#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nqt n PRO 7 N 0.00 2.81 -4.25 0.11 -0.02 -1.26 -5.10 135.00 127.29 1nqt n PRO 7 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.27 1nqt n PRO 7 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.32 1nqt n PRO 7 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nqt s ASN 8 N -1.00 1.19 0.00 2.55 4.22 -1.26 -5.05 114.94 115.59 1nqt s ASN 8 Ca 0.00 -0.17 0.00 0.00 -2.14 0.00 0.00 52.86 50.55 1nqt s ASN 8 Cb 0.00 -0.55 0.00 0.00 1.28 0.00 0.00 41.25 41.98 1nqt s ASN 8 CO 0.00 -0.04 0.00 2.22 -2.04 0.00 0.00 177.10 177.24 1nqt n PHE 9 N 4.03 0.00 -0.21 1.54 1.16 -1.26 -0.06 117.46 122.66 1nqt n PHE 9 Ca -0.24 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.29 1nqt n PHE 9 Cb 0.51 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.33 1nqt n PHE 9 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1nqt n PHE 10 N -0.78 -0.22 0.28 2.97 7.35 -1.26 0.13 117.46 125.93 1nqt n PHE 10 Ca 0.00 0.62 0.12 0.00 -0.76 0.00 0.00 57.45 57.43 1nqt n PHE 10 Cb 0.00 -0.50 0.79 0.00 0.35 0.00 0.00 39.48 40.12 1nqt n PHE 10 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1nqt h LYS 11 N 0.00 0.00 0.00 -4.13 1.79 -0.89 0.43 116.57 113.77 1nqt h LYS 11 Ca 0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1nqt h LYS 11 Cb 0.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1nqt h LYS 11 CO -0.46 0.02 0.00 -1.33 -1.08 0.00 0.00 179.45 176.59 1nqt n MET 12 N -4.11 0.00 -0.35 3.15 2.81 0.34 -1.71 117.12 117.26 1nqt n MET 12 Ca -0.03 0.07 0.03 0.00 -1.81 0.00 0.00 57.70 55.96 1nqt n MET 12 Cb 0.10 -0.90 0.10 0.00 -0.71 0.00 0.00 33.22 31.80 1nqt n MET 12 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1nqt n VAL 13 N -0.71 -0.44 -0.20 2.03 0.31 -0.49 0.26 118.33 119.08 1nqt n VAL 13 Ca 0.00 2.21 0.01 0.00 -0.01 0.00 0.00 64.34 66.55 1nqt n VAL 13 Cb 0.00 -3.00 0.10 0.00 -0.91 0.00 0.00 33.84 30.02 1nqt n VAL 13 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1nqt h GLU 14 N 0.00 0.13 0.48 5.55 4.81 -0.23 0.15 114.58 125.47 1nqt h GLU 14 Ca 0.41 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.62 1nqt h GLU 14 Cb 0.65 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 1nqt h GLU 14 CO -0.97 0.08 -0.46 0.78 -0.73 0.00 0.00 179.01 177.72 1nqt h GLY 15 N 0.13 -1.12 -0.38 1.92 0.00 0.44 -0.57 103.07 103.49 1nqt h GLY 15 Ca 0.31 0.53 0.21 0.00 0.00 0.00 0.00 47.33 48.38 1nqt h GLY 15 CO -0.50 -0.36 0.19 0.74 0.00 0.00 0.00 176.54 176.61 1nqt h PHE 16 N -0.94 0.27 0.71 5.60 -1.00 -0.00 0.11 116.94 121.69 1nqt h PHE 16 Ca -0.05 0.05 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 1nqt h PHE 16 Cb 0.82 0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.39 1nqt h PHE 16 CO -0.23 -0.20 -0.40 0.35 -1.61 0.00 0.00 178.31 176.22 1nqt h PHE 17 N 0.20 -1.06 -0.74 -0.55 3.57 -0.19 -1.53 116.94 116.64 1nqt h PHE 17 Ca 0.51 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 62.10 1nqt h PHE 17 Cb 0.98 0.37 -0.05 0.00 2.79 0.00 0.00 35.95 40.04 1nqt h PHE 17 CO -0.29 -0.62 0.49 -0.44 -2.23 0.00 0.00 178.31 175.21 1nqt h ASP 18 N -1.04 0.53 0.29 0.41 3.32 -0.20 0.63 116.42 120.36 1nqt h ASP 18 Ca -0.09 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 1nqt h ASP 18 Cb 0.83 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1nqt h ASP 18 CO 0.12 0.31 -0.14 0.03 -1.72 0.00 0.00 179.24 177.84 1nqt h ARG 19 N 0.59 -0.38 -0.02 3.56 3.08 -0.46 -1.72 114.38 119.04 1nqt h ARG 19 Ca 0.35 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1nqt h ARG 19 Cb 0.56 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1nqt h ARG 19 CO -0.12 -0.12 0.01 0.78 -1.07 0.00 0.00 179.97 179.45 1nqt h GLY 20 N -0.59 0.03 -0.75 0.04 0.00 -0.44 -1.99 103.07 99.37 1nqt h GLY 20 Ca -0.04 -0.01 0.07 0.00 0.00 0.00 0.00 47.33 47.35 1nqt h GLY 20 CO 0.07 0.01 -0.43 0.00 0.00 0.00 0.00 