#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 4.60 -0.00 0.00 1.01 -0.81 -4.88 120.40 120.33 1nqo s VAL 1 Ca 0.00 1.75 -0.29 0.00 0.00 0.00 0.00 61.98 63.43 1nqo s VAL 1 Cb 0.00 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 1nqo s VAL 1 CO 0.00 0.39 0.95 -0.54 0.00 0.00 0.00 175.10 175.89 1nqo s LYS 2 N -0.26 4.55 0.07 2.72 1.02 -1.26 -1.83 119.74 124.76 1nqo s LYS 2 Ca 0.40 1.36 0.09 0.00 0.02 0.00 0.00 55.97 57.84 1nqo s LYS 2 Cb -0.22 -3.45 -0.03 0.00 -0.52 0.00 0.00 37.83 33.61 1nqo s LYS 2 CO 0.25 -0.02 -0.24 0.08 -0.92 0.00 0.00 175.35 174.50 1nqo s VAL 3 N 0.92 1.97 0.07 3.17 1.01 0.27 -1.63 120.40 126.18 1nqo s VAL 3 Ca 0.50 -1.44 0.09 0.00 0.00 0.00 0.00 61.98 61.13 1nqo s VAL 3 Cb -0.21 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1nqo s VAL 3 CO 0.27 0.20 -0.25 -0.83 0.00 0.00 0.00 175.10 174.48 1nqo s GLY 4 N -1.50 1.40 -0.21 4.51 0.00 -0.30 -1.82 107.32 109.40 1nqo s GLY 4 Ca 0.10 -1.29 -0.01 0.00 0.00 0.00 0.00 44.72 43.52 1nqo s GLY 4 CO 0.03 -1.21 -0.12 -0.42 0.00 0.00 0.00 173.10 171.38 1nqo s ILE 5 N -0.89 2.68 -0.44 0.90 1.01 -0.45 -0.67 121.20 123.35 1nqo s ILE 5 Ca 0.11 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 1nqo s ILE 5 Cb -0.10 -2.22 0.05 0.00 0.01 0.00 0.00 42.46 40.21 1nqo s ILE 5 CO 0.03 0.43 0.34 0.21 0.00 0.00 0.00 174.94 175.95 1nqo s ASN 6 N 1.36 6.06 0.00 3.58 2.47 0.00 -0.51 114.94 127.90 1nqo s ASN 6 Ca 0.04 -1.18 0.00 0.00 0.42 0.00 0.00 52.86 52.15 1nqo s ASN 6 Cb -0.14 -2.15 0.00 0.00 -1.45 0.00 0.00 41.25 37.51 1nqo s ASN 6 CO -0.08 -0.55 0.00 0.61 -3.72 0.00 0.00 177.10 173.36 1nqo n GLY 7 N 5.15 -0.01 2.51 1.21 0.00 0.10 -0.88 105.19 113.26 1nqo n GLY 7 Ca -0.12 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.78 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 0.31 2.30 -0.16 1.61 7.35 -1.21 -3.92 117.46 123.74 1nqo n PHE 8 Ca 0.00 -2.49 0.00 0.00 -0.76 0.00 0.00 57.45 54.20 1nqo n PHE 8 Cb 0.00 -1.60 0.00 0.00 0.35 0.00 0.00 39.48 38.23 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 1.20 2.00 0.10 7.13 0.00 -1.26 -4.43 105.19 109.93 1nqo n GLY 9 Ca 0.56 -1.77 -0.10 0.00 0.00 0.00 0.00 46.02 44.72 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 0.12 0.10 1.61 2.47 -1.92 0.18 114.38 116.94 1nqo h ARG 10 Ca 0.00 -0.01 -0.21 0.00 -1.26 0.00 0.00 59.98 58.50 1nqo h ARG 10 Cb 0.00 -0.03 0.02 0.00 -1.65 0.00 0.00 29.97 28.31 1nqo h ARG 10 CO 0.00 0.08 -0.88 0.82 0.56 0.00 0.00 179.97 180.54 1nqo h ILE 11 N 0.12 1.42 -0.28 2.04 1.08 -1.90 -2.61 117.51 117.38 1nqo h ILE 11 Ca 0.07 -2.38 0.06 0.00 -0.39 0.00 0.00 64.86 62.23 1nqo h ILE 11 Cb 0.05 2.88 -0.07 0.00 -3.07 0.00 0.00 36.82 36.61 1nqo h ILE 11 CO -0.09 0.69 -0.17 1.23 -0.69 0.00 0.00 178.15 179.13 1nqo h GLY 12 N -0.10 0.03 2.00 5.37 0.00 -1.65 0.46 103.07 109.17 1nqo h GLY 12 Ca -0.14 0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.28 1nqo h GLY 12 CO 0.17 -0.17 -0.61 3.21 0.00 0.00 0.00 176.54 179.13 1nqo h ARG 13 N -0.14 0.00 0.00 4.80 3.08 -0.75 -2.23 114.38 119.14 1nqo h ARG 13 Ca 0.15 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.07 1nqo h ARG 13 Cb 0.37 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1nqo h ARG 13 CO -0.37 0.61 -0.62 -0.91 -1.07 0.00 0.00 179.97 177.61 1nqo h ASN 14 N 0.00 0.00 0.34 7.04 2.35 -0.99 -2.46 115.58 121.86 1nqo h ASN 14 Ca -0.01 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.60 1nqo h ASN 14 Cb 1.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.46 1nqo h ASN 14 CO 0.08 0.62 -0.59 0.58 -1.65 0.00 0.00 177.43 176.47 1nqo h VAL 15 N 0.00 1.38 -0.45 2.81 2.07 0.04 -2.37 116.25 119.73 1nqo h VAL 15 Ca -0.01 -1.95 -0.09 0.00 0.82 0.00 0.00 66.70 65.48 1nqo h VAL 15 Cb 1.33 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 33.05 1nqo h VAL 15 CO 0.08 0.58 -0.08 0.15 0.02 0.00 0.00 177.57 178.31 1nqo h PHE 16 N 0.19 0.87 -0.14 1.57 3.04 -1.18 -0.07 116.94 121.21 1nqo h PHE 16 Ca -0.00 -0.15 -0.02 0.00 3.98 0.00 0.00 57.97 61.78 1nqo h PHE 16 Cb 1.09 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.37 1nqo h PHE 16 CO 0.02 0.84 0.02 0.00 -2.02 0.00 0.00 178.31 177.17 1nqo h ARG 17 N 0.72 0.23 -0.81 1.11 3.08 -1.21 -2.59 114.38 114.91 1nqo h ARG 17 Ca 0.13 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1nqo h ARG 17 Cb 0.56 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1nqo h ARG 17 CO 0.03 0.42 0.44 0.00 -1.07 0.00 0.00 179.97 179.80 1nqo h ALA 18 N 0.80 1.04 -0.36 0.04 0.00 -1.22 -2.07 119.26 117.48 1nqo h ALA 18 Ca 0.04 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1nqo h ALA 18 Cb 0.31 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1nqo h ALA 18 CO 0.00 0.56 0.24 0.00 0.00 0.00 0.00 179.25 180.05 1nqo h ALA 19 N 1.23 1.89 -0.02 0.00 0.00 -0.87 -0.45 119.26 121.04 1nqo h ALA 19 Ca 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1nqo h ALA 19 Cb 0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1nqo h ALA 19 CO -0.05 0.06 0.02 -0.07 0.00 0.00 0.00 179.25 179.22 1nqo h LEU 20 N 0.36 0.00 -0.46 0.00 3.38 -0.97 -1.08 115.31 116.55 1nqo h LEU 20 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1nqo h LEU 20 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1nqo h LEU 20 CO -0.03 0.00 -0.64 0.29 0.09 0.00 0.00 178.44 178.15 1nqo n LYS 21 N -3.61 0.59 -3.61 1.13 5.02 -0.19 -4.86 118.16 112.63 1nqo n LYS 21 Ca -0.03 -0.46 -0.40 0.00 -2.02 0.00 0.00 58.31 55.41 1nqo n LYS 21 Cb 0.10 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.51 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 -2.73 5.70 0.50 4.39 3.84 -0.41 -4.96 114.94 121.27 1nqo s ASN 22 Ca 0.15 -0.77 0.24 0.00 0.21 0.00 0.00 52.86 52.69 1nqo s ASN 22 Cb 0.17 -2.03 1.32 0.00 -0.55 0.00 0.00 41.25 40.17 1nqo s ASN 22 CO 0.69 -0.30 2.05 1.55 -2.79 0.00 0.00 177.10 178.29 1nqo h PRO 23 N 8.42 0.00 0.00 0.43 0.13 -1.89 -2.90 132.00 136.18 1nqo h PRO 23 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1nqo h PRO 23 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1nqo h PRO 23 CO 0.65 0.14 0.00 -0.44 -0.23 0.00 0.00 178.00 178.12 1nqo h ASP 24 N 0.00 0.00 -4.31 1.44 3.32 -1.93 -2.96 116.42 111.98 1nqo h ASP 24 Ca -0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 1nqo h ASP 24 Cb 0.34 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.64 1nqo h ASP 24 CO 0.02 0.00 -0.81 0.27 -1.72 0.00 0.00 179.24 177.00 1nqo s ILE 25 N -3.18 1.29 -0.05 0.35 -4.36 -1.10 -1.92 121.20 112.24 1nqo s ILE 25 Ca 0.09 -1.11 -0.01 0.00 -0.26 0.00 0.00 60.65 59.36 1nqo s ILE 25 Cb 0.11 -1.16 0.03 0.00 1.25 0.00 0.00 42.46 42.69 1nqo s ILE 25 CO 0.54 0.03 0.02 -0.70 0.24 0.00 0.00 174.94 175.08 1nqo s GLU 26 N -1.25 0.27 -0.29 0.37 2.12 -0.76 -4.66 118.70 114.49 1nqo s GLU 26 Ca 0.03 0.20 -0.25 0.00 0.36 0.00 0.00 54.97 55.30 1nqo s GLU 26 Cb -0.08 -0.66 0.00 0.00 0.26 0.00 0.00 34.13 33.65 1nqo s GLU 26 CO 0.02 -0.26 0.88 0.08 -0.54 0.00 0.00 175.26 175.44 1nqo s VAL 27 N 1.75 4.73 -0.29 3.70 1.01 -1.26 -0.57 120.40 129.47 1nqo s VAL 27 Ca 0.00 1.46 0.11 0.00 0.00 0.00 0.00 61.98 63.56 1nqo s VAL 27 Cb -0.13 -4.22 -0.15 0.00 0.00 0.00 0.00 36.38 31.89 1nqo s VAL 27 CO -0.03 -0.26 0.37 1.33 0.00 0.00 0.00 175.10 176.51 1nqo n VAL 28 N 5.54 0.00 -3.60 2.92 0.24 -0.76 -4.86 118.33 117.81 1nqo n VAL 28 Ca 0.07 -0.25 -0.16 0.00 -2.04 0.00 0.00 64.34 61.96 1nqo n VAL 28 Cb 0.48 0.65 -0.07 0.00 -1.47 0.00 0.00 33.84 33.42 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 -2.40 -1.50 0.03 2.33 0.00 -1.25 -0.96 121.76 118.01 1nqo s ALA 29 Ca 0.00 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.16 1nqo s ALA 29 Cb 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1nqo s ALA 29 CO 0.47 -0.33 -0.08 0.14 0.00 0.00 0.00 175.76 175.96 1nqo s VAL 30 N -0.93 0.56 -0.03 0.00 -7.23 0.01 -1.34 120.40 111.44 1nqo s VAL 30 Ca -0.09 -0.86 0.05 0.00 -1.81 0.00 0.00 61.98 59.26 1nqo s VAL 30 Cb -0.02 -0.58 -0.01 0.00 0.56 0.00 0.00 36.38 36.34 1nqo s VAL 30 CO 0.07 -0.23 -0.16 0.21 -0.31 0.00 0.00 175.10 174.68 1nqo s ASN 31 N -1.18 2.01 0.00 4.85 2.47 0.33 -0.25 114.94 123.16 1nqo s ASN 31 Ca -0.06 -0.32 0.00 0.00 0.42 0.00 0.00 52.86 52.90 1nqo s ASN 31 Cb -0.08 -0.39 0.00 0.00 -1.45 0.00 0.00 41.25 39.33 1nqo s ASN 31 CO 0.00 0.17 0.00 -0.67 -3.72 0.00 0.00 177.10 172.89 1nqo n ASP 32 N 2.91 0.00 -0.68 -4.21 2.03 -0.80 0.01 116.55 115.81 1nqo n ASP 32 Ca -0.16 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.21 1nqo n ASP 32 Cb 0.54 0.00 0.18 0.00 -0.72 0.00 0.00 41.12 41.11 1nqo n ASP 32 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1nqo n LEU 33 N 0.00 2.42 0.00 -2.67 4.77 -1.26 -3.69 117.00 116.57 1nqo n LEU 33 Ca 0.00 -3.55 0.00 0.00 -0.03 0.00 0.00 56.01 52.43 1nqo n LEU 33 Cb 0.00 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 1nqo n LEU 33 CO 0.00 1.22 0.00 1.07 -1.33 0.00 0.00 177.39 178.35 1nqo n THR 34 N -0.91 0.00 -3.49 -5.08 5.66 -1.26 -5.10 114.28 104.10 1nqo n THR 34 Ca 0.17 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.91 1nqo n THR 34 Cb 0.75 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.51 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 -0.96 6.35 0.43 1.09 1.47 -1.26 -4.76 116.67 119.02 1nqo s ASP 36 Ca 0.00 0.46 0.17 0.00 1.18 0.00 0.00 52.55 54.36 1nqo s ASP 36 Cb 0.00 -2.03 1.09 0.00 -0.34 0.00 0.00 42.92 41.63 1nqo s ASP 36 CO 0.00 -0.20 1.89 0.00 0.68 0.00 0.00 175.17 177.54 1nqo h ALA 37 N 1.25 2.19 -0.84 2.11 0.00 -1.92 -0.77 119.26 121.29 1nqo h ALA 37 Ca -0.49 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1nqo h ALA 37 Cb 1.21 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 1nqo h ALA 37 CO 0.64 -0.44 0.40 -0.97 0.00 0.00 0.00 179.25 178.88 1nqo h ASN 38 N 0.39 1.09 -0.10 0.00 -1.24 -1.92 0.12 115.58 113.93 1nqo h ASN 38 Ca 0.42 -0.13 -0.09 0.00 0.71 0.00 0.00 56.30 57.21 1nqo h ASN 38 Cb 1.05 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.82 1nqo h ASN 38 CO -0.14 0.92 -0.27 0.74 -1.29 0.00 0.00 177.43 177.38 1nqo h THR 39 N 1.19 1.40 -0.70 -3.57 2.02 -1.56 -2.53 112.91 109.16 1nqo h THR 39 Ca 0.29 -1.60 -0.02 0.00 0.77 0.00 0.00 66.41 65.84 1nqo h THR 39 Cb 0.11 2.