN 180 Ca 0.03 0.13 0.13 0.00 -0.03 0.00 0.00 54.58 54.83 1nqo n ASN 180 Cb 0.64 -0.31 0.45 0.00 -0.61 0.00 0.00 39.78 39.95 1nqo n ASN 180 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1nqo n ASP 181 N -1.31 0.62 -1.79 6.41 2.03 -1.26 -4.83 116.55 116.42 1nqo n ASP 181 Ca 0.06 0.58 0.00 0.00 0.52 0.00 0.00 54.79 55.96 1nqo n ASP 181 Cb 0.12 -0.74 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 1nqo n ASP 181 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nqo n GLN 182 N -2.11 1.54 -4.29 -0.67 6.02 -0.74 -4.98 117.38 112.15 1nqo n GLN 182 Ca 0.05 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.85 1nqo n GLN 182 Cb 0.35 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.48 1nqo n GLN 182 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1nqo s ARG 183 N 0.44 0.81 -0.03 -1.09 1.81 -1.21 -5.03 118.95 114.65 1nqo s ARG 183 Ca 0.00 -0.69 -0.25 0.00 -1.72 0.00 0.00 55.73 53.07 1nqo s ARG 183 Cb 0.00 -0.78 -0.19 0.00 -0.45 0.00 0.00 34.95 33.53 1nqo s ARG 183 CO 0.00 0.19 1.17 0.82 -0.68 0.00 0.00 175.30 176.80 1nqo h ILE 184 N 4.56 1.17 -3.35 1.52 2.04 -1.90 0.70 117.51 122.25 1nqo h ILE 184 Ca -0.37 -1.08 -0.36 0.00 1.00 0.00 0.00 64.86 64.06 1nqo h ILE 184 Cb 1.18 1.85 -0.38 0.00 -0.74 0.00 0.00 36.82 38.73 1nqo h ILE 184 CO 0.44 0.26 -0.74 -0.76 0.00 0.00 0.00 178.15 177.35 1nqo s LEU 185 N -9.20 0.31 0.00 1.44 1.43 -1.26 -3.76 118.68 107.64 1nqo s LEU 185 Ca -0.15 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1nqo s LEU 185 Cb 0.01 -0.12 0.00 0.00 0.03 0.00 0.00 46.19 46.11 1nqo s LEU 185 CO 0.61 -0.23 0.00 0.47 0.23 0.00 0.00 176.35 177.43 1nqo n ASP 186 N 5.10 0.00 -4.29 2.29 9.92 -1.23 -4.81 116.55 123.52 1nqo n ASP 186 Ca -0.08 0.00 -0.16 0.00 -0.53 0.00 0.00 54.79 54.02 1nqo n ASP 186 Cb 0.50 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.88 1nqo n ASP 186 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1nqo s LEU 187 N 0.00 2.51 0.41 0.64 1.43 0.25 -4.99 118.68 118.94 1nqo s LEU 187 Ca 0.00 -1.04 -0.26 0.00 -1.03 0.00 0.00 54.13 51.80 1nqo s LEU 187 Cb 0.00 -0.46 -0.10 0.00 0.03 0.00 0.00 46.19 45.66 1nqo s LEU 187 CO 0.00 -0.29 1.30 -2.65 0.23 0.00 0.00 176.35 174.94 1nqo n PRO 188 N -0.29 2.05 -3.60 1.29 -0.02 -1.26 -4.47 135.00 128.70 1nqo n PRO 188 Ca -0.09 0.72 -0.15 0.00 -2.02 0.00 0.00 63.50 61.97 1nqo n PRO 188 Cb 0.61 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.61 1nqo n PRO 188 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1nqo s HIS 190 N -1.17 -0.74 0.50 6.00 2.46 -1.26 -4.92 115.29 116.15 1nqo s HIS 190 Ca 0.59 1.69 0.22 0.00 0.47 0.00 0.00 55.06 58.03 1nqo s HIS 190 Cb -0.51 0.31 1.29 0.00 -0.13 0.00 0.00 32.58 33.54 1nqo s HIS 190 CO 0.59 -0.44 1.99 0.87 -2.47 0.00 0.00 174.74 175.29 1nqo h LYS 191 N 4.43 0.12 -4.62 2.88 1.57 -1.98 -3.34 116.57 115.63 1nqo h LYS 191 Ca -0.28 -0.01 -0.70 0.00 -1.87 0.00 0.00 60.65 57.79 1nqo h LYS 191 Cb 1.16 -0.03 -0.23 0.00 0.08 0.00 0.00 32.23 33.21 1nqo h LYS 191 CO 0.14 0.08 -0.50 0.34 -0.57 0.00 0.00 179.45 178.94 1nqo s ASP 192 N -6.23 5.81 0.64 0.86 -1.08 -1.26 -4.97 116.67 110.44 1nqo s ASP 192 Ca -0.06 -0.82 0.39 0.00 -0.52 0.00 0.00 52.55 51.54 1nqo s ASP 192 Cb 0.20 -2.06 2.21 0.00 -1.46 0.00 0.00 42.92 41.80 1nqo s ASP 192 CO 0.74 -0.34 2.33 -0.07 0.52 0.00 0.00 175.17 178.34 1nqo h LEU 193 N 8.46 0.00 0.01 -1.34 3.38 -1.99 -2.23 115.31 121.61 1nqo h LEU 193 Ca -0.28 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1nqo h LEU 193 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1nqo h LEU 193 CO 0.67 0.00 -0.01 0.03 0.09 0.00 0.00 178.44 179.22 1nqo h ARG 194 N 0.00 -0.02 0.00 1.13 2.47 -1.92 -3.22 114.38 112.82 1nqo h ARG 194 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1nqo h ARG 194 Cb 0.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 1nqo h ARG 194 CO -0.00 0.70 0.00 0.54 0.56 0.00 0.00 179.97 181.77 1nqo n ARG 195 N -4.75 0.13 0.24 0.04 1.74 -0.88 -2.08 116.66 111.09 1nqo n ARG 195 Ca -0.09 0.20 0.13 0.00 -0.77 0.00 0.00 57.85 57.32 1nqo n ARG 195 Cb 0.35 -1.50 0.34 0.00 -1.02 0.00 0.00 32.46 30.63 1nqo n ARG 195 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nqo h ALA 196 N 2.54 0.99 -2.11 7.54 0.00 -1.45 -3.21 119.26 123.56 1nqo h ALA 196 Ca 0.00 -0.02 -0.45 0.00 0.00 0.00 0.00 54.91 54.44 1nqo h ALA 196 Cb 0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1nqo h ALA 196 CO 0.00 0.03 0.35 1.03 0.00 0.00 0.00 179.25 180.66 1nqo s ARG 197 N -3.36 4.13 -0.63 0.00 1.81 -0.88 -0.58 118.95 119.43 1nqo s ARG 197 Ca 0.05 1.06 -0.37 0.00 -1.72 0.00 0.00 55.73 54.75 1nqo s ARG 197 Cb 0.07 -2.16 -0.17 0.00 -0.45 0.00 0.00 34.95 32.23 1nqo s ARG 197 CO 0.63 -0.12 2.35 0.00 -0.68 0.00 0.00 175.30 177.48 1nqo n ALA 198 N -0.98 0.46 -0.25 2.13 0.00 -1.26 -4.35 120.51 116.26 1nqo n ALA 198 Ca 0.07 -0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.44 1nqo n ALA 198 Cb 0.54 -2.32 0.15 0.00 0.00 0.00 0.00 19.45 17.82 1nqo n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nqo h ALA 199 N 11.42 1.02 -0.13 0.00 0.00 -0.94 -2.74 119.26 127.89 1nqo h ALA 199 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nqo h ALA 199 Cb 1.