176.54 176.19 1nqt n ALA 21 N -2.10 -0.44 0.07 3.60 0.00 0.21 -0.28 120.51 121.56 1nqt n ALA 21 Ca -0.07 0.64 -0.13 0.00 0.00 0.00 0.00 53.44 53.89 1nqt n ALA 21 Cb 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 19.45 19.28 1nqt n ALA 21 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nqt h SER 22 N 0.00 -0.09 -0.97 0.00 4.64 -1.14 -0.61 113.55 115.38 1nqt h SER 22 Ca 0.13 -0.09 0.28 0.00 -0.47 0.00 0.00 61.79 61.64 1nqt h SER 22 Cb 0.32 0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 1nqt h SER 22 CO -0.70 0.04 0.69 0.40 -0.87 0.00 0.00 176.83 176.39 1nqt h ILE 23 N -0.21 0.52 0.00 0.95 2.04 0.13 -3.00 117.51 117.94 1nqt h ILE 23 Ca -0.01 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1nqt h ILE 23 Cb 0.18 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1nqt h ILE 23 CO 0.02 0.00 -0.23 -0.37 0.00 0.00 0.00 178.15 177.57 1nqt h VAL 24 N 0.03 0.00 0.00 1.67 -1.51 -0.11 -3.41 116.25 112.91 1nqt h VAL 24 Ca 0.47 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1nqt h VAL 24 Cb 1.82 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1nqt h VAL 24 CO -0.02 0.00 0.00 1.21 -1.23 0.00 0.00 177.57 177.53 1nqt n GLU 25 N -3.82 0.00 0.00 5.19 2.13 -0.29 -0.71 120.64 123.13 1nqt n GLU 25 Ca -0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.79 1nqt n GLU 25 Cb 0.12 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.83 1nqt n GLU 25 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1nqt n ASP 26 N -2.39 0.00 0.00 4.31 10.43 -1.26 -2.62 116.55 125.02 1nqt n ASP 26 Ca 0.00 0.81 0.00 0.00 2.57 0.00 0.00 54.79 58.17 1nqt n ASP 26 Cb 0.00 -0.35 0.02 0.00 1.84 0.00 0.00 41.12 42.63 1nqt n ASP 26 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1nqt n LYS 27 N -1.56 0.04 0.00 -1.24 4.76 0.11 -0.30 118.16 119.97 1nqt n LYS 27 Ca 0.00 0.00 0.10 0.00 -2.87 0.00 0.00 58.31 55.54 1nqt n LYS 27 Cb 0.00 -1.32 -0.05 0.00 -1.84 0.00 0.00 35.03 31.82 1nqt n LYS 27 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1nqt n LEU 28 N -0.82 0.84 -0.01 -0.35 7.94 -0.64 -4.14 117.00 119.83 1nqt n LEU 28 Ca 0.01 -0.36 -0.01 0.00 -1.11 0.00 0.00 56.01 54.54 1nqt n LEU 28 Cb 0.00 -0.05 -0.00 0.00 0.53 0.00 0.00 43.42 43.90 1nqt n LEU 28 CO 0.00 0.20 -0.09 0.52 -1.11 0.00 0.00 177.39 176.92 1nqt n VAL 29 N -1.56 0.27 0.00 1.96 0.31 0.59 -4.70 118.33 115.21 1nqt n VAL 29 Ca 0.04 0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.68 1nqt n VAL 29 Cb 0.35 -1.47 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 1nqt n VAL 29 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1nqt n GLU 30 N -2.81 0.00 -0.14 5.55 -0.58 -1.11 -2.41 120.64 119.13 1nqt n GLU 30 Ca -0.02 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.80 1nqt n GLU 30 Cb 0.07 0.00 0.15 0.00 -0.57 0.00 0.00 31.44 31.09 1nqt n GLU 30 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1nqt n ASP 31 N 0.00 0.00 -2.23 1.62 -0.08 -1.26 -1.00 116.55 113.60 1nqt n ASP 31 Ca 0.00 0.70 -0.25 0.00 -1.51 0.00 0.00 54.79 53.73 1nqt n ASP 31 Cb 0.00 -0.28 0.02 0.00 2.34 0.00 0.00 41.12 43.20 1nqt n ASP 31 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1nqt n LEU 32 N -4.30 6.79 0.00 -2.67 4.77 -1.24 -4.50 117.00 115.85 1nqt n LEU 32 Ca 0.11 -3.83 0.00 0.00 -0.03 0.00 0.00 56.01 52.27 1nqt n LEU 32 Cb 0.38 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 1nqt n LEU 32 CO -0.02 1.46 0.00 -2.11 -1.33 0.00 0.00 177.39 175.39 1nqt n ARG 33 N 0.20 0.00 -1.45 3.23 1.85 -0.19 -4.70 116.66 115.60 1nqt n ARG 33 Ca 0.43 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.92 1nqt n ARG 33 Cb 0.56 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.93 1nqt n ARG 33 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1nqt n THR 34 N 0.00 4.39 -0.70 8.89 -1.04 -0.17 -3.19 114.28 122.46 1nqt n THR 34 Ca 0.00 -2.91 0.00 0.00 -2.04 0.00 0.00 64.05 59.10 