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 1nqo h THR 39 CO -0.04 0.46 0.34 -0.07 0.37 0.00 0.00 175.52 176.59 1nqo h LEU 40 N -0.09 0.90 -0.48 2.58 3.38 -1.23 -1.32 115.31 119.06 1nqo h LEU 40 Ca -0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1nqo h LEU 40 Cb 0.88 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1nqo h LEU 40 CO 0.06 0.76 0.15 0.00 0.09 0.00 0.00 178.44 179.50 1nqo h ALA 41 N 1.38 0.63 -0.59 1.53 0.00 -0.76 -0.74 119.26 120.71 1nqo h ALA 41 Ca 0.24 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1nqo h ALA 41 Cb 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1nqo h ALA 41 CO -0.03 0.28 0.14 1.25 0.00 0.00 0.00 179.25 180.89 1nqo h HIS 42 N 0.64 0.96 -0.12 0.00 -0.00 -1.02 -1.61 115.15 114.01 1nqo h HIS 42 Ca 0.16 -0.10 -0.17 0.00 -0.00 0.00 0.00 60.37 60.26 1nqo h HIS 42 Cb 0.26 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.39 1nqo h HIS 42 CO 0.01 0.80 -0.64 -0.07 -0.00 0.00 0.00 177.93 178.03 1nqo h LEU 43 N 0.88 0.50 -0.87 0.26 3.38 -0.98 -2.43 115.31 116.05 1nqo h LEU 43 Ca 0.19 -0.29 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 1nqo h LEU 43 Cb 0.32 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1nqo h LEU 43 CO 0.00 1.00 -0.54 0.25 0.09 0.00 0.00 178.44 179.25 1nqo h LEU 44 N 0.31 0.09 0.04 1.67 5.85 -0.88 -3.30 115.31 119.10 1nqo h LEU 44 Ca -0.01 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 1nqo h LEU 44 Cb 1.19 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.20 1nqo h LEU 44 CO 0.11 0.61 -0.33 0.50 -0.34 0.00 0.00 178.44 178.99 1nqo h LYS 45 N 0.06 0.15 -4.72 1.25 3.64 -1.24 -3.39 116.57 112.32 1nqo h LYS 45 Ca -0.00 -0.22 -0.69 0.00 -1.27 0.00 0.00 60.65 58.47 1nqo h LYS 45 Cb 0.97 0.07 -0.30 0.00 -0.41 0.00 0.00 32.23 32.56 1nqo h LYS 45 CO 0.07 1.05 -0.65 0.71 -2.27 0.00 0.00 179.45 178.36 1nqo s TYR 46 N -2.59 3.25 -0.23 1.91 2.02 -0.92 -1.14 117.35 119.65 1nqo s TYR 46 Ca -0.16 -1.57 -0.03 0.00 -0.37 0.00 0.00 57.07 54.94 1nqo s TYR 46 Cb -0.01 -2.20 0.01 0.00 -0.40 0.00 0.00 41.96 39.36 1nqo s TYR 46 CO 0.75 -0.75 -0.05 0.34 -1.57 0.00 0.00 175.55 174.27 1nqo s ASP 47 N 1.35 4.25 0.59 2.29 -1.08 -1.17 -4.67 116.67 118.23 1nqo s ASP 47 Ca -0.03 -0.58 0.29 0.00 -0.52 0.00 0.00 52.55 51.71 1nqo s ASP 47 Cb -0.19 -1.70 1.68 0.00 -1.46 0.00 0.00 42.92 41.24 1nqo s ASP 47 CO 0.01 -0.06 2.12 0.28 0.52 0.00 0.00 175.17 178.04 1nqo h SER 48 N 8.08 0.00 0.01 -0.34 0.02 -1.93 -0.70 113.55 118.69 1nqo h SER 48 Ca -0.39 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.16 1nqo h SER 48 Cb 1.14 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.62 1nqo h SER 48 CO 0.60 0.00 -2.36 0.52 -1.14 0.00 0.00 176.83 174.45 1nqo n VAL 49 N -3.81 1.54 -0.33 2.27 0.31 -1.26 -4.69 118.33 112.36 1nqo n VAL 49 Ca 0.01 -0.44 0.09 0.00 -0.01 0.00 0.00 64.34 63.99 1nqo n VAL 49 Cb 0.29 -1.72 0.25 0.00 -0.91 0.00 0.00 33.84 31.76 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 -3.84 0.80 -0.17 3.52 8.25 -1.18 -5.00 115.22 117.59 1nqo n HIS 50 Ca -0.48 -0.52 0.02 0.00 -0.26 0.00 0.00 57.72 56.48 1nqo n HIS 50 Cb 0.92 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.98 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 1.03 -2.24 3.74 -1.41 0.00 -0.28 -4.85 105.19 101.19 1nqo n GLY 51 Ca 0.19 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 1nqo n GLY 51 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nqo s ARG 52 N -1.08 4.38 0.21 1.61 3.52 -1.26 -3.06 118.95 123.26 1nqo s ARG 52 Ca 0.00 2.08 -0.31 0.00 -0.13 0.00 0.00 55.73 57.37 1nqo s ARG 52 Cb 0.00 -3.19 -0.11 0.00 -1.56 0.00 0.00 34.95 30.10 1nqo s ARG 52 CO 0.00 -0.27 1.58 -1.17 -0.81 0.00 0.00 175.30 174.63 1nqo s LEU 53 N -0.12 4.37 -1.25 -0.88 2.96 -0.29 -4.90 118.68 118.56 1nqo s LEU 53 Ca 0.57 2.74 -0.15 0.00 -0.22 0.00 0.00 54.13 57.07 1nqo s LEU 53 Cb -0.37 -3.61 0.13 0.00 0.50 0.00 0.00 46.19 42.84 1nqo s LEU 53 CO 0.39 -0.85 1.59 -0.67 -1.32 0.00 0.00 176.35 175.48 1nqo n ASP 54 N 3.36 5.08 -3.60 3.68 2.03 -1.26 -4.86 116.55 120.98 1nqo n ASP 54 Ca 0.12 -2.95 -0.03 0.00 0.52 0.00 0.00 54.79 52.44 1nqo n ASP 54 Cb 0.38 -1.65 -0.02 0.00 -0.72 0.00 0.00 41.12 39.12 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 2.70 -2.10 -0.30 -1.67 0.00 -1.26 -5.12 121.76 114.00 1nqo s ALA 55 Ca 0.48 1.36 -0.29 0.00 0.00 0.00 0.00 51.96 53.51 1nqo s ALA 55 Cb 0.01 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.15 1nqo s ALA 55 CO 0.03 -0.71 1.16 -1.21 0.00 0.00 0.00 175.76 175.04 1nqo s GLU 56 N -2.45 4.02 -0.10 0.00 0.41 -1.26 -4.90 118.70 114.42 1nqo s GLU 56 Ca 0.10 1.16 0.01 0.00 -0.41 0.00 0.00 54.97 55.84 1nqo s GLU 56 Cb 0.00 -3.79 0.02 0.00 -1.78 0.00 0.00 34.13 28.58 1nqo s GLU 56 CO -0.04 -0.97 -0.12 0.08 -0.49 0.00 0.00 175.26 173.72 1nqo s VAL 57 N 3.89 1.25 0.35 2.63 1.01 -1.26 -0.12 120.40 128.15 1nqo s VAL 57 Ca 0.50 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1nqo s VAL 57 Cb -0.14 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.09 1nqo s VAL 57 CO 0.18 0.39 0.58 -0.94 0.00 0.00 0.00 175.10 175.31 1nqo s SER 58 N 1.08 0.55 -0.08 3.32 1.04 -0.52 -5.01 113.70 114.08 1nqo s SER 58 Ca -0.06 -1.33 0.03 0.00 0.48 0.00 0.00 55.95 55.07 1nqo s SER 58 Cb -0.14 0.72 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 1nqo s SER 58 CO -0.02 -1.42 -0.17 -0.69 0.98 0.00 0.00 173.24 171.93 1nqo s VAL 59 N -2.88 2.79 -0.83 5.02 1.01 -1.26 -1.11 120.40 123.15 1nqo s VAL 59 Ca 0.25 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1nqo s VAL 59 Cb -0.02 -2.11 0.26 0.00 0.00 0.00 0.00 36.38 34.51 1nqo s VAL 59 CO 0.17 0.56 0.99 -3.20 0.00 0.00 0.00 175.10 173.61 1nqo n ASN 60 N 2.96 4.69 0.00 3.32 5.15 0.15 -4.91 115.26 126.62 1nqo n ASN 60 Ca -0.18 -3.38 0.00 0.00 -0.60 0.00 0.00 54.58 50.42 1nqo n ASN 60 Cb 0.52 -0.93 0.00 0.00 -0.53 0.00 0.00 39.78 38.85 1nqo n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1nqo n GLY 61 N 1.26 1.30 0.00 8.20 0.00 -1.26 -2.18 105.19 112.51 1nqo n GLY 61 Ca 0.27 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1nqo n GLY 61 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nqo n ASN 62 N 2.85 0.91 -4.45 1.61 4.05 -1.26 -4.94 115.26 114.03 1nqo n ASN 62 Ca 0.00 -1.04 -0.24 0.00 0.45 0.00 0.00 54.58 53.75 1nqo n ASN 62 Cb 0.00 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 40.91 1nqo n ASN 62 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 1nqo s ASN 63 N -0.04 2.73 0.04 1.20 0.02 -0.93 -4.17 114.94 113.80 1nqo s ASN 63 Ca 0.00 -1.43 -0.01 0.00 -1.02 0.00 0.00 52.86 50.41 1nqo s ASN 63 Cb 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 41.25 41.21 1nqo s ASN 63 CO 0.00 -0.64 0.19 -0.76 0.02 0.00 0.00 177.10 175.91 1nqo s LEU 64 N -3.56 4.32 -0.20 0.60 1.43 -0.19 0.32 118.68 121.40 1nqo s LEU 64 Ca 0.33 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.71 1nqo s LEU 64 Cb 0.08 -2.82 0.05 0.00 0.03 0.00 0.00 46.19 43.53 1nqo s LEU 64 CO 0.15 0.20 -0.08 -0.69 0.23 0.00 0.00 176.35 176.16 1nqo s VAL 65 N -1.44 1.49 -0.20 -1.59 1.01 -0.26 0.98 120.40 120.39 1nqo s VAL 65 Ca 0.32 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1nqo s VAL 65 Cb -0.13 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.66 1nqo s VAL 65 CO 0.25 0.11 -0.17 -0.69 0.00 0.00 0.00 175.10 174.60 1nqo s VAL 66 N 1.45 2.01 -1.31 2.92 1.01 0.39 -1.44 120.40 125.44 1nqo s VAL 66 Ca -0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 1nqo s VAL 66 Cb -0.16 -1.91 -0.00 0.00 0.00 0.00 0.00 36.38 34.30 1nqo s VAL 66 CO -0.08 0.37 0.66 0.59 0.00 0.00 0.00 175.10 176.64 1nqo n ASN 67 N 4.60 -1.34 0.00 3.32 3.02 0.83 -1.82 115.26 123.88 1nqo n ASN 67 Ca -0.19 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 1nqo n ASN 67 Cb 0.48 -3.86 0.00 0.00 -0.61 0.00 0.00 39.78 35.79 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 -1.65 2.01 3.79 7.41 0.00 -1.26 -4.98 105.19 110.51 1nqo n GLY 68 Ca -0.29 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 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 3.51 -0.19 1.61 -0.14 -0.75 -5.02 119.74 118.75 1nqo s LYS 69 Ca 0.00 1.44 -0.04 0.00 -1.36 0.00 0.00 55.97 56.00 1nqo s LYS 69 Cb 0.00 -2.04 -0.02 0.00 -1.68 0.00 0.00 37.83 34.09 1nqo s LYS 69 CO 0.00 -0.69 -0.02 -2.00 -0.76 0.00 0.00 175.35 171.88 1nqo s GLU 70 N -3.42 3.57 -0.24 1.68 2.12 -1.26 -0.46 118.70 120.69 1nqo s GLU 70 Ca 0.69 -0.55 -0.07 0.00 0.36 0.00 0.00 54.97 55.40 1nqo s GLU 70 Cb -0.19 -3.01 -0.03 0.00 0.26 0.00 0.00 34.13 31.15 1nqo s GLU 70 CO 0.26 0.03 0.07 0.42 -0.54 0.00 0.00 175.26 175.50 1nqo s ILE 71 N 0.94 4.42 0.01 -3.70 -1.09 0.28 -4.91 121.20 117.15 1nqo s ILE 71 Ca 0.01 -0.14 -0.30 0.00 -2.23 0.00 0.00 60.65 57.98 1nqo s ILE 71 Cb -0.14 -3.06 -0.06 0.00 -1.58 0.00 0.00 42.46 37.62 1nqo s ILE 71 CO 0.01 0.36 1.42 -0.63 -1.23 0.00 0.00 174.94 174.87 1nqo s ILE 72 N 1.39 3.64 -0.30 2.92 1.01 -0.13 -1.02 121.20 128.71 1nqo s ILE 72 Ca 0.05 1.04 -0.11 0.00 0.00 0.00 0.00 60.65 61.64 1nqo s ILE 72 Cb -0.15 -3.67 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 1nqo s ILE 72 CO 0.04 0.00 0.19 -0.69 0.00 0.00 0.00 174.94 174.48 1nqo s VAL 73 N 2.34 5.11 0.23 2.92 1.01 -1.26 -0.81 120.40 129.95 1nqo s VAL 73 Ca 0.65 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.66 1nqo s VAL 73 Cb -0.32 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1nqo s VAL 73 CO 0.27 0.17 0.15 -0.54 0.00 0.00 0.00 175.10 175.15 1nqo s LYS 74 N 1.72 2.81 -0.38 2.72 1.02 0.66 -4.91 119.74 123.37 1nqo s LYS 74 Ca 0.06 -1.08 0.11 0.00 0.02 0.00 0.00 55.97 55.09 1nqo s LYS 74 Cb -0.16 -2.51 0.33 0.00 -0.52 0.00 0.00 37.83 34.97 1nqo s LYS 74 CO 0.10 0.41 0.70 0.00 -0.92 0.00 0.00 175.35 175.64 1nqo n ALA 75 N -0.94 2.00 -3.43 5.17 0.00 -1.26 -1.91 120.51 120.14 1nqo n ALA 75 Ca -0.08 -3.35 -0.37 0.00 0.00 0.00 0.00 53.44 49.65 1nqo n ALA 75 Cb 0.57 -0.92 -0.13 0.00 0.00 0.00 0.00 19.45 18.98 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 -2.12 2.50 0.42 0.00 0.41 -1.24 -4.94 118.70 113.73 1nqo s GLU 76 Ca 0.39 -1.28 0.11 0.00 -0.41 0.00 0.00 54.97 53.77 1nqo s GLU 76 Cb 0.31 -3.39 0.90 0.00 -1.78 0.00 0.00 34.13 30.17 1nqo s GLU 76 CO -0.09 -0.70 1.99 -0.09 -0.49 0.00 0.00 175.26 175.88 1nqo h ARG 77 N 8.14 0.22 -4.90 1.61 2.43 -1.98 -3.39 114.38 116.50 1nqo h ARG 77 Ca -0.22 -0.04 -0.66 0.00 -0.81 0.00 0.00 59.98 58.26 1nqo h ARG 77 Cb 1.07 -0.04 -0.17 0.00 -0.42 0.00 0.00 29.97 30.41 1nqo h ARG 77 CO 0.60 0.29 -0.36 0.34 -1.51 0.00 0.00 179.97 179.33 1nqo s ASP 78 N -6.90 6.14 0.51 -3.80 -1.08 -1.26 -4.96 116.67 105.32 1nqo s ASP 78 Ca -0.06 -0.22 0.22 0.00 -0.52 0.00 0.00 52.55 51.98 1nqo s ASP 78 Cb 0.16 -2.17 1.33 0.00 -1.46 0.00 0.00 42.92 40.77 1nqo s ASP 78 CO 0.72 -0.27 2.01 -0.65 0.52 0.00 0.00 175.17 177.50 1nqo h PRO 79 N 8.44 0.06 -0.01 4.34 0.11 -1.94 -1.81 132.00 141.19 1nqo h PRO 79 Ca -0.31 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1nqo h PRO 79 Cb 1.15 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1nqo h PRO 79 CO 0.66 0.04 0.02 1.49 -0.21 0.00 0.00 178.00 180.00 1nqo h GLU 80 N 0.06 0.00 -0.55 1.05 4.81 -1.93 -2.13 114.58 115.89 1nqo h GLU 80 Ca 0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1nqo h GLU 80 Cb 0.81 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1nqo h GLU 80 CO -0.01 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.36 1nqo n ASN 81 N -3.30 4.70 0.21 1.04 5.03 -0.68 -4.56 115.26 117.71 1nqo n ASN 81 Ca -0.03 -2.61 0.10 0.00 0.87 0.00 0.00 54.58 52.91 1nqo n ASN 81 Cb 0.10 -0.57 0.30 0.00 -1.02 0.00 0.00 39.78 38.58 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 3.53 0.00 -2.26 3.41 3.38 -1.53 -3.48 115.31 118.36 1nqo h LEU 82 Ca 0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 1nqo h LEU 82 Cb 1.51 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 1nqo h LEU 82 CO 0.27 0.16 -0.90 0.00 0.09 0.00 0.00 178.44 178.06 1nqo n ALA 83 N -2.15 -2.15 0.01 1.53 0.00 -1.26 -4.87 120.51 111.62 1nqo n ALA 83 Ca 0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 53.44 53.18 1nqo n ALA 83 Cb 0.51 -2.08 0.29 0.00 0.00 0.00 0.00 19.45 18.18 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 -1.88 0.52 -0.31 0.00 -0.00 -1.28 -2.78 115.95 110.22 1nqo h TRP 84 Ca -0.64 -0.06 -0.00 0.00 -0.00 0.00 0.00 58.89 58.19 1nqo h TRP 84 Cb 1.37 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 30.37 1nqo h TRP 84 CO 0.45 0.54 0.18 0.78 -0.00 0.00 0.00 178.44 180.38 1nqo h GLY 85 N 0.84 0.44 2.00 1.49 0.00 -1.18 -1.81 103.07 104.85 1nqo h GLY 85 Ca 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1nqo h GLY 85 CO 0.01 0.17 -0.14 0.83 0.00 0.00 0.00 176.54 177.42 1nqo h GLU 86 N 0.42 0.00 -0.20 4.80 5.08 -1.75 -2.99 114.58 119.94 1nqo h GLU 86 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1nqo h GLU 86 Cb -0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nqo h GLU 86 CO -0.02 0.14 0.00 0.44 -1.00 0.00 0.00 179.01 178.57 1nqo n ILE 87 N -3.35 2.17 -1.59 3.13 -5.35 -0.91 -4.98 119.36 108.48 1nqo n ILE 87 Ca -0.00 -1.95 -0.15 0.00 -0.27 0.00 0.00 62.75 60.38 1nqo n ILE 87 Cb 0.34 -0.24 -0.05 0.00 -1.74 0.00 0.00 39.64 37.95 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 -0.70 1.17 3.66 3.28 0.00 -1.07 -4.98 105.19 106.56 1nqo n GLY 88 Ca 0.20 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.58 4.52 -0.17 1.61 1.01 -0.73 -4.53 120.40 119.53 1nqo s VAL 89 Ca 0.00 1.83 0.09 0.00 0.00 0.00 0.00 61.98 63.90 1nqo s VAL 89 Cb 0.00 -4.18 -0.23 0.00 0.00 0.00 0.00 36.38 31.97 1nqo s VAL 89 CO 0.00 -0.15 0.15 0.47 0.00 0.00 0.00 175.10 175.57 1nqo n ASP 90 N 6.35 0.98 -4.13 3.32 8.00 -0.65 -4.19 116.55 126.22 1nqo n ASP 90 Ca 0.13 0.08 -0.29 0.00 0.71 0.00 0.00 54.79 55.42 1nqo n ASP 90 Cb 0.46 0.17 -0.17 0.00 -0.02 0.00 0.00 41.12 41.56 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 -2.53 1.64 -0.08 0.53 1.01 -1.14 -0.66 121.20 119.97 1nqo s ILE 91 Ca -0.17 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.73 1nqo s ILE 91 Cb 0.07 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 41.09 1nqo s ILE 91 CO 0.76 0.47 -0.17 -0.69 0.00 0.00 0.00 174.94 175.30 1nqo s VAL 92 N 0.44 2.72 -0.45 2.92 1.01 -0.31 -1.15 120.40 125.58 1nqo s VAL 92 Ca -0.16 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 60.83 1nqo s VAL 92 Cb -0.17 -2.08 0.04 0.00 0.00 0.00 0.00 36.38 34.18 1nqo s VAL 92 CO 0.06 0.56 0.49 -0.69 0.00 0.00 0.00 175.10 175.53 1nqo s VAL 93 N -0.12 5.04 -0.82 2.92 1.01 0.16 -0.52 120.40 128.07 1nqo s VAL 93 Ca -0.03 -0.49 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 1nqo s VAL 93 Cb -0.14 -4.14 0.09 0.00 0.00 0.00 0.00 36.38 32.19 1nqo s VAL 93 CO 0.04 -0.57 1.11 -0.70 0.00 0.00 0.00 175.10 174.98 1nqo s GLU 94 N 2.23 3.37 -0.29 2.72 2.56 0.20 -0.82 118.70 128.67 1nqo s GLU 94 Ca 0.12 -1.19 0.12 0.00 0.00 0.00 0.00 54.97 54.02 1nqo s GLU 94 Cb -0.19 -4.64 0.47 0.00 2.00 0.00 0.00 34.13 31.78 1nqo s GLU 94 CO 0.12 -1.87 1.16 -1.13 -0.56 0.00 0.00 175.26 172.97 1nqo n SER 95 N 7.52 3.76 0.03 -1.70 3.41 -0.06 -1.55 113.62 125.02 1nqo n SER 95 Ca 0.12 -3.17 -0.00 0.00 -0.26 0.00 0.00 58.87 55.56 1nqo n SER 95 Cb 0.48 -0.39 -0.09 0.00 -0.26 0.00 0.00 64.21 63.95 1nqo n SER 95 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nqo n THR 96 N -0.65 1.18 -0.16 6.66 -2.24 -1.06 -4.59 114.28 113.43 1nqo n THR 96 Ca 0.31 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1nqo n THR 96 Cb 0.90 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1nqo n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nqo n GLY 97 N 1.41 1.18 0.00 3.38 0.00 -1.26 -4.88 105.19 105.02 1nqo n GLY 97 Ca -0.10 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.99 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 1.36 -2.59 1.61 5.12 -1.26 -4.66 116.66 114.24 1nqo n ARG 98 Ca 0.00 -0.04 -0.26 0.00 -1.93 0.00 0.00 57.85 55.62 1nqo n ARG 98 Cb 0.00 -1.30 -0.01 0.00 -1.16 0.00 0.00 32.46 29.99 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 -1.54 3.43 1.12 -1.55 3.72 -1.26 -4.78 117.46 116.59 1nqo n PHE 99 Ca 0.02 -3.29 0.14 0.00 -0.05 0.00 0.00 57.45 54.26 1nqo n PHE 99 Cb 0.30 -0.18 0.54 0.00 -0.94 0.00 0.00 39.48 39.20 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 -0.41 0.00 -3.27 4.37 -2.24 -1.26 -3.91 114.28 107.56 1nqo n THR 100 Ca 0.36 -0.01 -0.39 0.00 -2.27 0.00 0.00 64.05 61.74 1nqo n THR 100 Cb 0.61 -0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 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 -2.86 4.22 0.39 -0.78 1.02 -1.26 -1.24 119.74 119.22 1nqo s LYS 101 Ca 0.17 0.72 0.08 0.00 0.02 0.00 0.00 55.97 56.97 1nqo s LYS 101 Cb 0.19 -3.26 0.83 0.00 -0.52 0.00 0.00 37.83 35.07 1nqo s LYS 101 CO 0.56 0.58 1.97 -0.09 -0.92 0.00 0.00 175.35 177.45 1nqo h ARG 102 N 4.81 0.62 -0.59 1.68 2.43 -1.51 -0.40 114.38 121.43 1nqo h ARG 102 Ca -0.49 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.68 1nqo h ARG 102 Cb 1.21 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 1nqo h ARG 102 CO 0.65 0.41 0.39 1.05 -1.51 0.00 0.00 179.97 180.96 1nqo h GLU 103 N 0.64 0.67 0.08 0.20 4.11 -1.93 0.17 114.58 118.52 1nqo h GLU 103 Ca 0.29 -0.04 -0.19 0.00 0.07 0.00 0.00 59.36 59.48 1nqo h GLU 103 Cb 0.30 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1nqo h GLU 103 CO -0.09 0.44 -0.98 -0.44 0.07 0.00 0.00 179.01 178.01 1nqo h ASP 104 N 0.69 0.26 -0.38 3.06 3.32 -1.55 -3.36 116.42 118.46 1nqo h ASP 104 Ca 0.24 -0.85 -0.01 0.00 0.02 0.00 0.00 57.03 56.43 1nqo h ASP 104 Cb 0.09 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1nqo h ASP 104 CO -0.06 1.43 0.20 0.00 -1.72 0.00 0.00 179.24 179.08 1nqo h ALA 105 N -0.08 1.58 0.00 3.45 0.00 -0.94 -1.67 119.26 121.59 1nqo h ALA 105 Ca -0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1nqo h ALA 105 Cb 1.51 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1nqo h ALA 105 CO 0.02 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.61 1nqo h ALA 106 N 1.65 1.00 -0.25 0.00 0.00 -0.81 -1.76 119.26 119.08 1nqo h ALA 106 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1nqo h ALA 106 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1nqo h ALA 106 CO -0.02 0.00 0.15 0.87 0.00 0.00 0.00 179.25 180.25 1nqo h LYS 107 N 0.00 0.34 -0.41 0.00 1.57 -1.46 -0.76 116.57 115.84 1nqo h LYS 107 Ca 0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1nqo h LYS 107 Cb 0.09 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1nqo h LYS 107 CO 0.00 0.24 0.20 0.45 -0.57 0.00 0.00 179.45 179.77 1nqo h HIS 108 N 0.34 0.55 -0.20 -1.35 3.86 -1.51 -0.88 115.15 115.97 1nqo h HIS 108 Ca 0.09 -0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.19 1nqo h HIS 108 Cb -0.01 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.28 1nqo h HIS 108 CO 0.00 0.41 -0.28 -0.07 0.86 0.00 0.00 177.93 178.85 1nqo h LEU 109 N 0.57 0.60 -2.04 2.43 3.38 -1.32 -2.04 115.31 116.89 1nqo h LEU 109 Ca 0.15 -0.51 0.07 0.00 0.09 0.00 0.00 57.88 57.68 1nqo h LEU 109 Cb 0.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1nqo h LEU 109 CO -0.02 0.99 0.19 -0.33 0.09 0.00 0.00 178.44 179.36 1nqo h GLU 110 N 0.22 0.00 -0.04 1.13 5.08 -0.89 0.12 114.58 120.20 1nqo h GLU 110 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1nqo h GLU 110 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1nqo h GLU 110 CO 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.08 1nqo n ALA 111 N -2.56 2.60 0.00 3.43 0.00 -0.41 -4.88 120.51 118.69 1nqo n ALA 111 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1nqo n ALA 111 Cb 0.35 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 0.94 0.80 3.89 0.00 0.00 0.43 -0.78 105.19 110.47 1nqo n GLY 112 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.00 3.21 -0.19 4.61 0.00 -0.80 -3.86 121.76 122.73 1nqo s ALA 113 Ca 0.00 -0.30 0.08 0.00 0.00 0.00 0.00 51.96 51.73 1nqo s ALA 113 Cb 0.00 -2.86 -0.17 0.00 0.00 0.00 0.00 23.12 20.08 1nqo s ALA 113 CO 0.00 -0.61 -0.08 1.63 0.00 0.00 0.00 175.76 176.70 1nqo n LYS 114 N -2.59 0.86 -4.12 0.00 5.02 0.13 -4.36 118.16 113.11 1nqo n LYS 114 Ca 0.04 0.06 -0.15 0.00 -2.02 0.00 0.00 58.31 56.24 1nqo n LYS 114 Cb 0.55 -1.43 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 1nqo n LYS 114 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nqo s LYS 115 N -2.42 0.65 -0.07 1.97 -0.14 0.16 -4.84 119.74 115.05 1nqo s LYS 115 Ca -0.20 -0.82 -0.00 0.00 -1.36 0.00 0.00 55.97 53.60 1nqo s LYS 115 Cb 0.06 -0.52 0.02 0.00 -1.68 0.00 0.00 37.83 35.72 1nqo s LYS 115 CO 0.59 0.11 -0.04 0.08 -0.76 0.00 0.00 175.35 175.33 1nqo s VAL 116 N -1.29 0.62 -0.40 3.17 1.01 -0.08 -1.16 120.40 122.27 1nqo s VAL 116 Ca -0.06 -0.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 1nqo s VAL 116 Cb -0.10 -0.68 0.06 0.00 0.00 0.00 0.00 36.38 35.67 1nqo s VAL 116 CO 0.01 0.27 0.24 -0.63 0.00 0.00 0.00 175.10 175.00 1nqo s ILE 117 N 1.43 4.32 -0.19 2.22 1.01 0.33 -0.34 121.20 129.98 1nqo s ILE 117 Ca -0.03 -1.23 -0.29 0.00 0.00 0.00 0.00 60.65 59.10 1nqo s ILE 117 Cb -0.13 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 38.77 1nqo s ILE 117 CO -0.03 -0.42 1.07 -0.63 0.00 0.00 0.00 174.94 174.94 1nqo s ILE 118 N 1.46 4.62 -0.00 2.92 1.01 0.24 -0.63 121.20 130.82 1nqo s ILE 118 Ca 0.02 1.94 -0.01 0.00 0.00 0.00 0.00 60.65 62.60 1nqo s ILE 118 Cb -0.22 -4.25 -0.06 0.00 0.01 0.00 0.00 42.46 37.94 1nqo s ILE 118 CO 0.03 -0.13 2.35 -1.54 0.00 0.00 0.00 174.94 175.66 1nqo n SER 119 N 6.08 5.33 -3.63 3.58 3.41 -0.60 -1.67 113.62 126.12 1nqo n SER 119 Ca 0.12 -2.43 0.03 0.00 -0.26 0.00 0.00 58.87 56.33 1nqo n SER 119 Cb 0.46 -1.19 -0.00 0.00 -0.26 0.00 0.00 64.21 63.22 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 0.21 -2.42 0.45 7.33 0.00 -1.17 -4.90 121.76 121.26 1nqo s ALA 120 Ca 0.15 0.73 -0.24 0.00 0.00 0.00 0.00 51.96 52.60 1nqo s ALA 120 Cb 0.07 0.38 -0.09 0.00 0.00 0.00 0.00 23.12 23.48 1nqo s ALA 120 CO -0.00 -1.07 1.10 -2.30 0.00 0.00 0.00 175.76 173.49 1nqo n PRO 121 N -0.56 1.49 -4.50 0.00 -0.02 -1.24 -4.14 135.00 126.03 1nqo n PRO 121 Ca -0.07 0.54 -0.23 0.00 -2.02 0.00 0.00 63.50 61.71 1nqo n PRO 121 Cb 0.63 -2.19 -0.10 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.28 2.63 -0.17 3.55 0.00 -1.26 -4.89 121.76 120.34 1nqo s ALA 122 Ca 0.64 -1.86 -0.02 0.00 0.00 0.00 0.00 51.96 50.73 1nqo s ALA 122 Cb -0.52 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 1nqo s ALA 122 CO 0.56 -0.28 -0.10 0.21 0.00 0.00 0.00 175.76 176.15 1nqo s LYS 122 N -3.84 3.37 -1.68 0.00 2.20 -0.37 -4.62 119.74 114.79 1nqo s LYS 122 Ca 0.33 -0.66 0.00 0.00 -0.36 0.00 0.00 55.97 55.27 1nqo s LYS 122 Cb 0.07 -2.78 0.00 0.00 -1.51 0.00 0.00 37.83 33.61 1nqo s LYS 122 CO 0.15 0.03 0.00 0.09 -0.36 0.00 0.00 175.35 175.25 1nqo n ASN 123 N 4.09 -5.52 -4.77 1.43 3.02 -1.26 -1.40 115.26 110.85 1nqo n ASN 123 Ca -0.18 0.02 -0.33 0.00 -0.03 0.00 0.00 54.58 54.06 1nqo n ASN 123 Cb 0.52 -4.58 0.05 0.00 -0.61 0.00 0.00 39.78 35.16 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 -4.86 2.70 0.41 3.52 1.03 -1.26 -4.68 118.70 115.55 1nqo s GLU 124 Ca 0.00 1.36 0.17 0.00 0.03 0.00 0.00 54.97 56.53 1nqo s GLU 124 Cb 0.00 -1.94 0.88 0.00 -0.80 0.00 0.00 34.13 32.27 1nqo s GLU 124 CO 0.00 -1.32 1.87 -0.44 -1.33 0.00 0.00 175.26 174.04 1nqo h ASP 125 N -0.17 0.00 -3.23 0.83 3.32 -1.48 -3.46 116.42 112.25 1nqo h ASP 125 Ca -0.46 0.00 0.16 0.00 0.02 0.00 0.00 57.03 56.74 1nqo h ASP 125 Cb 1.24 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.52 1nqo h ASP 125 CO 0.54 0.31 0.74 -0.51 -1.72 0.00 0.00 179.24 178.60 1nqo s ILE 126 N -4.11 0.00 -0.20 0.35 2.07 -1.24 -4.95 121.20 113.13 1nqo s ILE 126 Ca -0.02 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.17 1nqo s ILE 126 Cb 0.14 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.70 1nqo s ILE 126 CO 0.69 0.00 -0.01 -0.89 -1.91 0.00 0.00 174.94 