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1nqo h ALA 199 CO 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 180.38 1nqo n ALA 200 N -2.41 2.54 0.36 0.00 0.00 -1.26 -4.11 120.51 115.62 1nqo n ALA 200 Ca 0.12 -0.43 0.06 0.00 0.00 0.00 0.00 53.44 53.18 1nqo n ALA 200 Cb 0.29 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.53 1nqo n ALA 200 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nqo n GLU 201 N 0.08 2.20 -4.14 0.00 -0.58 -1.04 -4.78 120.64 112.39 1nqo n GLU 201 Ca 0.16 -0.04 -0.11 0.00 -0.42 0.00 0.00 57.16 56.75 1nqo n GLU 201 Cb 0.27 -1.13 -0.09 0.00 -0.57 0.00 0.00 31.44 29.92 1nqo n GLU 201 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1nqo s SER 202 N -2.54 0.12 -0.21 1.62 0.01 -1.23 -5.07 113.70 106.41 1nqo s SER 202 Ca 0.01 -1.25 -0.17 0.00 1.31 0.00 0.00 55.95 55.86 1nqo s SER 202 Cb 0.08 0.41 -0.04 0.00 0.21 0.00 0.00 66.02 66.69 1nqo s SER 202 CO 0.48 -0.89 0.43 -0.63 0.41 0.00 0.00 173.24 173.05 1nqo s ILE 203 N -4.11 5.17 -0.32 1.44 1.01 -1.26 -4.21 121.20 118.92 1nqo s ILE 203 Ca 0.33 0.77 0.02 0.00 0.00 0.00 0.00 60.65 61.77 1nqo s ILE 203 Cb 0.05 -3.76 0.09 0.00 0.01 0.00 0.00 42.46 38.85 1nqo s ILE 203 CO 0.09 0.22 0.02 -0.63 0.00 0.00 0.00 174.94 174.64 1nqo s ILE 204 N 1.49 2.47 0.30 2.92 1.01 0.12 -4.93 121.20 124.57 1nqo s ILE 204 Ca 0.20 -2.02 -0.29 0.00 0.00 0.00 0.00 60.65 58.55 1nqo s ILE 204 Cb -0.15 -2.66 -0.10 0.00 0.01 0.00 0.00 42.46 39.56 1nqo s ILE 204 CO 0.09 -0.41 1.25 -2.84 0.00 0.00 0.00 174.94 173.02 1nqo s PRO 205 N 1.02 4.44 -0.21 2.79 0.02 -1.26 -0.58 135.00 141.23 1nqo s PRO 205 Ca 0.04 2.08 -0.22 0.00 0.02 0.00 0.00 61.00 62.92 1nqo s PRO 205 Cb -0.20 -3.12 0.06 0.00 0.02 0.00 0.00 34.50 31.26 1nqo s PRO 205 CO -0.06 -0.07 0.60 -0.08 -0.33 0.00 0.00 177.00 177.06 1nqo s THR 206 N -1.03 0.00 0.79 0.99 -1.32 -0.10 -4.81 115.64 110.16 1nqo s THR 206 Ca 0.48 -0.02 -0.12 0.00 -1.21 0.00 0.00 61.69 60.83 1nqo s THR 206 Cb -0.37 -0.85 0.07 0.00 -1.51 0.00 0.00 72.50 69.84 1nqo s THR 206 CO 0.48 -0.01 1.14 0.42 -2.21 0.00 0.00 174.62 174.44 1nqo s THR 207 N 0.14 2.64 -0.13 5.08 -4.23 -1.26 -0.88 115.64 117.00 1nqo s THR 207 Ca -0.01 0.25 -0.22 0.00 -1.18 0.00 0.00 61.69 60.53 1nqo s THR 207 Cb -0.04 -2.61 0.05 0.00 1.34 0.00 0.00 72.50 71.24 1nqo s THR 207 CO 0.02 -0.23 0.54 0.28 -0.54 0.00 0.00 174.62 174.69 1nqo s THR 208 N -2.50 0.01 -2.07 3.99 -1.32 -1.26 -4.69 115.64 107.80 1nqo s THR 208 Ca 0.67 -0.10 0.23 0.00 -1.21 0.00 0.00 61.69 61.28 1nqo s THR 208 Cb -0.23 -0.81 0.60 0.00 -1.51 0.00 0.00 72.50 70.56 1nqo s THR 208 CO 0.52 -0.05 1.51 0.61 -2.21 0.00 0.00 174.62 175.00 1nqo n GLY 209 N 1.97 2.35 0.25 6.08 0.00 -1.26 -4.55 105.19 110.02 1nqo n GLY 209 Ca -0.17 -0.78 0.03 0.00 0.00 0.00 0.00 46.02 45.10 1nqo n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqo h ALA 210 N 4.33 0.80 -0.13 4.61 0.00 -1.95 0.30 119.26 127.22 1nqo h ALA 210 Ca 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1nqo h ALA 210 Cb 0.99 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1nqo h ALA 210 CO 0.00 -0.34 -0.09 0.00 0.00 0.00 0.00 179.25 178.82 1nqo h ALA 211 N 1.56 0.18 -0.07 0.00 0.00 -1.90 -3.03 119.26 116.00 1nqo h ALA 211 Ca 0.36 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1nqo h ALA 211 Cb 0.58 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1nqo h ALA 211 CO -0.48 0.00 -0.20 0.87 0.00 0.00 0.00 179.25 179.45 1nqo h LYS 212 N -0.08 0.12 0.00 0.00 1.57 -1.58 -2.10 116.57 114.50 1nqo h LYS 212 Ca 0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1nqo h LYS 212 Cb 0.58 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1nqo h LYS 212 CO 0.02 0.32 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 1nqo h ALA 213 N 1.69 1.00 -0.53 3.86 0.00 -0.29 -1.78 119.26 123.21 1nqo h ALA 213 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1nqo h ALA 213 Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1nqo h ALA 213 CO 0.03 0.00 0.36 0.28 0.00 0.00 0.00 179.25 179.91 1nqo h VAL 214 N 0.00 0.97 0.00 0.00 2.07 -1.32 0.17 116.25 118.14 1nqo h VAL 214 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1nqo h VAL 214 Cb 0.19 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1nqo h VAL 214 CO 0.00 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.68 1nqo h ALA 215 N 1.71 1.00 -0.01 1.67 0.00 -1.50 0.34 119.26 122.47 1nqo h ALA 215 Ca 0.23 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 1nqo h ALA 215 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1nqo h ALA 215 CO -0.06 0.00 -0.74 -0.07 0.00 0.00 0.00 179.25 178.38 1nqo h LEU 216 N 0.00 0.07 0.00 0.00 3.38 -1.14 -3.14 115.31 114.48 1nqo h LEU 216 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1nqo h LEU 216 Cb 0.08 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1nqo h LEU 216 CO 0.00 0.78 -1.11 1.33 0.09 0.00 0.00 178.44 179.53 1nqo n VAL 217 N -3.70 0.00 -3.39 1.22 0.24 -0.64 -4.73 118.33 107.33 1nqo n VAL 217 Ca -0.01 -0.21 -0.27 0.00 -2.04 0.00 0.00 64.34 61.80 1nqo n VAL 217 Cb 0.71 0.69 -0.10 0.00 -1.47 0.00 0.00 33.84 33.67 1nqo n VAL 217 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1nqo n LEU 218 N -1.63 -0.38 -0.31 1.34 4.77 0.01 -4.58 117.00 116.23 1nqo n LEU 218 Ca 0.01 -4.41 0.12 0.00 -0.03 0.00 0.00 56.01 51.70 1nqo n LEU 218 Cb 0.32 0.52 0.25 0.00 -2.33 0.00 0.00 43.42 42.18 1nqo n LEU 218 CO 0.34 1.87 0.84 -0.65 -1.33 0.00 0.00 177.39 178.45 1nqo h PRO 219 N 5.55 0.07 0.00 3.23 0.11 -1.80 -0.34 132.00 138.83 1nqo h PRO 219 