1nqt n THR 34 Cb 0.00 -2.39 0.00 0.00 -1.82 0.00 0.00 70.33 66.12 1nqt n THR 34 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1nqt n ARG 35 N 2.93 -0.27 -2.71 -2.82 1.74 -1.26 -4.72 116.66 109.56 1nqt n ARG 35 Ca 0.71 -0.17 -0.04 0.00 -0.77 0.00 0.00 57.85 57.58 1nqt n ARG 35 Cb 0.31 -0.65 0.10 0.00 -1.02 0.00 0.00 32.46 31.20 1nqt n ARG 35 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1nqt n GLU 36 N -0.00 1.37 -0.85 5.56 -0.00 -1.19 -5.14 120.64 120.37 1nqt n GLU 36 Ca 0.00 -2.01 -0.35 0.00 -0.00 0.00 0.00 57.16 54.80 1nqt n GLU 36 Cb 0.18 -0.25 0.10 0.00 -0.00 0.00 0.00 31.44 31.47 1nqt n GLU 36 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1nqt n SER 37 N -0.97 -3.17 -2.74 -1.84 7.64 -1.26 -5.01 113.62 106.27 1nqt n SER 37 Ca -0.07 0.04 -0.06 0.00 1.01 0.00 0.00 58.87 59.79 1nqt n SER 37 Cb 0.85 -0.81 0.04 0.00 -1.01 0.00 0.00 64.21 63.28 1nqt n SER 37 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1nqt n GLU 38 N 0.27 0.62 -0.84 1.43 4.71 -1.26 -4.94 120.64 120.63 1nqt n GLU 38 Ca 0.00 -1.67 0.00 0.00 -0.01 0.00 0.00 57.16 55.49 1nqt n GLU 38 Cb 0.64 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.80 1nqt n GLU 38 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1nqt n GLU 39 N 2.03 0.00 -2.28 3.49 1.02 -1.26 -3.66 120.64 119.99 1nqt n GLU 39 Ca 0.11 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.05 1nqt n GLU 39 Cb 0.62 -2.22 -0.02 0.00 -0.02 0.00 0.00 31.44 29.80 1nqt n GLU 39 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1nqt n GLN 40 N -2.00 -1.72 -0.21 3.49 1.13 -1.26 -4.75 117.38 112.05 1nqt n GLN 40 Ca 0.00 0.98 0.11 0.00 -1.94 0.00 0.00 57.00 56.15 1nqt n GLN 40 Cb 0.00 -5.59 0.26 0.00 0.11 0.00 0.00 30.24 25.03 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1nqt n LYS 41 N -2.87 2.34 0.23 -1.09 5.02 -1.24 -3.66 118.16 116.89 1nqt n LYS 41 Ca -0.23 -2.05 0.12 0.00 -2.02 0.00 0.00 58.31 54.13 1nqt n LYS 41 Cb 0.67 -1.48 0.46 0.00 -0.02 0.00 0.00 35.03 34.66 1nqt n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt h ARG 42 N 3.78 0.00 0.00 1.97 2.47 -1.86 0.80 114.38 121.54 1nqt h ARG 42 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1nqt h ARG 42 Cb 0.84 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.16 1nqt h ARG 42 CO 0.00 0.15 0.00 -1.71 0.56 0.00 0.00 179.97 178.97 1nqt n ASN 43 N -3.26 0.00 -1.07 7.04 5.15 -1.24 -1.31 115.26 120.57 1nqt n ASN 43 Ca 0.01 -0.44 0.11 0.00 -0.60 0.00 0.00 54.58 53.66 1nqt n ASN 43 Cb 0.42 -0.15 0.20 0.00 -0.53 0.00 0.00 39.78 39.72 1nqt n ASN 43 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1nqt n ARG 44 N -1.15 2.40 -0.53 1.20 0.63 0.27 -3.75 116.66 115.73 1nqt n ARG 44 Ca 0.16 -2.20 0.08 0.00 -0.92 0.00 0.00 57.85 54.97 1nqt n ARG 44 Cb 0.15 -1.48 0.31 0.00 0.45 0.00 0.00 32.46 31.90 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1nqt n VAL 45 N 1.37 1.57 1.63 5.15 3.14 -0.43 -3.75 118.33 127.00 1nqt n VAL 45 Ca 0.18 -1.00 0.14 0.00 -2.96 0.00 0.00 64.34 60.70 1nqt n VAL 45 Cb 0.57 0.05 0.80 0.00 -1.06 0.00 0.00 33.84 34.20 1nqt n VAL 45 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 1nqt n ARG 46 N 0.92 0.73 0.08 1.45 1.85 -1.25 -2.38 116.66 118.07 1nqt n ARG 46 Ca 0.22 0.01 0.12 0.00 -1.00 0.00 0.00 57.85 57.20 1nqt n ARG 46 Cb 0.78 -1.50 0.45 0.00 -1.05 0.00 0.00 32.46 31.14 1nqt n ARG 46 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nqt n GLY 47 N 0.87 -1.39 0.22 2.89 0.00 -1.25 -2.02 105.19 104.52 1nqt n GLY 47 Ca 0.19 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 1nqt n GLY 47 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nqt h ILE 48 N 0.00 1.24 0.00 -0.61 1.08 -1.80 -1.85 117.51 115.57 1nqt h ILE 48 Ca 0.00 -0.89 -0.02 0.00 -0.39 0.00 0.00 64.86 63.57 1nqt h ILE 48 Cb 0.47 0.98 -0.00 0.00 -3.07 0.00 0.00 36.82 35.20 1nqt h ILE 48 CO 0.00 0.31 -0.07 -0.07 -0.69 0.00 0.00 178.15 177.62 1nqt h LEU 49 N 0.58 0.00 -0.37 1.44 4.07 -1.64 -1.03 115.31 118.36 1nqt h LEU 49 Ca 0.13 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.91 1nqt h LEU 49 Cb 0.38 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.11 1nqt h LEU 49 CO 0.01 0.07 -0.55 0.03 -1.08 0.00 0.00 178.44 176.93 1nqt h ARG 50 N 0.00 0.78 -0.40 1.13 3.08 -1.26 -2.54 114.38 115.17 1nqt h ARG 50 Ca -0.00 -0.49 -0.05 0.00 0.07 0.00 0.00 59.98 59.50 1nqt h ARG 50 Cb 0.51 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1nqt h ARG 50 CO 0.01 1.12 0.05 0.82 -1.07 0.00 0.00 179.97 180.91 1nqt h ILE 51 N 0.60 1.24 -0.14 2.04 2.04 -0.79 -3.26 117.51 119.24 1nqt h ILE 51 Ca 0.01 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 1nqt h ILE 51 Cb 1.14 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 1nqt h ILE 51 CO 0.12 0.30 0.09 0.40 0.00 0.00 0.00 178.15 179.06 1nqt h ILE 52 N 0.51 1.07 -0.91 -0.67 2.04 -1.13 -3.32 117.51 115.10 1nqt h ILE 52 Ca 0.12 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 65.93 1nqt h ILE 52 Cb 0.39 0.93 -0.14 0.00 -0.74 0.00 0.00 36.82 37.26 1nqt h ILE 52 CO 0.01 0.06 -0.47 0.50 0.00 0.00 0.00 178.15 178.26 1nqt h LYS 53 N 0.16 -0.05 -6.40 2.37 3.64 -1.49 -3.43 116.57 111.36 1nqt h LYS 53 Ca 0.05 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.89 1nqt h LYS 53 Cb 0.03 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 1nqt h LYS 53 CO -0.01 -0.03 -0.01 -1.25 -2.27 0.00 0.00 179.45 175.88 1nqt s PRO 54 N -5.77 4.10 0.11 1.90 0.04 -1.25 -5.01 135.00 129.11 1nqt s PRO 54 Ca -0.13 0.65 -0.31 0.00 0.04 0.00 0.00 61.00 61.25 1nqt s PRO 54 Cb 0.16 -2.94 -0.09 0.00 0.04 0.00 0.00 34.50 31.67 1nqt s PRO 54 CO 0.67 0.46 1.62 0.00 0.04 0.00 0.00 177.00 179.79 1nqt h ASN 56 N 7.69 0.84 -5.03 0.00 2.35 -1.07 -3.45 115.58 116.91 1nqt h ASN 56 Ca -0.43 -0.29 -0.16 0.00 -0.55 0.00 0.00 56.30 54.88 1nqt h ASN 56 Cb 1.20 -0.23 -0.20 0.00 0.05 0.00 0.00 38.32 39.14 1nqt h ASN 56 CO 0.92 1.00 -0.69 -1.00 -1.65 0.00 0.00 177.43 176.02 1nqt s HIS 57 N -4.71 0.30 -0.29 1.19 3.76 -1.07 -5.06 115.29 109.42 1nqt s HIS 57 Ca -0.10 -0.62 0.01 0.00 -0.15 0.00 0.00 55.06 54.20 1nqt s HIS 57 Cb 0.13 -0.22 0.18 0.00 1.11 0.00 0.00 32.58 33.78 1nqt s HIS 57 CO 0.84 -0.23 0.55 0.54 -0.85 0.00 0.00 174.74 175.59 1nqt s VAL 58 N -1.92 -0.92 -0.21 -0.90 0.11 -1.26 -1.20 120.40 114.10 1nqt s VAL 58 Ca -0.12 -0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 58.72 1nqt s VAL 58 Cb -0.07 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.78 1nqt s VAL 58 CO -0.03 -0.04 0.50 -0.22 -3.33 0.00 0.00 175.10 171.98 1nqt s LEU 59 N 2.79 4.14 -0.07 2.54 2.96 -0.23 -4.96 118.68 125.84 1nqt s LEU 59 Ca 0.16 0.63 0.02 0.00 -0.22 0.00 0.00 54.13 54.71 1nqt s LEU 59 Cb -0.13 -2.67 -0.03 0.00 0.50 0.00 0.00 46.19 43.86 1nqt s LEU 59 CO -0.22 -0.18 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.08 1nqt s SER 60 N 1.19 4.32 -0.06 3.68 0.01 -1.26 -0.84 113.70 120.73 1nqt s SER 60 Ca 0.23 -0.13 -0.14 0.00 1.31 0.00 0.00 55.95 57.21 1nqt s SER 60 Cb -0.15 -1.10 0.03 0.00 0.21 0.00 0.00 66.02 65.01 1nqt s SER 60 CO 0.09 0.33 0.34 -1.48 0.41 0.00 0.00 173.24 172.93 1nqt s LEU 61 N -0.61 0.73 0.13 2.44 0.05 0.19 -4.99 118.68 116.62 1nqt s LEU 61 Ca 0.09 0.35 0.03 0.00 0.05 0.00 0.00 54.13 54.65 1nqt s LEU 61 Cb -0.11 1.28 -0.04 0.00 -2.05 0.00 0.00 46.19 45.27 1nqt s LEU 61 CO 0.01 -0.33 0.19 -0.94 -0.55 0.00 0.00 176.35 174.74 1nqt s SER 62 N -0.73 5.96 -0.29 1.48 1.04 -1.26 -1.63 113.70 118.27 1nqt s SER 62 Ca -0.08 0.07 -0.20 0.00 0.48 0.00 0.00 55.95 56.21 1nqt s SER 62 Cb -0.04 -1.71 0.16 0.00 0.10 0.00 0.00 66.02 64.54 1nqt s SER 62 CO 0.03 0.09 1.15 0.72 0.98 0.00 0.00 173.24 176.21 1nqt s PHE 63 N -1.65 -0.33 0.49 5.02 -0.12 -0.82 -4.94 117.98 115.62 1nqt s PHE 63 Ca 0.33 0.72 -0.02 0.00 -0.05 0.00 0.00 56.93 57.91 