172.82 1nqo s THR 127 N -0.64 3.85 -0.03 4.00 2.01 -1.26 -1.39 115.64 122.18 1nqo s THR 127 Ca 0.05 -0.35 0.07 0.00 0.31 0.00 0.00 61.69 61.76 1nqo s THR 127 Cb -0.02 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 1nqo s THR 127 CO -0.06 0.44 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.44 1nqo s ILE 128 N 0.97 2.32 -0.28 1.82 1.01 0.89 -4.67 121.20 123.24 1nqo s ILE 128 Ca 0.01 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 59.68 1nqo s ILE 128 Cb -0.14 -1.83 0.08 0.00 0.01 0.00 0.00 42.46 40.57 1nqo s ILE 128 CO 0.01 0.58 -0.02 -0.69 0.00 0.00 0.00 174.94 174.83 1nqo s VAL 129 N -0.62 1.89 0.04 2.92 1.01 -1.26 -4.15 120.40 120.22 1nqo s VAL 129 Ca 0.10 -1.73 -0.36 0.00 0.00 0.00 0.00 61.98 60.00 1nqo s VAL 129 Cb -0.10 -2.21 -0.15 0.00 0.00 0.00 0.00 36.38 33.92 1nqo s VAL 129 CO -0.00 -0.30 1.59 0.80 0.00 0.00 0.00 175.10 177.18 1nqo n MET 130 N 4.48 1.74 -0.07 2.72 1.56 -1.26 -0.65 117.12 125.64 1nqo n MET 130 Ca -0.06 0.63 0.00 0.00 -0.27 0.00 0.00 57.70 58.00 1nqo n MET 130 Cb 0.43 -2.37 0.00 0.00 2.15 0.00 0.00 33.22 33.43 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 3.44 0.53 0.97 -5.12 0.00 -1.26 -4.88 105.19 98.88 1nqo n GLY 131 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 -2.15 1.61 0.31 0.17 -4.97 118.33 111.30 1nqo n VAL 132 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1nqo n VAL 132 Cb 0.00 -1.36 -0.00 0.00 -0.91 0.00 0.00 33.84 31.56 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 -2.93 0.19 0.34 4.52 6.94 -1.01 -4.87 115.26 118.43 1nqo n ASN 133 Ca 0.00 -1.84 0.23 0.00 -0.02 0.00 0.00 54.58 52.95 1nqo n ASN 133 Cb 0.47 -0.14 1.20 0.00 -2.36 0.00 0.00 39.78 38.95 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 0.30 0.00 0.00 -3.83 -0.00 -1.94 0.48 115.11 110.12 1nqo h GLN 134 Ca -0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.51 1nqo h GLN 134 Cb 1.49 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.97 1nqo h GLN 134 CO -0.00 0.00 -0.03 0.38 -0.00 0.00 0.00 178.83 179.18 1nqo h ASP 135 N 0.00 0.00 0.38 0.06 3.04 -1.96 -1.80 116.42 116.15 1nqo h ASP 135 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1nqo h ASP 135 Cb 0.03 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.32 1nqo h ASP 135 CO 0.00 0.03 0.00 0.29 -2.04 0.00 0.00 179.24 177.52 1nqo n LYS 136 N -3.18 0.58 -2.12 4.15 4.76 0.16 -4.85 118.16 117.66 1nqo n LYS 136 Ca -0.01 0.01 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 1nqo n LYS 136 Cb 0.23 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.90 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 -2.40 3.05 -0.32 2.13 5.04 -0.68 -5.02 117.35 119.16 1nqo s TYR 137 Ca 0.33 1.41 0.01 0.00 -2.44 0.00 0.00 57.07 56.39 1nqo s TYR 137 Cb 0.20 -3.68 0.10 0.00 0.35 0.00 0.00 41.96 38.93 1nqo s TYR 137 CO 0.42 -1.86 0.08 0.34 -1.34 0.00 0.00 175.55 173.19 1nqo s ASP 138 N -0.47 4.30 0.58 4.32 -1.08 -1.26 -5.00 116.67 118.06 1nqo s ASP 138 Ca 0.49 -1.83 0.29 0.00 -0.52 0.00 0.00 52.55 50.98 1nqo s ASP 138 Cb -0.40 -1.15 1.47 0.00 -1.46 0.00 0.00 42.92 41.38 1nqo s ASP 138 CO 0.53 -0.40 1.90 1.55 0.52 0.00 0.00 175.17 179.26 1nqo h PRO 138 N 7.91 0.00 0.00 4.34 0.13 -1.90 0.44 132.00 142.92 1nqo h PRO 138 Ca -0.10 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 1nqo h PRO 138 Cb 1.02 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.14 1nqo h PRO 138 CO 0.49 0.00 -0.74 0.87 -0.23 0.00 0.00 178.00 178.39 1nqo h LYS 139 N 0.00 0.00 0.00 0.86 6.56 -1.94 -3.39 116.57 118.66 1nqo h LYS 139 Ca 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 1nqo h LYS 139 Cb 1.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.92 1nqo h LYS 139 CO -0.00 0.08 -0.25 0.00 -2.06 0.00 0.00 179.45 177.22 1nqo n ALA 140 N -2.19 1.82 -3.00 3.86 0.00 -0.47 -4.98 120.51 115.55 1nqo n ALA 140 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1nqo n ALA 140 Cb 0.60 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.94 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 -1.16 3.27 -0.04 0.00 3.76 0.14 -4.88 115.29 116.39 1nqo s HIS 141 Ca 0.00 -1.19 0.03 0.00 -0.15 0.00 0.00 55.06 53.76 1nqo s HIS 141 Cb 0.00 -2.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.04 1nqo s HIS 141 CO 0.00 -0.73 0.01 0.72 -0.85 0.00 0.00 174.74 173.89 1nqo n HIS 142 N 4.96 0.00 -3.82 1.40 -0.00 -1.26 -4.72 115.22 111.78 1nqo n HIS 142 Ca -0.11 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.25 1nqo n HIS 142 Cb 0.45 -0.18 -0.12 0.00 -0.00 0.00 0.00 29.99 30.13 1nqo n HIS 142 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1nqo s VAL 143 N -2.09 3.18 -0.04 1.59 1.01 -1.26 -0.90 120.40 121.90 1nqo s VAL 143 Ca -0.02 -1.88 0.01 0.00 0.00 0.00 0.00 61.98 60.09 1nqo s VAL 143 Cb 0.01 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 1nqo s VAL 143 CO 0.15 -0.53 -0.02 -0.63 0.00 0.00 0.00 175.10 174.07 1nqo s ILE 144 N 1.16 4.03 -0.11 2.22 1.09 0.54 -1.09 121.20 129.05 1nqo s ILE 144 Ca 0.05 -0.51 -0.03 0.00 -1.10 0.00 0.00 60.65 59.07 1nqo s ILE 144 Cb -0.22 -2.73 -0.03 0.00 -1.06 0.00 0.00 42.46 38.42 1nqo s ILE 144 CO -0.03 0.49 -0.01 -0.55 -0.10 0.00 0.00 174.94 174.73 1nqo s SER 145 N -1.20 5.06 -0.14 3.58 0.15 -0.48 0.79 113.70 121.46 1nqo s SER 145 Ca 0.16 0.03 0.15 0.00 0.70 0.00 0.00 55.95 56.99 1nqo s SER 145 Cb -0.11 -1.58 0.67 0.00 -1.71 0.00 0.00 66.02 63.29 1nqo s SER 145 CO 0.06 0.29 1.56 -3.20 1.20 0.00 0.00 173.24 173.15 1nqo n ASN 146 N 2.72 4.59 0.00 5.45 4.05 -0.67 -0.08 115.26 131.32 1nqo n ASN 146 Ca -0.18 -2.54 0.00 0.00 0.45 0.00 0.00 54.58 52.32 1nqo n ASN 146 Cb 0.53 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 40.95 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 0.85 0.00 -2.62 5.20 0.00 -1.26 -4.79 120.51 117.88 1nqo n ALA 147 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.47 1nqo n ALA 147 Cb 0.90 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.32 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 5.58 0.33 0.00 1.04 -1.26 -3.04 113.70 112.35 1nqo s SER 148 Ca 0.00 -0.32 0.11 0.00 0.48 0.00 0.00 55.95 56.22 1nqo s SER 148 Cb 0.00 -1.22 0.57 0.00 0.10 0.00 0.00 66.02 65.47 1nqo s SER 148 CO 0.00 -0.26 1.74 0.77 0.98 0.00 0.00 173.24 176.47 1nqo h SER 149 N 1.23 0.06 -0.39 7.02 4.64 -1.88 -1.57 113.55 122.66 1nqo h SER 149 Ca -0.47 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 60.80 1nqo h SER 149 Cb 1.25 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1nqo h SER 149 CO 0.58 0.50 0.14 0.74 -0.87 0.00 0.00 176.83 177.92 1nqo h THR 150 N 0.05 1.20 -0.49 2.95 2.02 -1.95 -0.88 112.91 115.82 1nqo h THR 150 Ca 0.00 -0.64 -0.06 0.00 0.77 0.00 0.00 66.41 66.48 1nqo h THR 150 Cb 0.81 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1nqo h THR 150 CO 0.06 0.23 0.06 0.74 0.37 0.00 0.00 175.52 176.98 1nqo h THR 151 N 0.49 1.23 0.00 3.16 2.02 -1.77 -0.93 112.91 117.11 1nqo h THR 151 Ca 0.13 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 1nqo h THR 151 Cb 0.22 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1nqo h THR 151 CO -0.01 0.32 -0.01 0.78 0.37 0.00 0.00 175.52 176.97 1nqo h ASN 152 N 0.74 0.00 0.24 4.18 2.35 -0.79 -0.44 115.58 121.86 1nqo h ASN 152 Ca 0.15 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.56 1nqo h ASN 152 Cb 0.36 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 1nqo h ASN 152 CO 0.01 0.01 -1.89 0.00 -1.65 0.00 0.00 177.43 173.90 1nqo h LEU 154 N 0.05 0.28 -0.45 0.00 5.85 -0.99 -3.40 115.31 116.66 1nqo h LEU 154 Ca -0.38 -0.93 0.09 0.00 0.84 0.00 0.00 57.88 57.51 1nqo h LEU 154 Cb 2.03 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 42.88 1nqo h LEU 154 CO 0.09 1.19 -0.17 0.00 -0.34 0.00 0.00 178.44 179.21 1nqo h ALA 155 N 0.10 0.19 -0.63 1.25 0.00 -1.31 0.41 119.26 119.27 1nqo h ALA 155 Ca -0.07 0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1nqo h ALA 155 Cb 1.31 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 19.49 1nqo h ALA 155 CO 0.08 -0.52 0.28 -1.35 0.00 0.00 0.00 179.25 177.75 1nqo h PRO 156 N -0.08 0.49 0.00 0.00 0.11 -1.78 0.30 132.00 131.04 1nqo h PRO 156 Ca 0.22 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.27 1nqo h PRO 156 Cb 0.41 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 1nqo h PRO 156 CO -0.51 0.32 -0.43 0.27 -0.21 0.00 0.00 178.00 177.45 1nqo h PHE 157 N 0.50 0.00 -0.46 0.65 -5.15 -1.70 -2.92 116.94 107.87 1nqo h PHE 157 Ca 0.31 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.96 1nqo h PHE 157 Cb 0.33 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.48 1nqo h PHE 157 CO -0.13 0.12 -0.19 0.00 -2.00 0.00 0.00 178.31 176.11 1nqo h ALA 158 N 1.88 0.81 0.23 12.09 0.00 -0.12 -1.54 119.26 132.60 1nqo h ALA 158 Ca -0.01 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1nqo h ALA 158 Cb 1.10 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1nqo h ALA 158 CO 0.01 0.65 -0.17 -0.22 0.00 0.00 0.00 179.25 179.53 1nqo h LYS 159 N 0.79 -0.39 0.06 0.00 3.64 -0.37 -1.13 116.57 119.16 1nqo h LYS 159 Ca 0.11 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1nqo h LYS 159 Cb 0.73 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.60 1nqo h LYS 159 CO 0.06 -0.26 -0.21 0.28 -2.27 0.00 0.00 179.45 177.04 1nqo h VAL 160 N -0.41 0.51 -0.46 2.00 2.07 -1.35 -0.87 116.25 117.74 1nqo h VAL 160 Ca -0.01 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.57 1nqo h VAL 160 Cb 0.36 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1nqo h VAL 160 CO -0.00 0.00 0.14 -0.07 0.02 0.00 0.00 177.57 177.66 1nqo h LEU 161 N -0.37 0.11 0.01 2.57 3.38 -1.19 -0.81 115.31 119.01 1nqo h LEU 161 Ca 0.04 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1nqo h LEU 161 Cb 0.42 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1nqo h LEU 161 CO -0.16 0.10 -0.00 -0.74 0.09 0.00 0.00 178.44 177.72 1nqo h HIS 162 N 0.30 -0.01 -0.32 1.13 2.76 -0.93 0.36 115.15 118.43 1nqo h HIS 162 Ca 0.22 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.34 1nqo h HIS 162 Cb 0.24 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 1nqo h HIS 162 CO -0.18 0.21 -0.03 0.93 -1.30 0.00 0.00 177.93 177.57 1nqo h GLU 163 N -0.23 0.51 0.07 5.26 5.08 -1.03 0.33 114.58 124.57 1nqo h GLU 163 Ca -0.00 -0.12 -0.32 0.00 -1.00 0.00 0.00 59.36 57.92 1nqo h GLU 163 Cb 0.23 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1nqo h GLU 163 CO 0.00 0.56 -1.81 1.96 -1.00 0.00 0.00 179.01 178.72 1nqo h GLN 164 N 0.49 0.14 0.00 2.33 1.08 -1.10 -3.43 115.11 114.62 1nqo h GLN 164 Ca 0.10 -0.24 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1nqo h GLN 164 Cb 0.37 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1nqo h GLN 164 CO 0.01 0.88 -0.73 1.19 -0.95 0.00 0.00 178.83 179.23 1nqo n PHE 165 N -3.28 0.00 -0.44 2.96 3.72 0.11 -4.98 117.46 115.55 1nqo n PHE 165 Ca -0.23 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 1nqo n PHE 165 Cb 1.