Ca 0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1nqo h PRO 219 Cb 0.90 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1nqo h PRO 219 CO 0.38 0.05 0.21 0.39 -0.21 0.00 0.00 178.00 178.82 1nqo n GLU 220 N -5.39 0.06 -0.34 1.05 1.02 -1.26 -0.59 120.64 115.19 1nqo n GLU 220 Ca 0.20 0.49 0.09 0.00 -0.02 0.00 0.00 57.16 57.92 1nqo n GLU 220 Cb 0.66 -1.92 0.26 0.00 -0.02 0.00 0.00 31.44 30.43 1nqo n GLU 220 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1nqo n LEU 221 N -1.81 3.68 -4.68 -4.62 4.77 -0.14 -4.94 117.00 109.26 1nqo n LEU 221 Ca -0.01 -2.12 -0.45 0.00 -0.03 0.00 0.00 56.01 53.40 1nqo n LEU 221 Cb 0.23 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.87 1nqo n LEU 221 CO 0.04 0.85 1.17 1.17 -1.33 0.00 0.00 177.39 179.29 1nqo n LYS 222 N 1.02 2.19 -0.83 3.23 4.81 0.25 -1.25 118.16 127.57 1nqo n LYS 222 Ca 0.20 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 1nqo n LYS 222 Cb 0.60 -2.54 0.00 0.00 0.02 0.00 0.00 35.03 33.11 1nqo n LYS 222 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nqo n GLY 223 N 3.16 0.27 0.03 3.14 0.00 -1.26 -4.82 105.19 105.70 1nqo n GLY 223 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1nqo n GLY 223 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nqo n LYS 224 N -1.24 0.58 -4.34 1.61 5.02 -0.38 -4.97 118.16 114.43 1nqo n LYS 224 Ca 0.00 -0.12 -0.25 0.00 -2.02 0.00 0.00 58.31 55.92 1nqo n LYS 224 Cb 0.15 -1.58 -0.12 0.00 -0.02 0.00 0.00 35.03 33.47 1nqo n LYS 224 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nqo s LEU 225 N -4.53 2.36 0.18 -0.35 1.43 -1.25 -1.25 118.68 115.28 1nqo s LEU 225 Ca -0.05 -0.77 -0.24 0.00 -1.03 0.00 0.00 54.13 52.04 1nqo s LEU 225 Cb 0.13 -0.99 0.05 0.00 0.03 0.00 0.00 46.19 45.42 1nqo s LEU 225 CO 0.88 0.07 0.88 0.21 0.23 0.00 0.00 176.35 178.62 1nqo s ASN 226 N -2.26 -0.22 0.00 2.29 3.84 -1.10 -3.98 114.94 113.51 1nqo s ASN 226 Ca 0.13 -0.42 0.00 0.00 0.21 0.00 0.00 52.86 52.77 1nqo s ASN 226 Cb -0.09 0.55 0.00 0.00 -0.55 0.00 0.00 41.25 41.16 1nqo s ASN 226 CO 0.06 -1.01 0.00 0.61 -2.79 0.00 0.00 177.10 173.97 1nqo n GLY 227 N -0.45 -0.96 2.13 1.21 0.00 -1.26 -1.65 105.19 104.21 1nqo n GLY 227 Ca -0.06 -0.83 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 1nqo n GLY 227 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1nqo n MET 228 N 0.00 0.40 -4.17 1.61 0.00 -0.76 -4.25 117.12 109.95 1nqo n MET 228 Ca 0.00 -1.89 -0.12 0.00 0.00 0.00 0.00 57.70 55.69 1nqo n MET 228 Cb 0.00 1.74 -0.10 0.00 0.00 0.00 0.00 33.22 34.85 1nqo n MET 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1nqo s ALA 229 N -2.50 1.04 -0.22 3.17 0.00 -0.06 -1.97 121.76 121.21 1nqo s ALA 229 Ca 0.21 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.85 1nqo s ALA 229 Cb -0.00 0.11 0.07 0.00 0.00 0.00 0.00 23.12 23.30 1nqo s ALA 229 CO 0.15 -0.16 0.06 -1.64 0.00 0.00 0.00 175.76 174.17 1nqo s MET 230 N -3.43 0.58 -0.00 0.00 -1.94 0.08 -0.93 119.30 113.66 1nqo s MET 230 Ca 0.09 -0.52 -0.30 0.00 -1.71 0.00 0.00 55.69 53.26 1nqo s MET 230 Cb 0.02 -1.99 -0.03 0.00 2.01 0.00 0.00 34.83 34.84 1nqo s MET 230 CO -0.03 -0.74 1.02 1.03 -0.01 0.00 0.00 175.02 176.30 1nqo s ARG 231 N 1.86 4.52 0.28 2.03 1.81 0.26 -0.81 118.95 128.89 1nqo s ARG 231 Ca 0.02 1.48 0.07 0.00 -1.72 0.00 0.00 55.73 55.57 1nqo s ARG 231 Cb -0.17 -3.45 -0.06 0.00 -0.45 0.00 0.00 34.95 30.82 1nqo s ARG 231 CO -0.14 -0.13 -0.06 0.14 -0.68 0.00 0.00 175.30 174.44 1nqo s VAL 232 N 1.17 1.63 -0.18 3.52 -7.23 -0.30 0.11 120.40 119.12 1nqo s VAL 232 Ca 0.53 -2.13 -0.03 0.00 -1.81 0.00 0.00 61.98 58.54 1nqo s VAL 232 Cb -0.22 -2.43 -0.09 0.00 0.56 0.00 0.00 36.38 34.19 1nqo s VAL 232 CO 0.27 -0.31 1.79 -2.65 -0.31 0.00 0.00 175.10 173.89 1nqo n PRO 233 N -0.57 1.01 -4.61 4.82 -0.02 -1.26 -2.95 135.00 131.41 1nqo n PRO 233 Ca -0.05 -0.62 -0.26 0.00 -2.02 0.00 0.00 63.50 60.54 1nqo n PRO 233 Cb 0.63 -1.87 -0.14 0.00 -0.02 0.00 0.00 33.50 32.10 1nqo n PRO 233 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1nqo s THR 234 N 2.62 1.74 0.01 3.45 -4.23 -1.26 -5.00 115.64 112.97 1nqo s THR 234 Ca 0.28 -1.29 0.18 0.00 -1.18 0.00 0.00 61.69 59.68 1nqo s THR 234 Cb 0.12 -1.52 0.11 0.00 1.34 0.00 0.00 72.50 72.55 1nqo s THR 234 CO -0.01 0.18 1.61 1.55 -0.54 0.00 0.00 174.62 177.41 1nqo h PRO 235 N 4.72 0.00 -2.04 3.99 0.13 -1.87 -1.28 132.00 135.65 1nqo h PRO 235 Ca -0.44 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.76 1nqo h PRO 235 Cb 1.16 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.11 1nqo h PRO 235 CO 0.43 0.42 0.46 1.21 -0.23 0.00 0.00 178.00 180.29 1nqo s ASN 236 N -6.41 -0.41 0.00 1.44 2.47 -1.26 -4.67 114.94 106.09 1nqo s ASN 236 Ca 0.02 0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.53 1nqo s ASN 236 Cb 0.09 0.39 0.00 0.00 -1.45 0.00 0.00 41.25 40.28 1nqo s ASN 236 CO 0.71 -0.54 0.00 0.52 -3.72 0.00 0.00 177.10 174.06 1nqo n VAL 237 N 0.22 -0.38 -4.28 -5.21 0.31 -1.26 -4.84 118.33 102.90 1nqo n VAL 237 Ca -0.11 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.06 1nqo n VAL 237 Cb 0.60 -0.23 -0.09 0.00 -0.91 0.00 0.00 33.84 33.21 1nqo n VAL 237 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1nqo s SER 238 N -0.52 1.10 -0.10 4.52 0.01 0.96 -3.37 113.70 116.30 1nqo s SER 238 Ca 0.00 -1.54 -0.07 0.00 1.31 0.00 0.00 55.95 55.65 1nqo s SER 238 Cb 0.00 0.41 0.04 0.00 