1nqt s PHE 63 Cb -0.11 0.31 -0.00 0.00 -0.63 0.00 0.00 43.02 42.59 1nqt s PHE 63 CO 0.26 -0.16 0.74 -1.25 -0.05 0.00 0.00 175.22 174.75 1nqt s PRO 64 N 0.73 3.06 -0.05 1.99 0.04 -1.26 0.45 135.00 139.96 1nqt s PRO 64 Ca -0.02 -0.32 -0.14 0.00 0.04 0.00 0.00 61.00 60.56 1nqt s PRO 64 Cb -0.04 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 32.06 1nqt s PRO 64 CO -0.12 -0.38 0.33 0.96 0.04 0.00 0.00 177.00 177.83 1nqt s ILE 65 N -2.68 0.04 -0.38 0.56 -4.36 -0.36 -4.88 121.20 109.13 1nqt s ILE 65 Ca 0.50 -0.33 -0.17 0.00 -0.26 0.00 0.00 60.65 60.38 1nqt s ILE 65 Cb -0.10 -0.59 0.01 0.00 1.25 0.00 0.00 42.46 43.02 1nqt s ILE 65 CO 0.40 -0.18 0.45 -0.60 0.24 0.00 0.00 174.94 175.25 1nqt s ARG 66 N -0.90 3.38 0.97 0.37 3.52 -1.26 -1.88 118.95 123.14 1nqt s ARG 66 Ca -0.10 -0.47 -0.12 0.00 -0.13 0.00 0.00 55.73 54.91 1nqt s ARG 66 Cb -0.04 -3.88 0.17 0.00 -1.56 0.00 0.00 34.95 29.64 1nqt s ARG 66 CO 0.03 -0.71 1.09 1.03 -0.81 0.00 0.00 175.30 175.92 1nqt s ARG 67 N 2.22 0.65 0.53 5.12 0.52 -0.71 -4.92 118.95 122.37 1nqt s ARG 67 Ca 0.14 0.96 0.25 0.00 -0.52 0.00 0.00 55.73 56.57 1nqt s ARG 67 Cb -0.16 -1.73 1.49 0.00 0.52 0.00 0.00 34.95 35.07 1nqt s ARG 67 CO 0.13 -2.70 2.13 -0.44 0.02 0.00 0.00 175.30 174.44 1nqt h ASP 68 N -1.89 0.00 0.92 0.23 3.32 -1.97 -2.78 116.42 114.25 1nqt h ASP 68 Ca -0.51 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 1nqt h ASP 68 Cb 1.29 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.85 1nqt h ASP 68 CO 0.51 0.08 -0.44 0.44 -1.72 0.00 0.00 179.24 178.11 1nqt h ASP 69 N 0.00 -1.05 0.00 6.45 3.32 -2.04 -3.47 116.42 119.64 1nqt h ASP 69 Ca -0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1nqt h ASP 69 Cb 0.20 0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1nqt h ASP 69 CO 0.01 -0.74 0.00 0.61 -1.72 0.00 0.00 179.24 177.40 1nqt n GLY 70 N -1.57 1.52 2.82 2.75 0.00 -1.05 -5.15 105.19 104.51 1nqt n GLY 70 Ca -0.16 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 1nqt n GLY 70 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nqt n SER 71 N 0.00 -1.22 -4.80 1.61 3.41 -1.26 -4.20 113.62 107.16 1nqt n SER 71 Ca 0.00 0.91 -0.38 0.00 -0.26 0.00 0.00 58.87 59.14 1nqt n SER 71 Cb 0.00 -0.78 -0.06 0.00 -0.26 0.00 0.00 64.21 63.10 1nqt n SER 71 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1nqt s TRP 72 N -0.91 3.63 -0.01 7.33 0.51 -1.26 -1.73 118.94 126.49 1nqt s TRP 72 Ca 0.53 0.86 -0.01 0.00 -2.12 0.00 0.00 56.10 55.35 1nqt s TRP 72 Cb -0.74 -2.32 0.00 0.00 -0.81 0.00 0.00 33.47 29.60 1nqt s TRP 72 CO 0.47 0.48 0.03 -2.00 -0.51 0.00 0.00 176.95 175.43 1nqt s GLU 73 N -0.45 0.07 0.23 4.98 2.12 -0.79 -4.99 118.70 119.87 1nqt s GLU 73 Ca 0.22 -0.01 -0.11 0.00 0.36 0.00 0.00 54.97 55.43 1nqt s GLU 73 Cb -0.15 0.03 -0.07 0.00 0.26 0.00 0.00 34.13 34.20 1nqt s GLU 73 CO 0.10 -0.01 0.57 0.14 -0.54 0.00 0.00 175.26 175.52 1nqt s VAL 74 N -0.13 4.89 -0.05 3.70 -7.23 -1.26 -1.22 120.40 119.10 1nqt s VAL 74 Ca -0.02 0.58 0.05 0.00 -1.81 0.00 0.00 61.98 60.79 1nqt s VAL 74 Cb -0.01 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.29 1nqt s VAL 74 CO 0.00 -0.03 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.91 1nqt s ILE 75 N -1.78 1.78 0.17 -0.62 1.09 0.17 -4.92 121.20 117.09 1nqt s ILE 75 Ca 0.47 -0.92 0.04 0.00 -1.10 0.00 0.00 60.65 59.14 1nqt s ILE 75 Cb -0.12 -1.51 -0.04 0.00 -1.06 0.00 0.00 42.46 39.73 1nqt s ILE 75 CO 0.20 0.50 0.24 -1.83 -0.10 0.00 0.00 174.94 173.95 1nqt s GLU 76 N -0.10 3.23 -0.26 2.79 -1.05 -1.26 -1.94 118.70 120.10 1nqt s GLU 76 Ca -0.03 -0.73 -0.36 0.00 -0.15 0.00 0.00 54.97 53.70 1nqt s GLU 76 Cb -0.13 -2.83 0.16 0.00 -0.44 0.00 0.00 34.13 30.89 1nqt s GLU 76 CO 0.03 0.49 1.33 0.20 0.95 0.00 0.00 175.26 178.27 1nqt s GLY 77 N -3.29 -0.18 0.13 -3.83 0.00 -0.65 -1.58 107.32 97.92 1nqt s GLY 77 Ca 0.33 1.99 -0.01 0.00 0.00 0.00 0.00 44.72 