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 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 1.91 -3.37 3.66 1.37 0.00 0.12 -2.37 105.19 106.52 1nqo n GLY 166 Ca 0.00 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.06 5.24 -0.15 -0.61 1.01 -1.26 -1.32 121.20 124.04 1nqo s ILE 167 Ca 0.00 0.56 -0.28 0.00 0.00 0.00 0.00 60.65 60.93 1nqo s ILE 167 Cb 0.00 -3.67 -0.25 0.00 0.01 0.00 0.00 42.46 38.56 1nqo s ILE 167 CO 0.00 0.27 0.67 0.58 0.00 0.00 0.00 174.94 176.45 1nqo h VAL 168 N 5.06 1.63 -1.70 2.92 2.07 -1.48 -3.48 116.25 121.28 1nqo h VAL 168 Ca -0.36 -2.32 0.18 0.00 0.82 0.00 0.00 66.70 65.02 1nqo h VAL 168 Cb 1.16 3.18 -0.19 0.00 -1.52 0.00 0.00 31.29 33.92 1nqo h VAL 168 CO 0.69 0.55 0.68 0.00 0.02 0.00 0.00 177.57 179.52 1nqo s ARG 169 N -2.25 0.49 0.16 1.57 1.70 -1.24 -4.85 118.95 114.54 1nqo s ARG 169 Ca -0.21 -0.11 -0.24 0.00 -0.47 0.00 0.00 55.73 54.70 1nqo s ARG 169 Cb -0.01 0.23 0.06 0.00 -0.57 0.00 0.00 34.95 34.66 1nqo s ARG 169 CO 0.67 -0.20 0.84 0.20 -1.08 0.00 0.00 175.30 175.74 1nqo s GLY 170 N -1.97 -0.29 0.01 3.88 0.00 -0.31 -1.03 107.32 107.61 1nqo s GLY 170 Ca 0.06 0.22 0.01 0.00 0.00 0.00 0.00 44.72 45.01 1nqo s GLY 170 CO -0.05 0.06 -0.05 1.06 0.00 0.00 0.00 173.10 174.12 1nqo s MET 171 N -3.47 0.39 0.16 2.90 -1.94 0.21 -2.67 119.30 114.89 1nqo s MET 171 Ca 0.09 -0.35 0.05 0.00 -1.71 0.00 0.00 55.69 53.77 1nqo s MET 171 Cb -0.02 -0.28 -0.05 0.00 2.01 0.00 0.00 34.83 36.49 1nqo s MET 171 CO -0.00 0.07 -0.11 0.00 -0.01 0.00 0.00 175.02 174.96 1nqo s MET 172 N -0.61 1.14 -0.03 2.03 0.23 -0.45 -0.94 119.30 120.66 1nqo s MET 172 Ca -0.03 -1.50 -0.01 0.00 -1.03 0.00 0.00 55.69 53.13 1nqo s MET 172 Cb -0.05 -0.75 0.03 0.00 -1.53 0.00 0.00 34.83 32.54 1nqo s MET 172 CO -0.00 0.10 0.06 0.99 -2.03 0.00 0.00 175.02 174.14 1nqo s THR 173 N -3.24 -0.05 -0.22 3.16 2.01 -0.53 -1.59 115.64 115.17 1nqo s THR 173 Ca 0.19 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.34 1nqo s THR 173 Cb 0.02 -0.12 -0.01 0.00 0.01 0.00 0.00 72.50 72.39 1nqo s THR 173 CO 0.02 0.08 -0.02 0.28 -0.69 0.00 0.00 174.62 174.29 1nqo s THR 174 N 1.03 3.56 -0.51 -0.82 -1.32 -0.73 -0.90 115.64 115.96 1nqo s THR 174 Ca -0.08 -0.43 -0.25 0.00 -1.21 0.00 0.00 61.69 59.72 1nqo s THR 174 Cb -0.12 -2.63 0.03 0.00 -1.51 0.00 0.00 72.50 68.28 1nqo s THR 174 CO -0.04 0.41 0.93 -0.69 -2.21 0.00 0.00 174.62 173.03 1nqo s VAL 175 N 1.47 4.42 -0.04 5.08 1.01 -0.39 -1.02 120.40 130.93 1nqo s VAL 175 Ca 0.06 0.49 0.05 0.00 0.00 0.00 0.00 61.98 62.57 1nqo s VAL 175 Cb -0.14 -4.49 -0.02 0.00 0.00 0.00 0.00 36.38 31.72 1nqo s VAL 175 CO -0.02 -0.99 -0.18 -2.28 0.00 0.00 0.00 175.10 171.63 1nqo s HIS 176 N 3.87 2.59 0.75 5.22 5.04 -0.70 -0.98 115.29 131.08 1nqo s HIS 176 Ca 0.33 -0.29 -0.14 0.00 -1.54 0.00 0.00 55.06 53.42 1nqo s HIS 176 Cb -0.11 -1.60 0.05 0.00 0.04 0.00 0.00 32.58 30.96 1nqo s HIS 176 CO 0.22 0.08 1.19 -1.12 -2.34 0.00 0.00 174.74 172.77 1nqo s SER 177 N -0.62 4.11 0.65 9.88 0.01 -1.21 -1.54 113.70 124.98 1nqo s SER 177 Ca 0.09 2.28 -0.15 0.00 1.31 0.00 0.00 55.95 59.48 1nqo s SER 177 Cb -0.11 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.54 1nqo s SER 177 CO 0.00 -2.31 1.11 -0.72 0.41 0.00 0.00 173.24 171.73 1nqo s TYR 178 N -2.15 2.66 0.40 2.43 -0.85 -0.64 -4.74 117.35 114.47 1nqo s TYR 178 Ca 0.72 1.55 0.04 0.00 -0.52 0.00 0.00 57.07 58.85 1nqo s TYR 178 Cb -0.27 -3.16 -0.03 0.00 0.38 0.00 0.00 41.96 38.89 1nqo s TYR 178 CO 0.47 -1.63 0.11 0.95 -1.52 0.00 0.00 175.55 173.93 1nqo s THR 179 N -2.34 0.71 -1.79 -3.49 -4.23 -1.26 -4.69 115.64 98.55 1nqo s THR 179 Ca 0.67 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.33 1nqo s THR 179 Cb -0.20 -2.39 0.38 0.00 1.34 0.00 0.00 72.50 71.63 1nqo s THR 179 CO 0.41 0.00 1.38 0.59 -0.54 0.00 0.00 174.62 176.46 1nqo n ASN 180 N -1.22 0.00 0.02 3.99 3.02 -1.26 -2.08 115.26 117.73 1nqo n ASN 180 Ca -0.06 -0.29 0.13 0.00 -0.03 0.00 0.00 54.58 54.33 1nqo n ASN 180 Cb 0.65 -0.10 0.51 0.00 -0.61 0.00 0.00 39.78 40.23 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 -1.10 0.25 -1.76 6.41 2.03 -1.26 -4.84 116.55 116.27 1nqo n ASP 181 Ca 0.10 0.40 0.00 0.00 0.52 0.00 0.00 54.79 55.81 1nqo n ASP 181 Cb 0.08 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.06 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 -1.67 1.57 -4.13 -0.67 6.02 -0.88 -4.99 117.38 112.62 1nqo n GLN 182 Ca 0.06 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.90 1nqo n GLN 182 Cb 0.36 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.50 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 0.48 0.66 -0.03 -1.09 1.81 -1.21 -5.03 118.95 114.54 1nqo s ARG 183 Ca 0.00 -0.79 -0.21 0.00 -1.72 0.00 0.00 55.73 53.02 1nqo s ARG 183 Cb 0.00 -0.54 -0.14 0.00 -0.45 0.00 0.00 34.95 33.82 1nqo s ARG 183 CO 0.00 0.12 0.90 0.82 -0.68 0.00 0.00 175.30 176.45 1nqo h ILE 184 N 4.46 0.57 -3.18 1.52 2.04 -1.90 -1.11 117.51 119.92 1nqo h ILE 184 Ca -0.37 -0.85 -0.49 0.00 1.00 0.00 0.00 64.86 64.14 1nqo h ILE 184 Cb 1.20 0.92 -0.40 0.00 -0.74 0.00 0.00 36.82 37.79 1nqo h ILE 184 CO 0.41 0.13 -0.76 -0.76 0.00 0.00 0.00 178.15 177.18 1nqo s LEU 185 N -9.15 0.83 0.00 1.44 1.43 -1.26 -3.85 118.68 108.12 1nqo s LEU 185 Ca -0.12 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1nqo s LEU 185 Cb 0.01 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.78 1nqo s LEU 185 CO 0.43 -0.33 0.00 0.47 0.23 0.00 0.00 176.35 177.15 1nqo n ASP 186 N 5.15 0.00 -4.27 2.29 9.92 -1.22 -4.84 116.55 123.58 1nqo n ASP 186 Ca -0.08 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.00 1nqo n ASP 186 Cb 0.48 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.85 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 2.44 0.32 0.64 1.43 0.11 -4.99 118.68 118.63 1nqo s LEU 187 Ca 0.00 -0.87 -0.29 0.00 -1.03 0.00 0.00 54.13 51.95 1nqo s LEU 187 Cb 0.00 -0.59 -0.13 0.00 0.03 0.00 0.00 46.19 45.50 1nqo s LEU 187 CO 0.00 -0.15 1.27 -2.65 0.23 0.00 0.00 176.35 175.05 1nqo n PRO 188 N 0.30 2.00 -3.62 1.29 -0.02 -1.26 -4.43 135.00 129.26 1nqo n PRO 188 Ca -0.14 0.70 -0.14 0.00 -2.02 0.00 0.00 63.50 61.91 1nqo n PRO 188 Cb 0.58 -2.27 -0.07 0.00 -0.02 0.00 0.00 33.50 31.72 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 -0.90 -0.77 0.39 6.00 2.46 -1.26 -4.93 115.29 116.28 1nqo s HIS 190 Ca 0.58 1.83 0.13 0.00 0.47 0.00 0.00 55.06 58.07 1nqo s HIS 190 Cb -0.60 0.29 0.96 0.00 -0.13 0.00 0.00 32.58 33.10 1nqo s HIS 190 CO 0.60 -0.40 1.87 0.87 -2.47 0.00 0.00 174.74 175.20 1nqo h LYS 191 N 4.77 0.51 -4.84 2.88 1.57 -1.98 -3.31 116.57 116.18 1nqo h LYS 191 Ca -0.29 -0.03 -0.69 0.00 -1.87 0.00 0.00 60.65 57.77 1nqo h LYS 191 Cb 1.16 -0.12 -0.19 0.00 0.08 0.00 0.00 32.23 33.16 1nqo h LYS 191 CO 0.09 0.34 -0.01 0.34 -0.57 0.00 0.00 179.45 179.64 1nqo s ASP 192 N -5.72 6.21 0.26 0.86 -1.08 -1.26 -4.92 116.67 111.01 1nqo s ASP 192 Ca -0.09 -1.01 0.16 0.00 -0.52 0.00 0.00 52.55 51.08 1nqo s ASP 192 Cb 0.22 -2.27 0.85 0.00 -1.46 0.00 0.00 42.92 40.25 1nqo s ASP 192 CO 0.78 -0.87 1.44 0.18 0.52 0.00 0.00 175.17 177.23 1nqo n LEU 193 N 6.02 0.40 -0.01 -1.34 4.77 -1.25 -1.01 117.00 124.59 1nqo n LEU 193 Ca -0.08 0.66 -0.18 0.00 -0.03 0.00 0.00 56.01 56.38 1nqo n LEU 193 Cb 0.45 -0.69 -0.14 0.00 -2.33 0.00 0.00 43.42 40.71 1nqo n LEU 193 CO 0.53 -0.80 0.13 0.03 -1.33 0.00 0.00 177.39 175.95 1nqo h ARG 194 N 0.00 0.16 0.00 3.23 2.47 -1.91 -3.30 114.38 115.04 1nqo h ARG 194 Ca 0.00 -0.28 0.00 0.00 -1.26 0.00 0.00 59.98 58.44 1nqo h ARG 194 Cb 0.15 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 1nqo h ARG 194 CO 0.00 1.13 0.00 0.54 0.56 0.00 0.00 179.97 182.20 1nqo n ARG 195 N -4.32 0.20 0.24 0.04 1.74 -0.18 -2.56 116.66 111.84 1nqo n ARG 195 Ca -0.14 0.13 0.14 0.00 -0.77 0.00 0.00 57.85 57.21 1nqo n ARG 195 Cb 0.68 -1.50 0.38 0.00 -1.02 0.00 0.00 32.46 31.00 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 2.82 1.00 -2.49 7.54 0.00 -1.47 -3.20 119.26 123.46 1nqo h ALA 196 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1nqo h ALA 196 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1nqo h ALA 196 CO 0.00 0.00 0.22 1.03 0.00 0.00 0.00 179.25 180.50 1nqo s ARG 197 N -3.39 4.40 -0.45 0.00 1.81 -1.06 -0.71 118.95 119.55 1nqo s ARG 197 Ca 0.05 1.08 -0.36 0.00 -1.72 0.00 0.00 55.73 54.78 1nqo s ARG 197 Cb 0.07 -2.83 -0.16 0.00 -0.45 0.00 0.00 34.95 31.58 1nqo s ARG 197 CO 0.62 0.34 1.81 0.00 -0.68 0.00 0.00 175.30 177.39 1nqo n ALA 198 N 0.62 0.19 -0.37 2.13 0.00 -1.26 -4.51 120.51 117.32 1nqo n ALA 198 Ca -0.00 0.13 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 1nqo n ALA 198 Cb 0.51 -1.74 0.10 0.00 0.00 0.00 0.00 19.45 18.32 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 7.67 1.25 -0.18 0.00 0.00 -1.30 -2.71 119.26 123.99 1nqo h ALA 199 Ca -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1nqo h ALA 199 Cb 1.17 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1nqo h ALA 199 CO 0.93 0.65 0.00 0.00 0.00 0.00 0.00 179.25 180.83 1nqo n ALA 200 N -2.38 2.51 0.20 0.00 0.00 -1.26 -4.07 120.51 115.51 1nqo n ALA 200 Ca 0.11 -0.42 0.04 0.00 0.00 0.00 0.00 53.44 53.17 1nqo n ALA 200 Cb 0.02 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 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 0.11 2.68 -4.15 0.00 -0.58 -1.03 -4.78 120.64 112.90 1nqo n GLU 201 Ca 0.12 -0.03 -0.11 0.00 -0.42 0.00 0.00 57.16 56.72 1nqo n GLU 201 Cb 0.23 -0.99 -0.09 0.00 -0.57 0.00 0.00 31.44 30.02 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 -2.21 0.11 -0.22 1.62 0.01 -1.22 -5.05 113.70 106.73 1nqo s SER 202 Ca 0.00 -1.28 -0.18 0.00 1.31 0.00 0.00 55.95 55.81 1nqo s SER 202 Cb 0.05 0.41 -0.03 0.00 0.21 0.00 0.00 66.02 66.67 1nqo s SER 202 CO 0.31 -0.89 0.50 -0.63 0.41 0.00 0.00 173.24 172.94 1nqo s ILE 203 N -4.12 5.11 -0.32 1.44 1.01 -1.26 -4.18 121.20 118.88 1nqo s ILE 203 Ca 0.34 0.89 0.03 0.00 0.00 0.00 0.00 60.65 61.92 1nqo s ILE 203 Cb 0.05 -3.82 0.09 0.00 0.01 0.00 0.00 42.46 38.79 1nqo s ILE 203 CO 0.10 0.15 0.01 -0.63 0.00 0.00 0.00 174.94 174.58 1nqo s ILE 204 N 1.83 2.18 0.33 2.92 1.01 0.15 -4.94 121.20 124.68 1nqo s ILE 204 Ca 0.22 -2.11 -0.29 0.00 0.00 0.00 0.00 60.65 58.48 1nqo s ILE 204 Cb -0.15 -2.53 -0.10 0.00 0.01 0.00 0.00 42.46 39.69 1nqo s ILE 204 CO 0.09 -0.45 1.28 -2.84 0.00 0.00 0.00 174.94 173.02 1nqo s PRO 205 N 0.99 4.37 0.16 2.79 0.02 -1.26 -0.44 135.00 141.62 1nqo s PRO 205 Ca 0.06 2.16 -0.15 0.00 0.02 0.00 0.00 61.00 63.08 1nqo s PRO 205 Cb -0.19 -3.07 0.03 0.00 0.02 0.00 0.00 34.50 31.29 1nqo s PRO 205 CO -0.08 -0.16 0.43 -0.08 -0.33 0.00 0.00 177.00 176.78 1nqo s THR 206 N -1.15 0.05 0.93 0.99 -1.32 0.19 -4.80 115.64 110.53 1nqo s THR 206 Ca 0.49 -0.77 -0.12 0.00 -1.21 0.00 0.00 61.69 60.08 1nqo s THR 206 Cb -0.39 -1.41 0.15 0.00 -1.51 0.00 0.00 72.50 69.34 1nqo s THR 206 CO 0.51 -0.25 1.10 0.42 -2.21 0.00 0.00 174.62 174.19 1nqo s THR 207 N -3.85 2.38 -0.28 5.08 -4.23 -1.26 -1.00 115.64 112.48 1nqo s THR 207 Ca 0.07 0.12 -0.25 0.00 -1.18 0.00 0.00 61.69 60.45 1nqo s THR 207 Cb 0.01 -2.68 0.12 0.00 1.34 0.00 0.00 72.50 71.29 1nqo s THR 207 CO -0.07 -0.16 1.01 0.28 -0.54 0.00 0.00 174.62 175.14 1nqo s THR 208 N -3.03 0.00 -1.23 3.99 -1.32 -1.26 -4.47 115.64 108.32 1nqo s THR 208 Ca 0.64 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 61.26 1nqo s THR 208 Cb -0.17 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.21 1nqo s THR 208 CO 0.56 0.00 1.32 0.61 -2.21 0.00 0.00 174.62 174.91 1nqo n GLY 209 N 2.20 2.62 0.28 6.08 0.00 -1.26 -4.64 105.19 110.47 1nqo n GLY 209 Ca -0.12 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.46 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 2.65 1.11 -0.56 4.61 0.00 -1.96 0.59 119.26 125.70 1nqo h ALA 210 Ca 0.00 