0.21 0.00 0.00 66.02 66.68 1nqo s SER 238 CO 0.00 -0.91 0.25 0.54 0.41 0.00 0.00 173.24 173.53 1nqo s VAL 239 N -3.76 -0.02 -0.10 3.43 0.11 -0.42 -1.25 120.40 118.39 1nqo s VAL 239 Ca 0.38 0.08 -0.14 0.00 -2.93 0.00 0.00 61.98 59.37 1nqo s VAL 239 Cb 0.05 -0.37 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 1nqo s VAL 239 CO 0.18 0.03 0.34 -0.69 -3.33 0.00 0.00 175.10 171.63 1nqo s VAL 240 N 0.74 5.22 -0.33 2.04 1.01 0.10 -1.55 120.40 127.64 1nqo s VAL 240 Ca -0.05 0.67 0.03 0.00 0.00 0.00 0.00 61.98 62.63 1nqo s VAL 240 Cb -0.06 -3.66 0.10 0.00 0.00 0.00 0.00 36.38 32.75 1nqo s VAL 240 CO -0.05 0.46 0.05 -0.62 0.00 0.00 0.00 175.10 174.95 1nqo s ASP 241 N -0.12 4.58 -0.17 3.32 2.15 -0.26 -1.12 116.67 125.05 1nqo s ASP 241 Ca 0.20 -1.99 -0.04 0.00 0.43 0.00 0.00 52.55 51.14 1nqo s ASP 241 Cb -0.14 -1.45 -0.03 0.00 -0.30 0.00 0.00 42.92 41.00 1nqo s ASP 241 CO 0.08 -0.38 -0.02 -0.22 -0.17 0.00 0.00 175.17 174.46 1nqo s LEU 242 N 1.07 3.27 -0.18 -1.34 2.96 -0.68 -1.25 118.68 122.55 1nqo s LEU 242 Ca 0.10 -0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 53.84 1nqo s LEU 242 Cb -0.19 -1.80 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 1nqo s LEU 242 CO -0.12 0.14 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.29 1nqo s VAL 243 N 0.52 3.27 0.03 1.68 1.01 0.28 -1.18 120.40 126.01 1nqo s VAL 243 Ca -0.02 -0.56 -0.10 0.00 0.00 0.00 0.00 61.98 61.30 1nqo s VAL 243 Cb -0.14 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1nqo s VAL 243 CO 0.02 0.48 0.19 0.00 0.00 0.00 0.00 175.10 175.79 1nqo s ALA 244 N 0.89 -0.39 -0.20 5.51 0.00 0.16 -0.14 121.76 127.59 1nqo s ALA 244 Ca -0.02 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.60 1nqo s ALA 244 Cb -0.15 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 1nqo s ALA 244 CO 0.00 -0.32 0.31 -1.21 0.00 0.00 0.00 175.76 174.54 1nqo s GLU 245 N -2.24 4.16 0.20 0.00 0.41 0.64 -0.72 118.70 121.14 1nqo s GLU 245 Ca -0.08 0.05 0.05 0.00 -0.41 0.00 0.00 54.97 54.59 1nqo s GLU 245 Cb -0.03 -3.52 -0.04 0.00 -1.78 0.00 0.00 34.13 28.77 1nqo s GLU 245 CO -0.02 0.04 0.18 -0.51 -0.49 0.00 0.00 175.26 174.46 1nqo s LEU 246 N 1.08 3.88 0.03 1.80 1.02 0.25 0.01 118.68 126.76 1nqo s LEU 246 Ca 0.15 -0.13 0.02 0.00 0.02 0.00 0.00 54.13 54.19 1nqo s LEU 246 Cb -0.14 -2.45 -0.25 0.00 0.02 0.00 0.00 46.19 43.36 1nqo s LEU 246 CO 0.06 0.03 0.97 -0.33 0.02 0.00 0.00 176.35 177.10 1nqo h GLU 247 N 2.02 0.14 -6.15 1.70 5.08 -0.80 -3.45 114.58 113.12 1nqo h GLU 247 Ca -0.48 -0.24 -0.59 0.00 -1.00 0.00 0.00 59.36 57.05 1nqo h GLU 247 Cb 1.21 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1nqo h GLU 247 CO 0.63 0.99 -0.22 0.15 -1.00 0.00 0.00 179.01 179.55 1nqo s LYS 248 N -2.64 3.78 0.17 2.33 1.02 -0.89 -5.06 119.74 118.46 1nqo s LYS 248 Ca -0.05 0.21 -0.30 0.00 0.02 0.00 0.00 55.97 55.85 1nqo s LYS 248 Cb 0.08 -2.97 -0.08 0.00 -0.52 0.00 0.00 37.83 34.34 1nqo s LYS 248 CO 0.84 0.54 1.23 -2.00 -0.92 0.00 0.00 175.35 175.05 1nqo s GLU 249 N -1.97 4.45 0.11 1.68 2.56 -1.26 -4.74 118.70 119.53 1nqo s GLU 249 Ca 0.34 1.91 -0.04 0.00 0.00 0.00 0.00 54.97 57.19 1nqo s GLU 249 Cb -0.14 -3.24 -0.03 0.00 2.00 0.00 0.00 34.13 32.72 1nqo s GLU 249 CO 0.18 -0.17 0.11 0.14 -0.56 0.00 0.00 175.26 174.96 1nqo s VAL 250 N 0.19 0.13 0.28 3.70 -7.23 0.23 -5.03 120.40 112.67 1nqo s VAL 250 Ca 0.55 -1.65 0.09 0.00 -1.81 0.00 0.00 61.98 59.17 1nqo s VAL 250 Cb -0.33 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 1nqo s VAL 250 CO 0.36 -0.60 0.02 0.42 -0.31 0.00 0.00 175.10 175.00 1nqo s THR 251 N -3.97 3.32 0.24 5.32 -4.23 -1.26 -4.33 115.64 110.73 1nqo s THR 251 Ca 0.15 -1.88 -0.06 0.00 -1.18 0.00 0.00 61.69 58.72 1nqo s THR 251 Cb 0.06 -2.87 0.21 0.00 1.34 0.00 0.00 72.50 71.24 1nqo s THR 251 CO -0.04 -0.33 1.86 0.58 -0.54 0.00 0.00 174.62 176.16 1nqo h VAL 252 N 1.82 1.09 -0.83 2.29 2.07 -1.94 -1.95 116.25 118.81 1nqo h VAL 252 Ca -0.44 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1nqo h VAL 252 Cb 1.25 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1nqo h VAL 252 CO 0.61 0.19 0.46 -0.33 0.02 0.00 0.00 177.57 178.52 1nqo h GLU 253 N 1.02 1.15 -0.50 1.57 3.07 -1.96 -1.34 114.58 117.57 1nqo h GLU 253 Ca 0.35 -0.13 -0.02 0.00 -0.50 0.00 0.00 59.36 59.06 1nqo h GLU 253 Cb 0.08 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.74 1nqo h GLU 253 CO -0.14 0.84 0.24 1.49 -1.40 0.00 0.00 179.01 180.05 1nqo h GLU 254 N 1.15 0.72 0.17 2.33 4.81 -1.79 0.12 114.58 122.09 1nqo h GLU 254 Ca 0.29 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1nqo h GLU 254 Cb 0.03 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1nqo h GLU 254 CO -0.05 0.60 -0.08 0.28 -0.73 0.00 0.00 179.01 179.03 1nqo h VAL 255 N 0.67 0.91 -0.81 0.32 2.07 -1.04 -2.04 116.25 116.32 1nqo h VAL 255 Ca 0.17 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1nqo h VAL 255 Cb 0.12 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 1nqo h VAL 255 CO -0.02 0.09 0.47 0.78 0.02 0.00 0.00 177.57 178.91 1nqo h ASN 256 N -0.43 0.99 -0.72 0.57 2.35 -1.16 -1.62 115.58 115.56 1nqo h ASN 256 Ca -0.02 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1nqo h ASN 256 Cb 0.33 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.42 1nqo h ASN 256 CO 0.04 0.77 0.36 0.00 -1.65 0.00 0.00 177.43 176.95 1nqo h ALA 257 N 1.39 1.24 -0.18 -0.83 