47.03 1nqt s GLY 77 CO 0.27 0.69 0.05 -0.19 0.00 0.00 0.00 173.10 173.92 1nqt s TYR 78 N -1.96 0.84 -0.08 1.90 1.51 0.60 0.54 117.35 120.69 1nqt s TYR 78 Ca 0.11 -1.22 -0.05 0.00 -1.01 0.00 0.00 57.07 54.89 1nqt s TYR 78 Cb -0.01 -0.48 0.03 0.00 -0.11 0.00 0.00 41.96 41.40 1nqt s TYR 78 CO -0.04 -0.51 0.20 0.50 -1.11 0.00 0.00 175.55 174.60 1nqt s ARG 79 N -4.04 0.19 -0.05 -0.62 6.06 -0.02 -0.07 118.95 120.40 1nqt s ARG 79 Ca 0.23 0.39 0.04 0.00 -2.50 0.00 0.00 55.73 53.88 1nqt s ARG 79 Cb 0.07 -0.04 0.00 0.00 0.06 0.00 0.00 34.95 35.04 1nqt s ARG 79 CO 0.01 -0.11 -0.15 0.00 -2.50 0.00 0.00 175.30 172.55 1nqt s ALA 80 N 0.77 1.37 -0.36 6.12 0.00 0.41 -1.07 121.76 129.01 1nqt s ALA 80 Ca -0.06 -0.58 -0.10 0.00 0.00 0.00 0.00 51.96 51.23 1nqt s ALA 80 Cb -0.07 -0.49 0.03 0.00 0.00 0.00 0.00 23.12 22.59 1nqt s ALA 80 CO -0.04 0.22 0.18 -0.65 0.00 0.00 0.00 175.76 175.47 1nqt s GLN 81 N 0.19 2.84 0.00 0.00 -0.21 -0.34 -0.88 119.66 121.26 1nqt s GLN 81 Ca -0.06 -1.06 0.00 0.00 0.02 0.00 0.00 55.36 54.26 1nqt s GLN 81 Cb -0.12 -3.65 0.00 0.00 1.00 0.00 0.00 33.01 30.24 1nqt s GLN 81 CO 0.02 -0.66 0.22 1.58 -2.12 0.00 0.00 175.29 174.33 1nqt n HIS 82 N 4.96 0.00 -4.08 0.91 -0.00 0.71 -2.60 115.22 115.12 1nqt n HIS 82 Ca -0.12 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.38 1nqt n HIS 82 Cb 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.40 1nqt n HIS 82 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nqt s SER 83 N -1.78 5.27 -0.04 0.26 0.15 -1.23 -1.30 113.70 115.03 1nqt s SER 83 Ca 0.00 -0.40 0.05 0.00 0.70 0.00 0.00 55.95 56.31 1nqt s SER 83 Cb 0.00 -1.18 0.08 0.00 -1.71 0.00 0.00 66.02 63.21 1nqt s SER 83 CO 0.00 -0.11 0.94 1.41 1.20 0.00 0.00 173.24 176.68 1nqt n HIS 84 N -1.17 0.00 -0.17 3.44 -0.00 -1.26 -4.11 115.22 111.94 1nqt n HIS 84 Ca -0.06 -0.37 0.13 0.00 -0.00 0.00 0.00 57.72 57.43 1nqt n HIS 84 Cb 0.59 -0.07 0.46 0.00 -0.00 0.00 0.00 29.99 30.97 1nqt n HIS 84 CO 0.00 0.00 0.00 -0.56 -0.00 0.00 0.00 176.34 175.78 1nqt h GLN 85 N 0.00 0.49 -4.80 -0.41 3.07 -1.95 -3.28 115.11 108.22 1nqt h GLN 85 Ca 0.00 -0.03 -0.68 0.00 0.09 0.00 0.00 58.65 58.03 1nqt h GLN 85 Cb 1.07 -0.11 -0.34 0.00 0.08 0.00 0.00 27.48 28.18 1nqt h GLN 85 CO 0.00 0.32 -0.72 0.50 0.09 0.00 0.00 178.83 179.02 1nqt s ARG 86 N -5.48 2.42 0.00 0.06 6.06 -1.26 -4.98 118.95 115.77 1nqt s ARG 86 Ca -0.08 -1.26 0.00 0.00 -2.50 0.00 0.00 55.73 51.88 1nqt s ARG 86 Cb 0.21 -3.11 0.00 0.00 0.06 0.00 0.00 34.95 32.11 1nqt s ARG 86 CO 0.77 -0.59 0.05 0.25 -2.50 0.00 0.00 175.30 173.27 1nqt n THR 87 N 4.59 0.00 -1.71 4.11 -2.24 -1.24 -2.84 114.28 114.94 1nqt n THR 87 Ca -0.14 0.27 -0.42 0.00 -2.27 0.00 0.00 64.05 61.49 1nqt n THR 87 Cb 0.43 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 1nqt n THR 87 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1nqt s PRO 88 N -0.23 3.94 0.01 -0.78 0.04 -1.23 -4.68 135.00 132.06 1nqt s PRO 88 Ca 0.00 2.41 -0.30 0.00 0.04 0.00 0.00 61.00 63.15 1nqt s PRO 88 Cb 0.00 -4.18 -0.03 0.00 0.04 0.00 0.00 34.50 30.33 1nqt s PRO 88 CO 0.00 -1.18 1.02 0.00 0.04 0.00 0.00 177.00 176.88 1nqt s LYS 90 N 1.08 2.81 0.00 0.00 2.47 -0.48 0.13 119.74 125.75 1nqt s LYS 90 Ca 0.53 -1.12 0.00 0.00 -1.56 0.00 0.00 55.97 53.82 1nqt s LYS 90 Cb -0.22 -2.49 0.00 0.00 -1.46 0.00 0.00 37.83 33.65 1nqt s LYS 90 CO 0.28 0.40 0.00 0.41 0.16 0.00 0.00 175.35 176.59 1nqt n GLY 91 N -1.11 4.28 2.18 5.54 0.00 -1.19 -0.86 105.19 114.03 1nqt n GLY 91 Ca -0.08 -0.56 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 1nqt n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nqt n GLY 92 N -1.38 -2.95 2.79 -0.02 0.00 -1.25 -2.70 105.19 99.68 1nqt n GLY 92 Ca 0.00 -1.43 -0.23 0.00 0.00 0.00 0.00 46.02 44.36 1nqt n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 93 N -2.13 0.42 -0.09 -0.61 1.01 0.11 -0.41 121.20 119.51 1nqt s ILE 93 