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1nqo h ALA 210 Cb 0.80 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1nqo h ALA 210 CO 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 179.25 179.07 1nqo h ALA 211 N 1.53 0.86 -0.21 0.00 0.00 -1.88 -2.79 119.26 116.77 1nqo h ALA 211 Ca 0.42 -0.32 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1nqo h ALA 211 Cb 0.58 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1nqo h ALA 211 CO -0.36 0.66 -0.62 0.87 0.00 0.00 0.00 179.25 179.79 1nqo h LYS 212 N 0.91 0.79 0.00 0.00 1.57 -1.33 -3.14 116.57 115.37 1nqo h LYS 212 Ca 0.16 -0.57 -0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1nqo h LYS 212 Cb 0.59 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.99 1nqo h LYS 212 CO 0.04 1.19 -0.00 0.00 -0.57 0.00 0.00 179.45 180.11 1nqo h ALA 213 N 0.60 1.09 -0.74 3.86 0.00 0.26 -1.79 119.26 122.54 1nqo h ALA 213 Ca -0.02 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1nqo h ALA 213 Cb 1.24 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1nqo h ALA 213 CO 0.13 0.00 0.49 0.28 0.00 0.00 0.00 179.25 180.15 1nqo h VAL 214 N 0.00 0.92 0.00 0.00 2.07 -1.44 0.30 116.25 118.09 1nqo h VAL 214 Ca -0.00 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1nqo h VAL 214 Cb 0.01 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1nqo h VAL 214 CO 0.00 0.11 -0.05 0.00 0.02 0.00 0.00 177.57 177.65 1nqo h ALA 215 N 1.63 1.69 -0.85 1.67 0.00 -1.48 0.56 119.26 122.48 1nqo h ALA 215 Ca 0.35 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1nqo h ALA 215 Cb 0.51 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1nqo h ALA 215 CO -0.12 0.06 0.46 -0.07 0.00 0.00 0.00 179.25 179.58 1nqo h LEU 216 N 0.00 1.06 0.00 0.00 3.38 -1.10 -2.60 115.31 116.05 1nqo h LEU 216 Ca -0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1nqo h LEU 216 Cb 0.10 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1nqo h LEU 216 CO 0.01 0.85 -1.73 1.33 0.09 0.00 0.00 178.44 178.99 1nqo n VAL 217 N -4.34 0.08 -3.54 1.22 0.24 -0.59 -4.66 118.33 106.74 1nqo n VAL 217 Ca 0.09 -0.44 -0.27 0.00 -2.04 0.00 0.00 64.34 61.68 1nqo n VAL 217 Cb 0.10 0.08 -0.11 0.00 -1.47 0.00 0.00 33.84 32.44 1nqo n VAL 217 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1nqo s LEU 218 N -4.42 2.37 0.37 1.34 1.43 0.19 -4.63 118.68 115.32 1nqo s LEU 218 Ca -0.05 -3.25 0.16 0.00 -1.03 0.00 0.00 54.13 49.96 1nqo s LEU 218 Cb 0.14 -0.78 1.06 0.00 0.03 0.00 0.00 46.19 46.63 1nqo s LEU 218 CO 0.89 -0.15 1.73 -0.65 0.23 0.00 0.00 176.35 178.39 1nqo h PRO 219 N 5.64 0.41 0.00 1.29 0.11 -1.71 -0.35 132.00 137.40 1nqo h PRO 219 Ca 0.22 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1nqo h PRO 219 Cb 0.87 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1nqo h PRO 219 CO 0.47 0.27 0.00 0.93 -0.21 0.00 0.00 178.00 179.46 1nqo h GLU 220 N 0.42 0.00 -0.70 1.05 5.08 -1.95 -1.29 114.58 117.19 1nqo h GLU 220 Ca 0.65 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.01 1nqo h GLU 220 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1nqo h GLU 220 CO -0.41 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 178.88 1nqo n LEU 221 N -2.58 4.36 -4.69 1.33 4.77 -0.14 -4.94 117.00 115.10 1nqo n LEU 221 Ca -0.01 -2.19 -0.44 0.00 -0.03 0.00 0.00 56.01 53.34 1nqo n LEU 221 Cb 0.09 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.60 1nqo n LEU 221 CO 0.15 0.90 1.33 1.17 -1.33 0.00 0.00 177.39 179.62 1nqo n LYS 222 N 1.42 2.52 -0.87 3.23 4.81 -0.49 -1.78 118.16 127.00 1nqo n LYS 222 Ca 0.25 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.60 1nqo n LYS 222 Cb 0.76 -2.73 0.00 0.00 0.02 0.00 0.00 35.03 33.07 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 3.82 0.46 0.03 3.14 0.00 -1.26 -4.85 105.19 106.53 1nqo n GLY 223 Ca 0.17 0.00 0.10 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 -1.73 0.07 -4.42 1.61 5.02 -0.73 -4.96 118.16 113.02 1nqo n LYS 224 Ca 0.00 -0.06 -0.20 0.00 -2.02 0.00 0.00 58.31 56.03 1nqo n LYS 224 Cb 0.08 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.45 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 -2.97 2.10 0.19 -0.35 1.43 -1.26 -1.16 118.68 116.66 1nqo s LEU 225 Ca 0.09 -0.33 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 1nqo s LEU 225 Cb 0.16 -0.58 -0.03 0.00 0.03 0.00 0.00 46.19 45.78 1nqo s LEU 225 CO 0.85 0.08 0.21 0.21 0.23 0.00 0.00 176.35 177.93 1nqo s ASN 226 N -0.71 0.11 0.08 2.29 3.84 -1.09 -3.97 114.94 115.49 1nqo s ASN 226 Ca 0.02 -1.16 -0.25 0.00 0.21 0.00 0.00 52.86 51.69 1nqo s ASN 226 Cb -0.06 0.42 0.08 0.00 -0.55 0.00 0.00 41.25 41.14 1nqo s ASN 226 CO 0.00 -0.89 1.14 0.61 -2.79 0.00 0.00 177.10 175.18 1nqo n GLY 227 N -0.25 0.41 3.46 1.21 0.00 -1.26 -1.34 105.19 107.42 1nqo n GLY 227 Ca -0.02 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1nqo n GLY 227 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1nqo s MET 228 N -2.03 1.62 0.18 1.61 0.23 -0.62 -4.42 119.30 115.87 1nqo s MET 228 Ca 0.26 -1.54 0.07 0.00 -1.03 0.00 0.00 55.69 53.45 1nqo s MET 228 Cb -0.02 0.42 -0.05 0.00 -1.53 0.00 0.00 34.83 33.65 1nqo s MET 228 CO 0.02 -0.65 -0.13 0.00 -2.03 0.00 0.00 175.02 172.23 1nqo s ALA 229 N -3.67 1.84 -0.28 3.16 0.00 -0.17 -1.77 121.76 120.88 1nqo s ALA 229 Ca 0.29 -1.60 -0.03 0.00 0.00 0.00 0.00 51.96 50.63 1nqo s ALA 229 Cb 0.01 -0.05 0.09 0.00 0.00 0.00 0.00 23.12 23.17 1nqo s ALA 229 CO 0.14 0.03 0.10 -1.64 0.00 0.00 0.00 175.76 174.40 1nqo s MET 230 N -3.61 0.43 0.10 0.00 -1.94 -0.19 -0.64 119.30 113.46 1nqo s MET 230 Ca 0.20 -0.69 -0.30 0.00 -1.71 0.00 0.00 55.69 53.19 1nqo s MET 230 Cb -0.00 -1.63 -0.06 0.00 2.01 0.00 0.00 34.83 35.15 1nqo s MET 230 CO 0.05 -0.94 1.14 1.03 -0.01 0.00 0.00 175.02 176.30 1nqo s ARG 231 N 1.89 4.50 0.26 2.03 1.81 0.42 -1.71 118.95 128.14 1nqo s ARG 231 Ca 0.08 1.72 0.05 0.00 -1.72 0.00 0.00 55.73 55.86 1nqo s ARG 231 Cb -0.17 -3.33 -0.06 0.00 -0.45 0.00 0.00 34.95 30.95 1nqo s ARG 231 CO -0.27 -0.12 -0.04 0.14 -0.68 0.00 0.00 175.30 174.33 1nqo s VAL 232 N 0.58 1.43 -0.47 3.52 -7.23 -0.59 0.31 120.40 117.94 1nqo s VAL 232 Ca 0.55 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.59 1nqo s VAL 232 Cb -0.29 -2.40 -0.06 0.00 0.56 0.00 0.00 36.38 34.19 1nqo s VAL 232 CO 0.31 -0.32 1.85 -2.65 -0.31 0.00 0.00 175.10 173.98 1nqo n PRO 233 N -0.52 1.36 -4.49 4.82 -0.02 -1.26 -3.07 135.00 131.83 1nqo n PRO 233 Ca -0.05 -0.97 -0.21 0.00 -2.02 0.00 0.00 63.50 60.24 1nqo n PRO 233 Cb 0.63 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.83 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 3.25 1.15 -0.39 3.45 -4.23 -1.26 -5.02 115.64 112.58 1nqo s THR 234 Ca 0.30 -0.86 0.26 0.00 -1.18 0.00 0.00 61.69 60.21 1nqo s THR 234 Cb 0.10 -1.01 0.33 0.00 1.34 0.00 0.00 72.50 73.26 1nqo s THR 234 CO -0.02 0.14 1.73 1.55 -0.54 0.00 0.00 174.62 177.48 1nqo h PRO 235 N 5.26 0.00 -1.93 3.99 0.13 -1.86 -1.69 132.00 135.89 1nqo h PRO 235 Ca -0.37 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.87 1nqo h PRO 235 Cb 1.17 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.12 1nqo h PRO 235 CO 0.46 0.00 0.54 1.21 -0.23 0.00 0.00 178.00 179.98 1nqo s ASN 236 N -5.58 -0.35 0.00 1.44 2.47 -1.26 -4.70 114.94 106.96 1nqo s ASN 236 Ca 0.06 0.16 0.00 0.00 0.42 0.00 0.00 52.86 53.50 1nqo s ASN 236 Cb 0.08 0.33 0.00 0.00 -1.45 0.00 0.00 41.25 40.21 1nqo s ASN 236 CO 0.60 -0.48 0.00 0.52 -3.72 0.00 0.00 177.10 174.03 1nqo n VAL 237 N 0.15 -0.53 -4.31 -5.21 0.31 -1.26 -4.86 118.33 102.62 1nqo n VAL 237 Ca -0.08 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.07 1nqo n VAL 237 Cb 0.60 -0.42 -0.10 0.00 -0.91 0.00 0.00 33.84 33.01 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 -0.64 1.24 -0.07 4.52 0.01 0.14 -3.36 113.70 115.55 1nqo s SER 238 Ca 0.00 -1.46 -0.05 0.00 1.31 0.00 0.00 55.95 55.75 1nqo s SER 238 Cb 0.00 0.28 0.03 0.00 0.21 0.00 0.00 66.02 66.54 1nqo s SER 238 CO 0.00 -0.81 0.17 0.54 0.41 0.00 0.00 173.24 173.56 1nqo s VAL 239 N -3.73 -0.02 -0.12 3.43 0.11 -0.15 -1.10 120.40 118.83 1nqo s VAL 239 Ca 0.37 0.07 -0.11 0.00 -2.93 0.00 0.00 61.98 59.38 1nqo s VAL 239 Cb 0.07 -0.26 -0.05 0.00 -1.53 0.00 0.00 36.38 34.61 1nqo s VAL 239 CO 0.15 0.03 0.23 -0.69 -3.33 0.00 0.00 175.10 171.49 1nqo s VAL 240 N 0.56 5.35 -0.32 2.04 1.01 0.92 -1.26 120.40 128.70 1nqo s VAL 240 Ca -0.04 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.37 1nqo s VAL 240 Cb -0.05 -3.53 0.10 0.00 0.00 0.00 0.00 36.38 32.89 1nqo s VAL 240 CO -0.03 0.53 0.05 -0.62 0.00 0.00 0.00 175.10 175.03 1nqo s ASP 241 N -0.45 4.46 -0.18 3.32 2.15 -0.07 -1.21 116.67 124.69 1nqo s ASP 241 Ca 0.16 -1.89 -0.05 0.00 0.43 0.00 0.00 52.55 51.19 1nqo s ASP 241 Cb -0.13 -1.36 -0.03 0.00 -0.30 0.00 0.00 42.92 41.10 1nqo s ASP 241 CO 0.05 -0.37 0.00 -0.22 -0.17 0.00 0.00 175.17 174.46 1nqo s LEU 242 N 1.16 3.42 -0.19 -1.34 2.96 -0.48 -1.46 118.68 122.77 1nqo s LEU 242 Ca 0.08 -0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 53.90 1nqo s LEU 242 Cb -0.18 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.66 1nqo s LEU 242 CO -0.13 0.14 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.23 1nqo s VAL 243 N 0.53 2.74 0.02 1.68 1.01 -0.12 -0.75 120.40 125.51 1nqo s VAL 243 Ca -0.01 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 1nqo s VAL 243 Cb -0.14 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 1nqo s VAL 243 CO 0.02 0.49 -0.03 0.00 0.00 0.00 0.00 175.10 175.58 1nqo s ALA 244 N 1.22 0.14 -0.16 5.51 0.00 0.95 -0.62 121.76 128.80 1nqo s ALA 244 Ca 0.02 -0.62 -0.16 0.00 0.00 0.00 0.00 51.96 51.20 1nqo s ALA 244 Cb -0.14 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1nqo s ALA 244 CO -0.06 -0.18 0.37 -1.21 0.00 0.00 0.00 175.76 174.69 1nqo s GLU 245 N -1.64 4.27 0.29 0.00 0.41 -0.20 0.69 118.70 122.52 1nqo s GLU 245 Ca -0.14 0.22 0.07 0.00 -0.41 0.00 0.00 54.97 54.71 1nqo s GLU 245 Cb -0.09 -3.45 -0.03 0.00 -1.78 0.00 0.00 34.13 28.78 1nqo s GLU 245 CO -0.02 0.15 0.24 -0.51 -0.49 0.00 0.00 175.26 174.64 1nqo s LEU 246 N 0.70 3.73 -0.17 1.80 1.02 0.15 -1.22 118.68 124.69 1nqo s LEU 246 Ca 0.20 -0.35 -0.25 0.00 0.02 0.00 0.00 54.13 53.75 1nqo s LEU 246 Cb -0.14 -2.30 -0.23 0.00 0.02 0.00 0.00 46.19 43.54 1nqo s LEU 246 CO 0.07 -0.17 0.53 -0.33 0.02 0.00 0.00 176.35 176.46 1nqo h GLU 247 N 1.38 0.01 -6.86 1.70 5.08 -1.14 -3.45 114.58 111.30 1nqo h GLU 247 Ca -0.47 -0.02 -0.48 0.00 -1.00 0.00 0.00 59.36 57.39 1nqo h GLU 247 Cb 1.25 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1nqo h GLU 247 CO 0.60 1.01 0.37 0.21 -1.00 0.00 0.00 179.01 180.19 1nqo s LYS 248 N -2.29 4.59 -0.04 2.33 2.20 -1.00 -5.01 119.74 120.52 1nqo s LYS 248 Ca -0.23 1.44 -0.30 0.00 -0.36 0.00 0.00 55.97 56.52 1nqo s LYS 248 Cb 0.01 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.39 1nqo s LYS 248 CO 0.65 0.27 1.19 -2.00 -0.36 0.00 0.00 175.35 175.09 1nqo s GLU 249 N -1.86 4.37 0.31 4.03 2.12 -1.26 -4.78 118.70 121.63 1nqo s GLU 249 Ca 0.49 1.67 0.03 0.00 0.36 0.00 0.00 54.97 57.52 1nqo s GLU 249 Cb -0.22 -3.52 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 1nqo s GLU 249 CO 0.28 -0.40 0.17 0.14 -0.54 0.00 0.00 175.26 174.91 1nqo s VAL 250 N 1.99 0.30 0.29 3.70 -7.23 -0.15 -5.05 120.40 114.26 1nqo s VAL 250 Ca 0.56 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.80 1nqo s VAL 250 