0.00 -0.64 0.46 119.26 120.71 1nqo h ALA 257 Ca 0.29 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1nqo h ALA 257 Cb -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.48 1nqo h ALA 257 CO -0.05 0.59 -0.33 0.00 0.00 0.00 0.00 179.25 179.45 1nqo h ALA 258 N 1.35 0.29 -0.65 0.00 0.00 -0.91 -1.49 119.26 117.85 1nqo h ALA 258 Ca 0.26 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1nqo h ALA 258 Cb 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1nqo h ALA 258 CO -0.03 0.33 0.31 -0.07 0.00 0.00 0.00 179.25 179.78 1nqo h LEU 259 N 0.21 0.86 0.01 0.00 3.38 -1.02 -1.84 115.31 116.90 1nqo h LEU 259 Ca 0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1nqo h LEU 259 Cb 0.92 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1nqo h LEU 259 CO 0.07 0.76 -0.00 0.50 0.09 0.00 0.00 178.44 179.86 1nqo h LYS 260 N 0.90 -0.01 -0.86 1.13 3.64 -0.91 -0.85 116.57 119.62 1nqo h LYS 260 Ca 0.22 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.72 1nqo h LYS 260 Cb 0.13 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.87 1nqo h LYS 260 CO -0.03 0.11 0.49 0.00 -2.27 0.00 0.00 179.45 177.75 1nqo h ALA 261 N 0.86 1.27 -0.28 5.00 0.00 -1.07 -0.39 119.26 124.66 1nqo h ALA 261 Ca -0.00 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1nqo h ALA 261 Cb 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1nqo h ALA 261 CO 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 179.25 179.17 1nqo h ALA 262 N 1.50 0.39 -0.56 0.00 0.00 -1.08 -0.35 119.26 119.18 1nqo h ALA 262 Ca 0.44 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1nqo h ALA 262 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1nqo h ALA 262 CO -0.29 0.28 0.32 0.00 0.00 0.00 0.00 179.25 179.55 1nqo h ALA 263 N 0.74 1.51 -0.01 0.00 0.00 -0.34 -1.23 119.26 119.94 1nqo h ALA 263 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nqo h ALA 263 Cb 0.66 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1nqo h ALA 263 CO 0.04 0.42 -0.32 0.39 0.00 0.00 0.00 179.25 179.78 1nqo n GLU 264 N -4.41 0.78 0.00 0.00 1.02 -0.23 -2.84 120.64 114.96 1nqo n GLU 264 Ca 0.05 -0.49 0.00 0.00 -0.02 0.00 0.00 57.16 56.70 1nqo n GLU 264 Cb 0.09 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1nqo n GLU 264 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nqo n GLY 265 N 1.37 0.96 0.28 0.62 0.00 -0.15 -4.80 105.19 103.47 1nqo n GLY 265 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 1nqo n GLY 265 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nqo h GLU 266 N 0.00 0.00 -0.59 1.61 4.11 -1.80 -2.43 114.58 115.48 1nqo h GLU 266 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1nqo h GLU 266 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nqo h GLU 266 CO 0.00 0.03 0.00 1.28 0.07 0.00 0.00 179.01 180.39 1nqo n LEU 267 N -3.98 3.29 -4.66 3.06 4.77 -0.60 -4.97 117.00 113.91 1nqo n LEU 267 Ca -0.03 -1.65 -0.47 0.00 -0.03 0.00 0.00 56.01 53.84 1nqo n LEU 267 Cb 0.12 -0.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.74 1nqo n LEU 267 CO 0.30 0.72 1.14 1.17 -1.33 0.00 0.00 177.39 179.39 1nqo n LYS 268 N 1.05 2.01 0.00 3.23 4.81 -0.92 -0.41 118.16 127.93 1nqo n LYS 268 Ca 0.19 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.36 1nqo n LYS 268 Cb 0.56 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.14 1nqo n LYS 268 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nqo n GLY 269 N 3.19 3.24 0.30 3.14 0.00 -1.26 -4.76 105.19 109.03 1nqo n GLY 269 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1nqo n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nqo n ILE 270 N -1.50 1.26 -4.88 -0.61 2.08 0.45 -4.30 119.36 111.86 1nqo n ILE 270 Ca 0.00 -0.25 -0.33 0.00 0.56 0.00 0.00 62.75 62.73 1nqo n ILE 270 Cb 0.00 -1.86 -0.15 0.00 -0.75 0.00 0.00 39.64 36.89 1nqo n ILE 270 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1nqo s LEU 271 N -7.29 2.60 0.40 1.39 2.96 0.33 -0.87 118.68 118.20 1nqo s LEU 271 Ca -0.31 -0.35 0.08 0.00 -0.22 0.00 0.00 54.13 53.34 1nqo s LEU 271 Cb 0.11 -1.56 -0.07 0.00 0.50 0.00 0.00 46.19 45.17 1nqo s LEU 271 CO 0.39 0.20 0.03 0.00 -1.32 0.00 0.00 176.35 175.65 1nqo s ALA 272 N 0.14 3.23 -0.05 5.97 0.00 0.15 -4.37 121.76 126.83 1nqo s ALA 272 Ca -0.08 -2.21 -0.01 0.00 0.00 0.00 0.00 51.96 49.66 1nqo s ALA 272 Cb -0.15 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 22.98 1nqo s ALA 272 CO 0.05 -0.09 0.01 -0.47 0.00 0.00 0.00 175.76 175.27 1nqo s TYR 273 N -2.66 0.39 -0.02 0.00 5.04 -1.26 -1.35 117.35 117.48 1nqo s TYR 273 Ca 0.36 -0.00 0.04 0.00 -2.44 0.00 0.00 57.07 55.02 1nqo s TYR 273 Cb 0.07 -0.56 -0.00 0.00 0.35 0.00 0.00 41.96 41.81 1nqo s TYR 273 CO 0.19 -0.21 -0.13 0.45 -1.34 0.00 0.00 175.55 174.51 1nqo s SER 274 N 1.58 1.58 -0.06 4.32 0.15 -0.11 -4.93 113.70 116.24 1nqo s SER 274 Ca -0.02 -0.25 0.13 0.00 0.70 0.00 0.00 55.95 56.52 1nqo s SER 274 Cb -0.13 -0.34 0.42 0.00 -1.71 0.00 0.00 66.02 64.26 1nqo s SER 274 CO -0.03 0.12 1.35 -0.62 1.20 0.00 0.00 173.24 175.26 1nqo n GLU 275 N 3.06 2.97 -3.30 5.44 1.02 -1.26 -0.96 120.64 127.60 1nqo n GLU 275 Ca -0.17 -2.36 -0.35 0.00 -0.02 0.00 0.00 57.16 54.26 1nqo n GLU 275 Cb 0.54 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.41 1nqo n GLU 275 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1nqo s GLU 276 N -1.56 4.03 -1.34 3.49 0.41 -1.26 -4.76 118.70 