Ca 0.45 0.08 -0.02 0.00 0.00 0.00 0.00 60.65 61.16 1nqt s ILE 93 Cb -0.05 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 1nqt s ILE 93 CO 0.35 0.26 -0.01 -0.60 0.00 0.00 0.00 174.94 174.94 1nqt s ARG 94 N 1.88 3.00 -0.59 2.79 6.06 0.26 -3.13 118.95 129.22 1nqt s ARG 94 Ca 0.04 -0.43 0.04 0.00 -2.50 0.00 0.00 55.73 52.88 1nqt s ARG 94 Cb -0.12 -2.77 0.15 0.00 0.06 0.00 0.00 34.95 32.26 1nqt s ARG 94 CO -0.05 0.67 0.36 0.71 -2.50 0.00 0.00 175.30 174.49 1nqt s TYR 95 N -0.79 3.19 -0.22 5.12 4.12 -1.26 0.71 117.35 128.22 1nqt s TYR 95 Ca 0.12 -3.16 -0.19 0.00 0.02 0.00 0.00 57.07 53.86 1nqt s TYR 95 Cb -0.11 -2.63 0.06 0.00 -1.52 0.00 0.00 41.96 37.75 1nqt s TYR 95 CO 0.02 -0.66 0.58 0.45 0.02 0.00 0.00 175.55 175.96 1nqt s SER 96 N -0.75 -0.63 0.00 2.29 0.15 -0.60 -4.54 113.70 109.62 1nqt s SER 96 Ca 0.21 1.18 0.00 0.00 0.70 0.00 0.00 55.95 58.04 1nqt s SER 96 Cb -0.15 1.17 0.00 0.00 -1.71 0.00 0.00 66.02 65.33 1nqt s SER 96 CO -0.08 -0.20 0.42 0.35 1.20 0.00 0.00 173.24 174.93 1nqt n THR 97 N 3.00 0.00 -2.57 6.45 -2.24 -0.29 -1.87 114.28 116.77 1nqt n THR 97 Ca -0.15 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.40 1nqt n THR 97 Cb 0.56 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 1nqt n THR 97 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1nqt n ASP 98 N -0.92 3.97 -4.40 3.42 9.92 -1.26 -4.91 116.55 122.37 1nqt n ASP 98 Ca 0.00 -3.51 -0.32 0.00 -0.53 0.00 0.00 54.79 50.43 1nqt n ASP 98 Cb 0.00 -0.49 -0.14 0.00 -0.64 0.00 0.00 41.12 39.85 1nqt n ASP 98 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1nqt s VAL 99 N -4.92 2.82 -0.02 2.53 -7.23 -0.78 -5.10 120.40 107.70 1nqt s VAL 99 Ca 0.44 -0.79 0.01 0.00 -1.81 0.00 0.00 61.98 59.83 1nqt s VAL 99 Cb 0.40 -2.11 0.01 0.00 0.56 0.00 0.00 36.38 35.24 1nqt s VAL 99 CO -0.14 0.57 -0.03 -0.94 -0.31 0.00 0.00 175.10 174.25 1nqt s SER 100 N -0.36 0.57 0.07 4.85 1.04 -1.26 -4.86 113.70 113.76 1nqt s SER 100 Ca 0.03 -0.07 -0.13 0.00 0.48 0.00 0.00 55.95 56.25 1nqt s SER 100 Cb -0.12 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.77 1nqt s SER 100 CO 0.02 -0.02 0.91 0.52 0.98 0.00 0.00 173.24 175.65 1nqt n VAL 101 N 3.57 -0.30 -0.43 5.02 0.31 -1.26 0.31 118.33 125.56 1nqt n VAL 101 Ca -0.20 1.41 0.40 0.00 -0.01 0.00 0.00 64.34 65.94 1nqt n VAL 101 Cb 0.54 -1.77 0.77 0.00 -0.91 0.00 0.00 33.84 32.47 1nqt n VAL 101 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1nqt h ASP 102 N 0.00 0.01 0.13 4.52 5.19 -1.97 0.16 116.42 124.45 1nqt h ASP 102 Ca 0.07 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 1nqt h ASP 102 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 1nqt h ASP 102 CO -0.41 -0.00 -0.06 -0.08 -3.12 0.00 0.00 179.24 175.57 1nqt h GLU 103 N 0.00 -0.17 -0.47 3.56 4.81 0.45 -2.39 114.58 120.38 1nqt h GLU 103 Ca 0.67 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 60.00 1nqt h GLU 103 Cb 2.68 0.04 -0.10 0.00 0.63 0.00 0.00 28.75 32.00 1nqt h GLU 103 CO -0.01 -0.11 -0.35 -0.39 -0.73 0.00 0.00 179.01 177.42 1nqt h VAL 104 N -0.27 0.19 -1.41 0.32 -1.51 -0.36 1.39 116.25 114.60 1nqt h VAL 104 Ca -0.02 0.00 0.42 0.00 -1.23 0.00 0.00 66.70 65.87 1nqt h VAL 104 Cb 0.13 0.19 -0.09 0.00 -2.13 0.00 0.00 31.29 29.39 1nqt h VAL 104 CO 0.03 0.00 0.98 0.11 -1.23 0.00 0.00 177.57 177.46 1nqt h LYS 105 N -0.23 0.08 0.00 5.19 1.57 -0.85 0.49 116.57 122.82 1nqt h LYS 105 Ca 0.19 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1nqt h LYS 105 Cb 0.55 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1nqt h LYS 105 CO -0.59 0.05 -0.02 0.00 -0.57 0.00 0.00 179.45 178.31 1nqt h ALA 106 N 1.39 0.00 -0.93 3.86 0.00 0.23 -3.10 119.26 120.71 1nqt h ALA 106 Ca 0.75 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 55.44 1nqt h ALA 106 Cb 2.65 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 20.39 1nqt h ALA 106 CO -0.17 0.02 0.60 -0.07 