Cb -0.25 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.13 1nqo s VAL 250 CO 0.23 0.00 -0.06 0.42 -0.31 0.00 0.00 175.10 175.39 1nqo s THR 251 N -3.59 1.71 0.23 5.32 -4.23 -1.26 -4.35 115.64 109.48 1nqo s THR 251 Ca 0.36 -2.13 -0.08 0.00 -1.18 0.00 0.00 61.69 58.66 1nqo s THR 251 Cb 0.05 -2.51 0.21 0.00 1.34 0.00 0.00 72.50 71.59 1nqo s THR 251 CO 0.18 -0.26 1.90 0.58 -0.54 0.00 0.00 174.62 176.48 1nqo h VAL 252 N 2.22 1.20 -0.39 2.29 2.07 -1.94 -2.25 116.25 119.46 1nqo h VAL 252 Ca -0.40 -0.40 0.04 0.00 0.82 0.00 0.00 66.70 66.75 1nqo h VAL 252 Cb 1.24 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1nqo h VAL 252 CO 0.68 0.22 0.17 -0.33 0.02 0.00 0.00 177.57 178.33 1nqo h GLU 253 N 1.18 0.35 -0.38 1.57 3.07 -1.97 -0.90 114.58 117.50 1nqo h GLU 253 Ca 0.33 -0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 59.08 1nqo h GLU 253 Cb -0.10 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.72 1nqo h GLU 253 CO -0.09 0.23 -0.16 0.93 -1.40 0.00 0.00 179.01 178.53 1nqo h GLU 254 N 0.36 0.70 0.15 2.33 5.08 -1.91 0.13 114.58 121.42 1nqo h GLU 254 Ca 0.17 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1nqo h GLU 254 Cb 0.11 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1nqo h GLU 254 CO -0.14 0.82 -0.07 0.28 -1.00 0.00 0.00 179.01 178.90 1nqo h VAL 255 N 0.63 0.97 -0.53 3.13 2.07 -1.03 -1.76 116.25 119.72 1nqo h VAL 255 Ca 0.10 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1nqo h VAL 255 Cb 0.62 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1nqo h VAL 255 CO 0.04 0.13 0.21 0.78 0.02 0.00 0.00 177.57 178.74 1nqo h ASN 256 N -0.45 0.70 -0.30 0.57 2.35 -1.10 -1.74 115.58 115.61 1nqo h ASN 256 Ca -0.02 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1nqo h ASN 256 Cb 0.36 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1nqo h ASN 256 CO 0.03 0.64 0.17 0.00 -1.65 0.00 0.00 177.43 176.63 1nqo h ALA 257 N 1.47 0.38 -0.67 -0.83 0.00 -0.85 0.27 119.26 119.02 1nqo h ALA 257 Ca 0.18 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1nqo h ALA 257 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1nqo h ALA 257 CO -0.02 -0.11 0.24 0.00 0.00 0.00 0.00 179.25 179.37 1nqo h ALA 258 N 1.06 0.88 -0.44 0.00 0.00 -0.98 -0.48 119.26 119.29 1nqo h ALA 258 Ca 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1nqo h ALA 258 Cb 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1nqo h ALA 258 CO -0.02 0.52 0.12 -0.07 0.00 0.00 0.00 179.25 179.81 1nqo h LEU 259 N 0.96 0.65 -0.55 0.00 3.38 -1.08 -2.16 115.31 116.52 1nqo h LEU 259 Ca 0.22 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1nqo h LEU 259 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1nqo h LEU 259 CO -0.01 0.70 0.20 0.50 0.09 0.00 0.00 178.44 179.91 1nqo h LYS 260 N 0.58 0.83 -0.91 1.13 3.64 -0.70 -1.20 116.57 119.94 1nqo h LYS 260 Ca 0.14 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1nqo h LYS 260 Cb 0.29 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 1nqo h LYS 260 CO -0.00 0.74 0.51 0.00 -2.27 0.00 0.00 179.45 178.43 1nqo h ALA 261 N 1.05 1.19 -0.08 5.00 0.00 -0.99 -1.34 119.26 124.09 1nqo h ALA 261 Ca 0.18 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1nqo h ALA 261 Cb 0.24 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1nqo h ALA 261 CO -0.01 0.66 -0.59 0.00 0.00 0.00 0.00 179.25 179.32 1nqo h ALA 262 N 1.30 0.86 -0.13 0.00 0.00 -1.12 0.03 119.26 120.20 1nqo h ALA 262 Ca 0.32 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 1nqo h ALA 262 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1nqo h ALA 262 CO -0.05 0.72 -0.45 0.00 0.00 0.00 0.00 179.25 179.46 1nqo h ALA 263 N 1.19 0.98 -0.01 0.00 0.00 -0.71 -1.48 119.26 119.25 1nqo h ALA 263 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1nqo h ALA 263 Cb 1.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1nqo h ALA 263 CO 0.09 0.63 -0.43 0.39 0.00 0.00 0.00 179.25 179.93 1nqo n GLU 264 N -3.99 0.67 0.00 0.00 1.02 -0.55 -2.91 120.64 114.87 1nqo n GLU 264 Ca -0.02 -0.46 0.00 0.00 -0.02 0.00 0.00 57.16 56.66 1nqo n GLU 264 Cb 0.52 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 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 1.41 0.86 0.33 0.62 0.00 -0.02 -4.79 105.19 103.59 1nqo n GLY 265 Ca 0.09 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.33 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 -0.54 1.61 4.11 -1.81 -2.60 114.58 115.35 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 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.36 1nqo n LEU 267 N -3.12 3.48 -4.61 3.06 4.77 -0.58 -4.99 117.00 115.01 1nqo n LEU 267 Ca -0.02 -1.92 -0.48 0.00 -0.03 0.00 0.00 56.01 53.55 1nqo n LEU 267 Cb 0.11 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 1nqo n LEU 267 CO 0.22 0.85 0.87 1.17 -1.33 0.00 0.00 177.39 179.17 1nqo n LYS 268 N 1.19 1.43 0.00 3.23 4.81 -0.98 0.03 118.16 127.87 1nqo n LYS 268 Ca 0.19 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1nqo n LYS 268 Cb 0.54 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.49 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 2.31 3.07 0.21 3.14 0.00 -1.26 -4.72 105.19 107.94 1nqo n GLY 269 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.21 1.39 -4.95 -0.61 2.08 0.10 -4.33 119.36 111.83 1nqo n ILE 270 Ca 0.00 -0.37 -0.32 0.00 0.56 0.00 0.00 62.75 62.62 1nqo n ILE 270 Cb 0.00 -1.81 -0.14 0.00 -0.75 0.00 0.00 39.64 36.94 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 -7.30 2.61 0.28 1.39 2.96 0.42 -1.39 118.68 117.65 1nqo s LEU 271 Ca -0.35 -0.26 0.06 0.00 -0.22 0.00 0.00 54.13 53.36 1nqo s LEU 271 Cb 0.13 -1.52 -0.06 0.00 0.50 0.00 0.00 46.19 45.24 1nqo s LEU 271 CO 0.45 0.32 -0.03 0.00 -1.32 0.00 0.00 176.35 175.78 1nqo s ALA 272 N -0.60 2.26 -0.07 5.97 0.00 0.95 -4.41 121.76 125.85 1nqo s ALA 272 Ca 0.09 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.15 1nqo s ALA 272 Cb -0.11 0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.34 1nqo s ALA 272 CO 0.01 -0.14 -0.05 -0.47 0.00 0.00 0.00 175.76 175.10 1nqo s TYR 273 N -3.12 1.00 -0.08 0.00 5.04 -1.26 -0.75 117.35 118.17 1nqo s TYR 273 Ca 0.30 -0.36 0.02 0.00 -2.44 0.00 0.00 57.07 54.59 1nqo s TYR 273 Cb 0.05 -0.88 0.01 0.00 0.35 0.00 0.00 41.96 41.50 1nqo s TYR 273 CO 0.12 -0.30 -0.13 0.45 -1.34 0.00 0.00 175.55 174.35 1nqo s SER 274 N 1.26 2.07 -0.10 4.32 0.15 0.29 -4.91 113.70 116.78 1nqo s SER 274 Ca -0.05 -0.35 0.18 0.00 0.70 0.00 0.00 55.95 56.43 1nqo s SER 274 Cb -0.14 -0.93 0.66 0.00 -1.71 0.00 0.00 66.02 63.90 1nqo s SER 274 CO -0.02 0.02 1.57 -0.62 1.20 0.00 0.00 173.24 175.39 1nqo n GLU 275 N 4.04 3.53 -3.60 5.44 1.02 -1.26 -1.03 120.64 128.77 1nqo n GLU 275 Ca -0.20 -2.79 -0.36 0.00 -0.02 0.00 0.00 57.16 53.78 1nqo n GLU 275 Cb 0.51 -1.81 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 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 -1.80 3.76 -1.37 3.49 0.41 -1.26 -4.81 118.70 117.12 1nqo s GLU 276 Ca 0.47 0.19 -0.12 0.00 -0.41 0.00 0.00 54.97 55.10 1nqo s GLU 276 Cb 0.31 -3.09 0.10 0.00 -1.78 0.00 0.00 34.13 29.66 1nqo s GLU 276 CO 0.23 0.63 2.02 -0.35 -0.49 0.00 0.00 175.26 177.31 1nqo n PRO 277 N 1.31 3.20 -2.63 0.39 -0.04 -1.26 -4.88 135.00 131.10 1nqo n PRO 277 Ca -0.11 -3.06 -0.23 0.00 -0.04 0.00 0.00 63.50 60.05 1nqo n PRO 277 Cb 0.53 -3.15 0.11 0.00 -0.04 0.00 0.00 33.50 30.95 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 1.37 2.96 0.28 1.53 1.43 -1.26 -5.14 118.68 119.85 1nqo s LEU 278 Ca 0.44 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1nqo s LEU 278 Cb 0.11 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 1nqo s LEU 278 CO -0.04 -1.90 0.10 0.68 0.23 0.00 0.00 176.35 175.43 1nqo s VAL 279 N -3.14 0.60 0.23 -1.59 -7.23 -1.26 -5.05 120.40 102.96 1nqo s VAL 279 Ca 0.67 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.76 1nqo s VAL 279 Cb -0.05 -2.62 0.20 0.00 0.56 0.00 0.00 36.38 34.47 1nqo s VAL 279 CO 0.44 0.00 1.69 0.77 -0.31 0.00 0.00 175.10 177.70 1nqo h SER 280 N 2.30 -0.02 -0.43 4.85 4.64 -1.97 -0.07 113.55 122.85 1nqo h SER 280 Ca -0.38 0.13 0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1nqo h SER 280 Cb 1.25 0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.51 1nqo h SER 280 CO 0.60 -0.02 0.39 0.03 -0.87 0.00 0.00 176.83 176.96 1nqo h ARG 281 N 0.25 0.00 0.00 4.77 2.47 -1.98 -0.41 114.38 119.48 1nqo h ARG 281 Ca 0.36 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.08 1nqo h ARG 281 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 1nqo h ARG 281 CO -0.47 0.00 0.00 -0.44 0.56 0.00 0.00 179.97 179.62 1nqo h ASP 282 N 0.00 0.00 -0.34 7.04 3.32 -1.41 -2.93 116.42 122.10 1nqo h ASP 282 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1nqo h ASP 282 Cb 0.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1nqo h ASP 282 CO -0.00 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.30 1nqo n TYR 283 N -2.88 0.44 -2.02 4.55 4.01 -0.17 -4.89 117.16 116.20 1nqo n TYR 283 Ca 0.00 -0.24 -0.42 0.00 -0.16 0.00 0.00 57.90 57.08 1nqo n TYR 283 Cb 0.25 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.25 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 -1.40 6.68 0.00 7.72 2.47 -1.11 -1.11 114.94 128.18 1nqo s ASN 284 Ca 0.35 2.26 0.00 0.00 0.42 0.00 0.00 52.86 55.88 1nqo s ASN 284 Cb 0.20 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.46 1nqo s ASN 284 CO 0.29 -0.89 0.00 0.61 -3.72 0.00 0.00 177.10 173.38 1nqo n GLY 285 N 4.05 0.14 3.74 1.21 0.00 -1.26 -5.05 105.19 108.02 1nqo n GLY 285 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.25 6.48 0.00 1.61 0.15 -0.27 -4.92 113.70 114.51 1nqo s SER 286 Ca 0.00 2.82 0.22 0.00 0.70 0.00 0.00 55.95 59.69 1nqo s SER 286 Cb 0.00 -2.62 -0.03 0.00 -1.71 0.00 0.00 66.02 61.66 1nqo s SER 286 CO 0.00 -0.85 1.04 0.35 1.20 0.00 0.00 173.24 174.99 1nqo n THR 287 N 2.63 0.00 -1.67 6.45 -2.24 -1.26 -3.06 114.28 115.12 1nqo n THR 287 Ca 0.09 -0.02 -0.30 0.00 -2.27 0.00 0.00 64.05 61.56 1nqo n THR 287 Cb 0.38 0.83 0.09 0.00 -2.10 0.00 0.00 70.33 69.53 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 -2.96 2.79 -0.19 2.28 -7.23 -1.26 -4.37 120.40 109.45 1nqo s VAL 288 Ca 0.10 0.26 0.19 0.00 -1.81 0.00 0.00 61.98 60.72 1nqo s VAL 288 Cb 0.17 -3.09 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 1nqo s VAL 288 CO 0.81 -0.33 1.02 0.28 -0.31 0.00 0.00 175.10 176.56 1nqo h SER 289 N -1.07 0.00 -2.80 4.85 0.02 -1.42 -3.38 113.55 109.75 1nqo h SER 289 Ca -0.47 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.51 1nqo h SER 289 Cb 1.29 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.62 1nqo h SER 289 CO 0.62 0.29 0.01 -0.55 -1.14 0.00 0.00 176.83 176.06 1nqo s SER 290 N -5.69 -0.97 -0.21 3.07 0.15 -0.90 -3.76 113.70 105.39 1nqo s SER 290 Ca -0.01 1.50 0.01 0.00 0.70 0.00 0.00 55.95 58.16 1nqo s SER 290 Cb 0.09 1.54 0.04 0.00 -1.71 0.00 0.00 66.02 65.98 1nqo s SER 290 CO 0.79 -0.23 -0.12 -0.89 1.20 0.00 0.00 173.24 173.99 1nqo s THR 291 N 1.85 1.80 0.09 6.45 2.01 -0.51 -0.04 115.64 127.29 1nqo s THR 291 Ca -0.09 -1.10 -0.31 0.00 0.31 0.00 0.00 61.69 60.50 1nqo s THR 291 Cb -0.06 -1.83 -0.08 0.00 0.01 0.00 0.00 72.50 70.54 1nqo s THR 291 CO -0.20 0.20 1.47 -0.63 -0.69 0.00 0.00 174.62 174.77 1nqo s ILE 292 N 1.33 3.25 -1.09 1.82 -1.09 0.07 -0.09 121.20 125.40 1nqo s ILE 292 Ca -0.02 