117.71 1nqo s GLU 276 Ca 0.32 0.56 -0.13 0.00 -0.41 0.00 0.00 54.97 55.31 1nqo s GLU 276 Cb 0.20 -2.90 0.11 0.00 -1.78 0.00 0.00 34.13 29.76 1nqo s GLU 276 CO 0.16 0.45 1.93 -0.35 -0.49 0.00 0.00 175.26 176.95 1nqo n PRO 277 N 0.73 3.25 -2.85 0.39 -0.04 -1.26 -4.87 135.00 130.35 1nqo n PRO 277 Ca -0.04 -3.20 -0.19 0.00 -0.04 0.00 0.00 63.50 60.03 1nqo n PRO 277 Cb 0.52 -3.15 0.03 0.00 -0.04 0.00 0.00 33.50 30.85 1nqo n PRO 277 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nqo s LEU 278 N 1.54 3.43 0.35 1.53 1.43 -1.26 -5.13 118.68 120.57 1nqo s LEU 278 Ca 0.45 -0.30 0.06 0.00 -1.03 0.00 0.00 54.13 53.31 1nqo s LEU 278 Cb 0.09 -2.62 -0.07 0.00 0.03 0.00 0.00 46.19 43.62 1nqo s LEU 278 CO -0.02 -1.02 0.02 0.68 0.23 0.00 0.00 176.35 176.24 1nqo s VAL 279 N -2.58 1.62 0.26 -1.59 -7.23 -1.26 -5.05 120.40 104.57 1nqo s VAL 279 Ca 0.57 -2.03 -0.01 0.00 -1.81 0.00 0.00 61.98 58.70 1nqo s VAL 279 Cb -0.10 -2.82 0.25 0.00 0.56 0.00 0.00 36.38 34.28 1nqo s VAL 279 CO 0.36 -0.05 1.71 0.77 -0.31 0.00 0.00 175.10 177.58 1nqo h SER 280 N 2.00 0.28 -0.25 4.85 4.64 -1.97 -0.45 113.55 122.67 1nqo h SER 280 Ca -0.42 0.13 0.07 0.00 -0.47 0.00 0.00 61.79 61.10 1nqo h SER 280 Cb 1.24 0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.43 1nqo h SER 280 CO 0.74 0.06 0.21 0.03 -0.87 0.00 0.00 176.83 176.99 1nqo h ARG 281 N 0.42 0.00 0.00 4.77 2.47 -1.97 -1.19 114.38 118.88 1nqo h ARG 281 Ca 0.47 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.19 1nqo h ARG 281 Cb 0.80 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 1nqo h ARG 281 CO -0.46 0.00 0.00 -0.25 0.56 0.00 0.00 179.97 179.82 1nqo n ASP 282 N -4.17 0.70 -1.00 7.04 8.00 -0.18 -2.73 116.55 124.21 1nqo n ASP 282 Ca 0.03 0.69 0.09 0.00 0.71 0.00 0.00 54.79 56.31 1nqo n ASP 282 Cb 0.35 -0.83 0.21 0.00 -0.02 0.00 0.00 41.12 40.83 1nqo n ASP 282 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1nqo n TYR 283 N -2.29 0.57 -2.02 1.24 4.01 -0.45 -4.93 117.16 113.29 1nqo n TYR 283 Ca 0.02 -0.36 -0.42 0.00 -0.16 0.00 0.00 57.90 56.97 1nqo n TYR 283 Cb 0.21 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.21 1nqo n TYR 283 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1nqo s ASN 284 N -1.17 6.55 0.00 7.72 2.47 -1.11 -1.83 114.94 127.57 1nqo s ASN 284 Ca 0.35 2.07 0.00 0.00 0.42 0.00 0.00 52.86 55.69 1nqo s ASN 284 Cb 0.19 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.46 1nqo s ASN 284 CO 0.26 -1.05 0.00 0.61 -3.72 0.00 0.00 177.10 173.20 1nqo n GLY 285 N 4.33 0.39 3.70 1.21 0.00 -1.26 -5.06 105.19 108.50 1nqo n GLY 285 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1nqo n GLY 285 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nqo s SER 286 N -2.01 6.49 0.00 1.61 0.15 -0.76 -4.90 113.70 114.27 1nqo s SER 286 Ca 0.00 2.70 0.26 0.00 0.70 0.00 0.00 55.95 59.60 1nqo s SER 286 Cb 0.00 -2.58 0.62 0.00 -1.71 0.00 0.00 66.02 62.35 1nqo s SER 286 CO 0.00 -0.94 1.48 0.35 1.20 0.00 0.00 173.24 175.34 1nqo n THR 287 N 4.41 0.00 -1.84 6.45 -2.24 -1.26 -2.98 114.28 116.82 1nqo n THR 287 Ca 0.16 -0.08 -0.29 0.00 -2.27 0.00 0.00 64.05 61.57 1nqo n THR 287 Cb 0.38 0.38 0.08 0.00 -2.10 0.00 0.00 70.33 69.08 1nqo n THR 287 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1nqo s VAL 288 N -2.69 2.42 -0.22 2.28 -7.23 -1.26 -4.36 120.40 109.35 1nqo s VAL 288 Ca 0.19 0.14 0.21 0.00 -1.81 0.00 0.00 61.98 60.71 1nqo s VAL 288 Cb 0.18 -3.09 -0.02 0.00 0.56 0.00 0.00 36.38 34.01 1nqo s VAL 288 CO 0.59 -0.18 1.02 0.28 -0.31 0.00 0.00 175.10 176.51 1nqo h SER 289 N -1.01 0.00 -3.01 4.85 0.02 -1.19 -3.38 113.55 109.83 1nqo h SER 289 Ca -0.46 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.51 1nqo h SER 289 Cb 1.31 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.64 1nqo h SER 289 CO 0.65 0.13 0.02 -0.55 -1.14 0.00 0.00 176.83 175.93 1nqo s SER 290 N -5.49 -0.94 -0.23 3.07 0.15 -0.77 -3.61 113.70 105.88 1nqo s SER 290 Ca -0.01 1.51 0.01 0.00 0.70 0.00 0.00 55.95 58.16 1nqo s SER 290 Cb 0.09 1.38 0.06 0.00 -1.71 0.00 0.00 66.02 65.84 1nqo s SER 290 CO 0.79 -0.24 -0.05 -0.89 1.20 0.00 0.00 173.24 174.05 1nqo s THR 291 N 1.63 1.52 0.12 6.45 2.01 -0.17 0.30 115.64 127.51 1nqo s THR 291 Ca -0.10 -1.21 -0.31 0.00 0.31 0.00 0.00 61.69 60.38 1nqo s THR 291 Cb -0.05 -1.78 -0.10 0.00 0.01 0.00 0.00 72.50 70.58 1nqo s THR 291 CO -0.20 -0.09 1.69 -0.63 -0.69 0.00 0.00 174.62 174.71 1nqo s ILE 292 N 1.40 2.71 -1.13 1.82 -1.09 -0.46 -0.43 121.20 124.03 1nqo s ILE 292 Ca -0.06 0.31 -0.13 0.00 -2.23 0.00 0.00 60.65 58.54 1nqo s ILE 292 Cb -0.19 -3.20 0.21 0.00 -1.58 0.00 0.00 42.46 37.70 1nqo s ILE 292 CO -0.06 0.01 1.26 -0.62 -1.23 0.00 0.00 174.94 174.29 1nqo s ASP 293 N 2.14 7.10 0.43 3.58 -1.08 0.65 -0.94 116.67 128.54 1nqo s ASP 293 Ca 0.75 -3.09 0.21 0.00 -0.52 0.00 0.00 52.55 49.91 1nqo s ASP 293 Cb -0.43 -2.33 1.17 0.00 -1.46 0.00 0.00 42.92 39.87 1nqo s ASP 293 CO 0.33 -0.61 1.80 0.00 0.52 0.00 0.00 175.17 177.21 1nqo h ALA 294 N 7.19 2.36 0.00 3.66 0.00 -1.31 -0.47 119.26 130.68 1nqo h ALA 294 Ca 0.24 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1nqo h ALA 294 Cb 0.90 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1nqo h ALA 294 CO 1.13 -0.72 0.00 -0.07 0.00 0.00 0.00 179.25 179.59 1nqo h LEU 295 N 0.33 0.00 0.00 0.00 3.38 -1.86 -2.58 115.31 114.59 1nqo h LEU 295 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1nqo h LEU 295 Cb 1.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1nqo h LEU 295 CO -0.22 0.00 -0.55 -1.20 0.09 0.00 0.00 178.44 176.56 1nqo n SER 296 N -3.07 0.53 -4.71 -0.43 7.64 -0.18 -4.93 113.62 108.46 1nqo n SER 296 Ca -0.02 -0.20 -0.42 0.00 1.01 0.00 0.00 58.87 59.24 1nqo n SER 296 Cb 0.15 0.27 -0.03 0.00 -1.01 0.00 0.00 64.21 63.60 1nqo n SER 296 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1nqo s THR 297 N -3.03 2.24 0.07 0.44 2.01 -0.97 -4.79 115.64 111.59 1nqo s THR 297 Ca 0.10 0.10 0.02 0.00 0.31 0.00 0.00 61.69 62.22 1nqo s THR 297 Cb 0.17 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 1nqo s THR 297 CO 0.71 0.01 -0.07 -0.04 -0.69 0.00 0.00 174.62 174.53 1nqo s MET 298 N 1.50 0.66 -0.02 4.92 1.00 -1.09 -4.99 119.30 121.29 1nqo s MET 298 Ca 0.75 -1.02 -0.01 0.00 0.00 0.00 0.00 55.69 55.42 1nqo s MET 298 Cb -0.48 -0.25 0.01 0.00 0.00 0.00 0.00 34.83 34.11 1nqo s MET 298 CO 0.33 0.02 0.04 0.08 0.00 0.00 0.00 175.02 175.48 1nqo s VAL 299 N -2.39 -0.01 -0.06 -6.03 1.01 -1.26 -1.39 120.40 110.27 1nqo s VAL 299 Ca -0.00 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.08 1nqo s VAL 299 Cb -0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.27 1nqo s VAL 299 CO -0.02 0.02 -0.24 -0.63 0.00 0.00 0.00 175.10 174.23 1nqo s ILE 300 N 0.26 1.96 -1.39 2.22 1.01 0.39 -4.66 121.20 120.99 1nqo s ILE 300 Ca -0.02 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.61 1nqo s ILE 300 Cb -0.03 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.78 1nqo s ILE 300 CO -0.01 0.55 0.00 0.47 0.00 0.00 0.00 174.94 175.95 1nqo n ASP 301 N 2.98 -3.49 -0.70 3.58 8.00 -1.26 -1.08 116.55 124.58 1nqo n ASP 301 Ca -0.18 0.33 -0.09 0.00 0.71 0.00 0.00 54.79 55.56 1nqo n ASP 301 Cb 0.52 -3.26 -0.04 0.00 -0.02 0.00 0.00 41.12 38.33 1nqo n ASP 301 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nqo n GLY 302 N -0.24 0.91 0.00 0.44 0.00 -1.26 -4.74 105.19 100.30 1nqo n GLY 302 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1nqo n GLY 302 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nqo n LYS 303 N -0.82 2.06 -3.74 1.61 4.76 -0.24 -0.60 118.16 121.19 1nqo n LYS 303 Ca -0.09 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 54.99 1nqo n LYS 303 Cb 0.54 -0.82 -0.10 0.00 -1.84 0.00 0.00 35.03 32.81 1nqo n LYS 303 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1nqo s MET 304 N -1.64 3.99 0.15 1.97 1.75 -0.73 -0.58 119.30 124.22 1nqo s MET 304 Ca 0.00 -0.31 0.09 0.00 -1.25 0.00 0.00 55.69 54.21 1nqo s MET 304 Cb 0.00 -3.45 -0.04 0.00 2.84 0.00 0.00 34.83 34.18 1nqo s MET 304 CO 0.00 0.06 -0.19 0.54 -0.65 0.00 0.00 175.02 174.77 1nqo s VAL 305 N 1.03 1.84 -0.10 10.11 0.11 0.10 -0.47 120.40 133.03 1nqo s VAL 305 Ca 0.06 -1.83 0.02 0.00 -2.93 0.00 0.00 61.98 57.30 1nqo s VAL 305 Cb -0.14 -1.80 0.01 0.00 -1.53 0.00 0.00 36.38 32.93 1nqo s VAL 305 CO 0.04 -0.23 -0.16 -0.75 -3.33 0.00 0.00 175.10 170.67 1nqo s LYS 306 N -2.56 2.20 -0.08 1.54 2.20 -0.49 -0.66 119.74 121.88 1nqo s LYS 306 Ca 0.14 -0.56 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 1nqo s LYS 306 Cb -0.07 -1.83 0.01 0.00 -1.51 0.00 0.00 37.83 34.43 1nqo s LYS 306 CO 0.06 -0.02 -0.17 0.08 -0.36 0.00 0.00 175.35 174.95 1nqo s VAL 307 N 0.86 1.51 -0.13 4.02 1.01 -0.32 -2.66 120.40 124.69 1nqo s VAL 307 Ca -0.09 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 1nqo s VAL 307 Cb -0.15 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 1nqo s VAL 307 CO 0.01 0.44 -0.12 -0.69 0.00 0.00 0.00 175.10 174.74 1nqo s VAL 308 N 0.61 3.19 -0.03 2.92 1.01 -1.26 -1.69 120.40 125.16 1nqo s VAL 308 Ca -0.15 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1nqo s VAL 308 Cb -0.16 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.89 1nqo s VAL 308 CO 0.05 0.52 -0.02 -0.55 0.00 0.00 0.00 175.10 175.10 1nqo s SER 309 N 0.28 0.57 0.44 3.32 0.15 -0.28 -0.25 113.70 117.94 1nqo s SER 309 Ca -0.09 -0.06 -0.10 0.00 0.70 0.00 0.00 55.95 56.40 1nqo s SER 309 Cb -0.15 -0.26 -0.06 0.00 -1.71 0.00 0.00 66.02 63.83 1nqo s SER 309 CO 0.05 -0.06 0.81 0.26 1.20 0.00 0.00 173.24 175.50 1nqo s TRP 310 N 0.81 3.49 -0.28 3.44 0.52 0.43 0.01 118.94 127.36 1nqo s TRP 310 Ca -0.09 1.06 -0.17 0.00 0.02 0.00 0.00 56.10 56.93 1nqo s TRP 310 Cb -0.12 -2.47 0.10 0.00 -1.15 0.00 0.00 33.47 29.83 1nqo s TRP 310 CO -0.01 -0.20 0.80 1.52 0.02 0.00 0.00 176.95 179.08 1nqo s TYR 311 N -2.51 -0.87 -0.68 -1.98 1.13 -0.38 -1.00 117.35 111.06 1nqo s TYR 311 Ca 0.52 1.76 -0.26 0.00 -1.41 0.00 0.00 57.07 57.68 1nqo s TYR 311 Cb -0.10 0.52 0.04 0.00 -1.10 0.00 0.00 41.96 41.31 1nqo s TYR 311 CO 0.35 -0.43 1.16 0.34 -2.51 0.00 0.00 175.55 174.46 1nqo s ASP 312 N 1.45 6.21 0.61 -0.18 -1.08 -1.26 -0.03 116.67 122.40 1nqo s ASP 312 Ca -0.09 -0.51 0.31 0.00 -0.52 0.00 0.00 52.55 51.74 1nqo s ASP 312 Cb -0.05 -2.51 1.71 0.00 -1.46 0.00 0.00 42.92 40.61 1nqo s ASP 312 CO -0.17 -1.64 2.07 -0.55 0.52 0.00 0.00 175.17 175.39 1nqo h ASN 313 N 9.79 0.00 0.00 -0.34 -1.07 -1.91 -2.30 115.58 119.75 1nqo h ASN 313 Ca -0.28 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 55.88 1nqo h ASN 313 Cb 1.06 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.28 1nqo h ASN 313 CO 1.23 0.00 -1.22 -0.62 0.07 0.00 0.00 177.43 176.89 1nqo n GLU 314 N -3.54 0.55 0.07 4.14 1.02 -1.26 -4.23 