0.82 -0.15 0.00 -2.23 0.00 0.00 60.65 59.08 1nqo s ILE 292 Cb -0.16 -3.52 0.18 0.00 -1.58 0.00 0.00 42.46 37.37 1nqo s ILE 292 CO -0.08 0.04 1.27 -0.62 -1.23 0.00 0.00 174.94 174.31 1nqo s ASP 293 N 1.55 6.96 0.35 3.58 -1.08 0.51 -0.55 116.67 127.99 1nqo s ASP 293 Ca 0.67 -2.78 0.12 0.00 -0.52 0.00 0.00 52.55 50.04 1nqo s ASP 293 Cb -0.37 -2.37 0.91 0.00 -1.46 0.00 0.00 42.92 39.63 1nqo s ASP 293 CO 0.30 -0.77 1.79 0.00 0.52 0.00 0.00 175.17 177.01 1nqo h ALA 294 N 7.61 1.93 0.00 3.66 0.00 -1.36 -0.39 119.26 130.72 1nqo h ALA 294 Ca 0.24 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1nqo h ALA 294 Cb 0.93 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1nqo h ALA 294 CO 1.15 -0.29 -0.00 -0.07 0.00 0.00 0.00 179.25 180.03 1nqo h LEU 295 N 0.59 0.00 0.00 0.00 3.38 -1.88 -2.19 115.31 115.22 1nqo h LEU 295 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.53 1nqo h LEU 295 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1nqo h LEU 295 CO -0.31 0.00 -0.52 0.28 0.09 0.00 0.00 178.44 177.98 1nqo h SER 296 N 0.00 0.00 -2.15 -0.43 0.02 -1.44 -3.47 113.55 106.08 1nqo h SER 296 Ca -0.00 -0.16 -0.61 0.00 -0.84 0.00 0.00 61.79 60.18 1nqo h SER 296 Cb 0.02 0.00 0.06 0.00 0.14 0.00 0.00 62.40 62.62 1nqo h SER 296 CO 0.00 0.08 0.63 0.41 -1.14 0.00 0.00 176.83 176.81 1nqo n THR 297 N -2.20 0.24 -3.92 -2.27 -1.04 -0.83 -4.81 114.28 99.45 1nqo n THR 297 Ca 0.03 -0.06 -0.10 0.00 -2.04 0.00 0.00 64.05 61.88 1nqo n THR 297 Cb 0.45 -1.27 -0.12 0.00 -1.82 0.00 0.00 70.33 67.57 1nqo n THR 297 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1nqo s MET 298 N 0.46 0.26 -0.00 -2.82 1.75 -0.85 -4.99 119.30 113.12 1nqo s MET 298 Ca 0.78 -0.35 -0.01 0.00 -1.25 0.00 0.00 55.69 54.87 1nqo s MET 298 Cb -0.76 0.10 -0.00 0.00 2.84 0.00 0.00 34.83 37.00 1nqo s MET 298 CO 0.43 -0.05 0.01 0.08 -0.65 0.00 0.00 175.02 174.85 1nqo s VAL 299 N -0.96 0.02 -0.04 10.11 1.01 -1.26 -0.59 120.40 128.70 1nqo s VAL 299 Ca -0.11 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1nqo s VAL 299 Cb -0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 36.38 36.22 1nqo s VAL 299 CO -0.00 -0.11 -0.16 -0.63 0.00 0.00 0.00 175.10 174.19 1nqo s ILE 300 N -0.33 1.34 -0.83 2.22 1.01 -0.28 -4.73 121.20 119.61 1nqo s ILE 300 Ca -0.04 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 59.94 1nqo s ILE 300 Cb -0.02 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.30 1nqo s ILE 300 CO -0.00 0.39 0.00 0.47 0.00 0.00 0.00 174.94 175.80 1nqo n ASP 301 N 3.08 -4.34 -0.03 3.58 8.00 -1.26 -1.43 116.55 124.14 1nqo n ASP 301 Ca -0.17 0.19 -0.00 0.00 0.71 0.00 0.00 54.79 55.51 1nqo n ASP 301 Cb 0.53 -3.27 -0.00 0.00 -0.02 0.00 0.00 41.12 38.36 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 0.22 0.00 0.44 0.00 -1.26 -4.78 105.19 100.05 1nqo n GLY 302 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.54 0.42 -3.33 1.61 4.76 -0.51 -0.97 118.16 119.60 1nqo n LYS 303 Ca -0.00 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.05 1nqo n LYS 303 Cb 0.32 -0.91 -0.07 0.00 -1.84 0.00 0.00 35.03 32.53 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 -1.83 4.24 0.09 1.97 1.75 -0.87 0.31 119.30 124.96 1nqo s MET 304 Ca 0.00 0.35 0.08 0.00 -1.25 0.00 0.00 55.69 54.87 1nqo s MET 304 Cb 0.00 -3.50 -0.03 0.00 2.84 0.00 0.00 34.83 34.14 1nqo s MET 304 CO 0.00 0.01 -0.20 0.54 -0.65 0.00 0.00 175.02 174.72 1nqo s VAL 305 N 1.12 1.63 -0.13 10.11 0.11 0.22 -1.12 120.40 132.33 1nqo s VAL 305 Ca 0.23 -1.44 0.03 0.00 -2.93 0.00 0.00 61.98 57.87 1nqo s VAL 305 Cb -0.15 -1.48 0.01 0.00 -1.53 0.00 0.00 36.38 33.23 1nqo s VAL 305 CO 0.09 -0.02 -0.22 -0.75 -3.33 0.00 0.00 175.10 170.87 1nqo s LYS 306 N -1.73 3.03 -0.07 1.54 2.20 0.25 -0.03 119.74 124.93 1nqo s LYS 306 Ca 0.06 -0.86 0.04 0.00 -0.36 0.00 0.00 55.97 54.84 1nqo s LYS 306 Cb -0.10 -2.42 0.00 0.00 -1.51 0.00 0.00 37.83 33.81 1nqo s LYS 306 CO 0.03 0.02 -0.18 0.08 -0.36 0.00 0.00 175.35 174.94 1nqo s VAL 307 N 0.74 1.52 -0.10 4.02 1.01 0.07 -2.00 120.40 125.66 1nqo s VAL 307 Ca -0.09 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1nqo s VAL 307 Cb -0.16 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1nqo s VAL 307 CO -0.00 0.44 -0.19 -0.69 0.00 0.00 0.00 175.10 174.66 1nqo s VAL 308 N 0.34 2.54 -0.02 2.92 1.01 -1.26 -1.38 120.40 124.56 1nqo s VAL 308 Ca -0.12 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.02 1nqo s VAL 308 Cb -0.15 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.23 1nqo s VAL 308 CO 0.05 0.55 -0.04 -0.55 0.00 0.00 0.00 175.10 175.11 1nqo s SER 309 N 0.22 0.65 0.44 3.32 0.15 -0.35 -0.36 113.70 117.78 1nqo s SER 309 Ca -0.12 -0.09 -0.06 0.00 0.70 0.00 0.00 55.95 56.38 1nqo s SER 309 Cb -0.16 -0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 63.90 1nqo s SER 309 CO 0.07 -0.00 0.76 0.26 1.20 0.00 0.00 173.24 175.52 1nqo s TRP 310 N 0.40 3.53 -0.28 3.44 0.52 0.87 -0.06 118.94 127.37 1nqo s TRP 310 Ca -0.04 0.84 -0.19 0.00 0.02 0.00 0.00 56.10 56.73 1nqo s TRP 310 Cb -0.08 -2.31 0.12 0.00 -1.15 0.00 0.00 33.47 30.05 1nqo s TRP 310 CO -0.00 -0.19 0.91 1.52 0.02 0.00 0.00 176.95 179.20 1nqo s TYR 311 N -2.59 -0.67 -0.69 -1.98 1.13 -0.25 -1.42 117.35 110.88 1nqo s TYR 311 Ca 0.48 1.43 -0.24 0.00 -1.41 0.00 0.00 57.07 57.32 1nqo s TYR 311 Cb -0.10 0.41 0.05 0.00 -1.10 0.00 0.00 41.96 41.22 1nqo s TYR 311 CO 0.40 -0.33 1.09 0.34 -2.51 0.00 0.00 175.55 174.54 1nqo s ASP 312 N 1.04 6.18 0.63 -0.18 -1.08 -1.26 0.23 116.67 122.22 1nqo s ASP 312 Ca -0.05 -0.75 0.32 0.00 -0.52 0.00 0.00 52.55 51.55 1nqo s ASP 312 Cb -0.04 -2.47 1.76 0.00 -1.46 0.00 0.00 42.92 40.70 1nqo s ASP 312 CO -0.12 -1.59 2.06 -0.55 0.52 0.00 0.00 175.17 175.48 1nqo h ASN 313 N 9.73 0.00 0.00 -0.34 -1.07 -1.90 -1.72 115.58 120.28 1nqo h ASN 313 Ca -0.28 0.00 -0.26 0.00 0.07 0.00 0.00 56.30 55.82 1nqo h ASN 313 Cb 1.06 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 37.27 1nqo h ASN 313 CO 1.22 0.00 -1.49 -0.62 0.07 0.00 0.00 177.43 176.60 1nqo n GLU 314 N -3.33 0.56 0.04 4.14 1.02 -1.26 -4.30 120.64 117.52 1nqo n GLU 314 Ca 0.00 0.50 -0.12 0.00 -0.02 0.00 0.00 57.16 57.52 1nqo n GLU 314 Cb 0.34 -1.68 -0.09 0.00 -0.02 0.00 0.00 31.44 30.00 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 1.03 0.12 2.62 2.02 -1.78 -2.31 112.91 113.61 1nqo h THR 315 Ca -0.40 -1.10 0.02 0.00 0.77 0.00 0.00 66.41 65.70 1nqo h THR 315 Cb 1.31 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 69.36 1nqo h THR 315 CO -0.24 0.24 -0.24 1.23 0.37 0.00 0.00 175.52 176.89 1nqo h GLY 316 N -0.73 -0.43 0.88 2.16 0.00 -1.24 -1.38 103.07 102.32 1nqo h GLY 316 Ca -0.02 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.62 1nqo h GLY 316 CO 0.03 -0.21 0.56 -1.82 0.00 0.00 0.00 176.54 175.10 1nqo h TYR 317 N -0.43 1.04 -0.80 5.60 3.20 -1.71 -0.87 116.97 123.00 1nqo h TYR 317 Ca 0.03 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1nqo h TYR 317 Cb 0.46 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 1nqo h TYR 317 CO -0.22 0.60 0.45 0.77 -1.64 0.00 0.00 178.16 178.12 1nqo h SER 318 N 1.08 0.98 0.25 -2.11 0.02 -1.00 0.30 113.55 113.08 1nqo h SER 318 Ca 0.34 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 61.07 1nqo h SER 318 Cb 0.01 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 1nqo h SER 318 CO -0.12 0.78 -0.56 0.45 -1.14 0.00 0.00 176.83 176.24 1nqo h HIS 319 N 1.11 0.41 -0.38 3.45 3.86 -0.61 -2.68 115.15 120.32 1nqo h HIS 319 Ca 0.28 -0.15 -0.09 0.00 -1.16 0.00 0.00 60.37 59.25 1nqo h HIS 319 Cb 0.01 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1nqo h HIS 319 CO 0.01 0.81 -0.14 0.00 0.86 0.00 0.00 177.93 179.47 1nqo h ARG 320 N 0.25 0.70 -0.72 2.45 2.47 -0.29 0.51 114.38 119.74 1nqo h ARG 320 Ca 0.00 -0.24 -0.04 0.00 -1.26 0.00 0.00 59.98 58.45 1nqo h ARG 320 Cb 1.06 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.29 1nqo h ARG 320 CO 0.09 0.81 0.29 0.28 0.56 0.00 0.00 179.97 182.00 1nqo h VAL 321 N 0.63 1.24 -0.22 2.04 2.07 -0.77 0.72 116.25 121.97 1nqo h VAL 321 Ca 0.10 -0.76 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 1nqo h VAL 321 Cb 0.60 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1nqo h VAL 321 CO 0.04 0.31 -0.20 0.58 0.02 0.00 0.00 177.57 178.32 1nqo h VAL 322 N 1.04 1.32 -0.77 2.57 2.07 -1.11 -1.23 116.25 120.14 1nqo h VAL 322 Ca 0.24 -1.35 0.04 0.00 0.82 0.00 0.00 66.70 66.46 1nqo h VAL 322 Cb 0.19 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 1nqo h VAL 322 CO -0.02 0.41 0.47 0.44 0.02 0.00 0.00 177.57 178.90 1nqo h ASP 323 N 0.21 0.76 -0.61 0.57 3.32 -0.53 -0.84 116.42 119.30 1nqo h ASP 323 Ca 0.04 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 1nqo h ASP 323 Cb 0.74 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1nqo h ASP 323 CO 0.05 0.51 0.09 0.25 -1.72 0.00 0.00 179.24 178.42 1nqo h LEU 324 N 0.90 0.99 -0.62 1.55 5.85 -0.75 0.35 115.31 123.59 1nqo h LEU 324 Ca 0.32 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1nqo h LEU 324 Cb 0.08 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 1nqo h LEU 324 CO -0.14 1.00 0.29 0.00 -0.34 0.00 0.00 178.44 179.25 1nqo h ALA 325 N 1.12 0.80 -0.39 1.25 0.00 -0.39 -0.65 119.26 121.00 1nqo h ALA 325 Ca 0.19 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1nqo h ALA 325 Cb 0.44 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1nqo h ALA 325 CO 0.01 0.37 -0.33 0.00 0.00 0.00 0.00 179.25 179.30 1nqo h ALA 326 N 1.12 0.69 0.07 0.00 0.00 -0.88 -1.99 119.26 118.27 1nqo h ALA 326 Ca 0.21 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1nqo h ALA 326 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nqo h ALA 326 CO -0.03 0.67 -0.03 -0.92 0.00 0.00 0.00 179.25 178.94 1nqo h TYR 327 N 0.73 -0.09 -0.98 0.00 3.20 -0.69 -1.37 116.97 117.77 1nqo h TYR 327 Ca 0.07 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.03 1nqo h TYR 327 Cb 0.89 0.03 -0.07 0.00 1.54 0.00 0.00 36.73 39.12 1nqo h TYR 327 CO 0.05 0.12 0.63 0.82 -1.64 0.00 0.00 178.16 178.14 1nqo h ILE 328 N -0.29 1.02 -0.47 1.81 2.04 -1.12 -1.26 117.51 119.24 1nqo h ILE 328 Ca -0.01 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 1nqo h ILE 328 Cb 0.25 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 1nqo h ILE 328 CO 0.02 0.19 0.02 0.00 0.00 0.00 0.00 178.15 178.38 1nqo h ALA 329 N 1.50 1.15 0.00 1.87 0.00 -1.07 -2.42 119.26 120.30 1nqo h ALA 329 Ca 0.44 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nqo h ALA 329 Cb 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1nqo h ALA 329 CO -0.20 0.55 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 1nqo n SER 330 N -4.23 0.00 -0.36 0.00 3.41 -0.49 -2.26 113.62 109.69 1nqo n SER 330 Ca 0.03 -0.31 0.08 0.00 -0.26 0.00 0.00 58.87 58.40 1nqo n SER 330 Cb 0.28 -0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1nqo n SER 330 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1nqo n LYS 331 N -1.15 1.62 0.00 4.33 4.01 -0.91 -5.07 118.16 120.98 1nqo n LYS 331 Ca 0.12 -0.79 0.00 0.00 -0.51 0.00 0.00 58.31 57.14 1nqo n LYS 331 Cb 0.11 -1.30 0.00 0.00 -0.51 0.00 0.00 35.03 33.33 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 1.20 1.71 0.82 0.72 0.00 -0.96 -4.89 105.19 103.78 1nqo n GLY 332 Ca 0.07 -1.37 0.10 0.00 0.00 0.00 0.00 46.02 44.82 1nqo n GLY 332 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36