120.64 117.38 1nqo n GLU 314 Ca 0.01 0.57 -0.12 0.00 -0.02 0.00 0.00 57.16 57.60 1nqo n GLU 314 Cb 0.36 -1.74 -0.08 0.00 -0.02 0.00 0.00 31.44 29.96 1nqo n GLU 314 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1nqo h THR 315 N -1.00 0.93 -0.03 2.62 2.02 -1.80 -2.55 112.91 113.10 1nqo h THR 315 Ca -0.33 -1.00 0.03 0.00 0.77 0.00 0.00 66.41 65.88 1nqo h THR 315 Cb 1.24 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 69.11 1nqo h THR 315 CO -0.20 0.21 -0.16 1.23 0.37 0.00 0.00 175.52 176.98 1nqo h GLY 316 N -0.75 -0.18 0.77 2.16 0.00 -1.31 -1.26 103.07 102.50 1nqo h GLY 316 Ca -0.02 0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.54 1nqo h GLY 316 CO 0.04 -0.15 0.30 -1.82 0.00 0.00 0.00 176.54 174.90 1nqo h TYR 317 N -0.25 0.55 -0.84 5.60 3.20 -1.72 -0.95 116.97 122.57 1nqo h TYR 317 Ca 0.06 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1nqo h TYR 317 Cb 0.33 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 1nqo h TYR 317 CO -0.23 0.29 0.52 0.77 -1.64 0.00 0.00 178.16 177.87 1nqo h SER 318 N 0.58 1.00 0.18 -2.11 0.02 -1.16 -0.02 113.55 112.04 1nqo h SER 318 Ca 0.23 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1nqo h SER 318 Cb 0.10 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1nqo h SER 318 CO -0.14 0.76 -0.27 0.45 -1.14 0.00 0.00 176.83 176.49 1nqo h HIS 319 N 1.15 0.16 -0.08 3.45 3.86 -0.70 -2.10 115.15 120.89 1nqo h HIS 319 Ca 0.30 -0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.34 1nqo h HIS 319 Cb -0.07 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.35 1nqo h HIS 319 CO -0.01 0.41 -0.60 0.00 0.86 0.00 0.00 177.93 178.59 1nqo h ARG 320 N 0.14 0.28 -0.26 2.45 2.47 -0.01 -1.25 114.38 118.19 1nqo h ARG 320 Ca 0.02 -0.19 -0.01 0.00 -1.26 0.00 0.00 59.98 58.54 1nqo h ARG 320 Cb 0.55 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.89 1nqo h ARG 320 CO 0.04 0.80 0.13 0.28 0.56 0.00 0.00 179.97 181.78 1nqo h VAL 321 N 0.21 1.13 -0.39 2.04 2.07 -0.40 0.06 116.25 120.98 1nqo h VAL 321 Ca -0.01 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1nqo h VAL 321 Cb 1.11 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1nqo h VAL 321 CO 0.10 0.13 0.21 0.58 0.02 0.00 0.00 177.57 178.61 1nqo h VAL 322 N 0.29 1.15 -0.97 2.57 2.07 -1.30 -0.60 116.25 119.46 1nqo h VAL 322 Ca 0.09 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.28 1nqo h VAL 322 Cb 0.09 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 1nqo h VAL 322 CO -0.01 0.15 0.63 0.44 0.02 0.00 0.00 177.57 178.80 1nqo h ASP 323 N 0.49 1.02 -0.33 0.57 3.32 -0.98 -0.89 116.42 119.63 1nqo h ASP 323 Ca 0.14 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1nqo h ASP 323 Cb 0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1nqo h ASP 323 CO -0.02 0.68 -0.05 0.25 -1.72 0.00 0.00 179.24 178.37 1nqo h LEU 324 N 1.17 0.62 -0.60 1.55 5.85 -0.38 -0.74 115.31 122.77 1nqo h LEU 324 Ca 0.40 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1nqo h LEU 324 Cb 0.09 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1nqo h LEU 324 CO -0.14 0.82 0.39 0.00 -0.34 0.00 0.00 178.44 179.17 1nqo h ALA 325 N 0.82 0.76 -0.65 1.25 0.00 -0.61 0.87 119.26 121.70 1nqo h ALA 325 Ca 0.09 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1nqo h ALA 325 Cb 0.53 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1nqo h ALA 325 CO 0.03 0.18 0.09 0.00 0.00 0.00 0.00 179.25 179.55 1nqo h ALA 326 N 1.23 0.93 -0.32 0.00 0.00 -1.07 -1.41 119.26 118.62 1nqo h ALA 326 Ca 0.22 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1nqo h ALA 326 Cb -0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1nqo h ALA 326 CO -0.05 0.66 0.09 -0.92 0.00 0.00 0.00 179.25 179.03 1nqo h TYR 327 N 1.00 0.52 -0.34 0.00 3.20 -0.51 -2.12 116.97 118.73 1nqo h TYR 327 Ca 0.20 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1nqo h TYR 327 Cb 0.45 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 1nqo h TYR 327 CO 0.03 0.53 0.16 0.82 -1.64 0.00 0.00 178.16 178.07 1nqo h ILE 328 N 0.36 1.16 -0.57 1.81 2.04 -0.68 -2.68 117.51 118.94 1nqo h ILE 328 Ca 0.10 -0.47 0.04 0.00 1.00 0.00 0.00 64.86 65.54 1nqo h ILE 328 Cb 0.26 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1nqo h ILE 328 CO -0.00 0.17 0.38 0.00 0.00 0.00 0.00 178.15 178.70 1nqo h ALA 329 N 1.01 1.76 0.00 1.87 0.00 -1.16 -1.25 119.26 121.49 1nqo h ALA 329 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1nqo h ALA 329 Cb 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1nqo h ALA 329 CO -0.01 0.16 0.00 0.66 0.00 0.00 0.00 179.25 180.06 1nqo h SER 330 N 0.61 0.00 -0.20 0.00 4.64 -1.03 -2.85 113.55 114.73 1nqo h SER 330 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1nqo h SER 330 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1nqo h SER 330 CO -0.07 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.18 1nqo n LYS 331 N -2.42 2.18 0.00 4.77 4.01 -0.47 -5.03 118.16 121.19 1nqo n LYS 331 Ca 0.01 -1.75 0.00 0.00 -0.51 0.00 0.00 58.31 56.06 1nqo n LYS 331 Cb 0.23 -1.47 0.00 0.00 -0.51 0.00 0.00 35.03 33.28 1nqo n LYS 331 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1nqo n GLY 332 N 1.34 1.91 0.00 0.72 0.00 -1.07 -4.87 105.19 103.21 1nqo n GLY 332 Ca 0.17 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.94 1nqo n GLY 332 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22