0.00 0.00 0.00 179.25 179.62 1nqt h LEU 107 N -1.00 0.87 0.18 0.00 3.38 0.81 -0.79 115.31 118.77 1nqt h LEU 107 Ca -0.01 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1nqt h LEU 107 Cb 0.59 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1nqt h LEU 107 CO -0.00 0.52 -0.20 0.00 0.09 0.00 0.00 178.44 178.84 1nqt h ALA 108 N 1.53 -0.89 -0.72 1.53 0.00 -0.23 -1.43 119.26 119.05 1nqt h ALA 108 Ca 0.43 -0.07 0.27 0.00 0.00 0.00 0.00 54.91 55.53 1nqt h ALA 108 Cb 0.36 0.46 -0.13 0.00 0.00 0.00 0.00 17.79 18.48 1nqt h ALA 108 CO -0.19 -0.91 0.26 0.45 0.00 0.00 0.00 179.25 178.87 1nqt n SER 109 N -3.55 0.14 0.23 0.00 2.88 -0.70 0.65 113.62 113.27 1nqt n SER 109 Ca -0.05 1.21 -0.09 0.00 -1.33 0.00 0.00 58.87 58.61 1nqt n SER 109 Cb 0.18 -0.54 -0.04 0.00 -0.75 0.00 0.00 64.21 63.06 1nqt n SER 109 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1nqt h LEU 110 N 0.00 -0.50 -0.99 2.46 5.85 -0.27 -3.21 115.31 118.65 1nqt h LEU 110 Ca 0.55 0.02 0.40 0.00 0.84 0.00 0.00 57.88 59.70 1nqt h LEU 110 Cb 1.38 0.13 -0.18 0.00 0.37 0.00 0.00 40.66 42.36 1nqt h LEU 110 CO -0.60 -0.33 0.49 0.23 -0.34 0.00 0.00 178.44 177.89 1nqt n MET 111 N -3.71 -0.06 0.24 1.25 2.81 0.21 0.57 117.12 118.43 1nqt n MET 111 Ca -0.07 1.38 0.11 0.00 -1.81 0.00 0.00 57.70 57.30 1nqt n MET 111 Cb 0.23 -2.45 0.57 0.00 -0.71 0.00 0.00 33.22 30.87 1nqt n MET 111 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nqt h THR 112 N 0.00 0.57 0.07 2.03 1.03 -1.46 -0.66 112.91 114.49 1nqt h THR 112 Ca 0.82 -0.89 -0.27 0.00 -0.01 0.00 0.00 66.41 66.06 1nqt h THR 112 Cb 2.14 1.59 -0.02 0.00 -1.07 0.00 0.00 68.15 70.80 1nqt h THR 112 CO -0.78 0.18 -1.43 1.88 -0.01 0.00 0.00 175.52 175.37 1nqt h TYR 113 N 0.00 0.28 -0.30 0.00 0.05 0.10 -3.18 116.97 113.92 1nqt h TYR 113 Ca -0.00 -0.20 0.07 0.00 0.05 0.00 0.00 58.73 58.65 1nqt h TYR 113 Cb 0.58 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.23 1nqt h TYR 113 CO 0.00 1.56 -0.23 -0.22 -1.05 0.00 0.00 178.16 178.22 1nqt h LYS 114 N -0.49 -0.20 -0.20 4.88 3.64 -0.68 -0.75 116.57 122.77 1nqt h LYS 114 Ca -0.33 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1nqt h LYS 114 Cb 1.63 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 33.45 1nqt h LYS 114 CO -0.03 -0.13 -0.09 0.00 -2.27 0.00 0.00 179.45 176.92 1nqt h ALA 116 N 1.12 2.07 0.20 0.00 0.00 -1.17 -0.55 119.26 120.93 1nqt h ALA 116 Ca 0.11 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1nqt h ALA 116 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1nqt h ALA 116 CO -0.24 -0.48 -0.10 0.28 0.00 0.00 0.00 179.25 178.71 1nqt h VAL 117 N 0.48 0.80 -0.40 0.00 2.07 0.49 -2.90 116.25 116.80 1nqt h VAL 117 Ca 0.59 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 68.08 1nqt h VAL 117 Cb 1.35 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1nqt h VAL 117 CO -0.34 0.00 0.04 1.33 0.02 0.00 0.00 177.57 178.63 1nqt n VAL 118 N -5.21 1.85 -2.19 2.57 0.24 -0.42 -4.81 118.33 110.36 1nqt n VAL 118 Ca -0.09 -0.94 -0.20 0.00 -2.04 0.00 0.00 64.34 61.07 1nqt n VAL 118 Cb 0.13 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.09 1nqt n VAL 118 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1nqt n ASP 119 N 0.31 -5.63 -4.61 -1.34 8.00 -0.35 -4.95 116.55 107.98 1nqt n ASP 119 Ca 0.20 0.13 -0.42 0.00 0.71 0.00 0.00 54.79 55.41 1nqt n ASP 119 Cb 0.90 -4.76 -0.04 0.00 -0.02 0.00 0.00 41.12 37.20 1nqt n ASP 119 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1nqt s VAL 120 N -2.93 4.72 -0.09 2.53 1.01 -0.73 -4.95 120.40 119.96 1nqt s VAL 120 Ca 0.00 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.17 1nqt s VAL 120 Cb 0.00 -4.22 -0.11 0.00 0.00 0.00 0.00 36.38 32.05 1nqt s VAL 120 CO 0.00 -0.35 1.90 -0.81 0.00 0.00 0.00 175.10 175.84 1nqt n PRO 121 N 6.40 0.99 -4.47 2.72 -0.04 -1.26 -4.31 135.00 135.03 1nqt n PRO 121 Ca 0.05 -0.55 -0.23 0.00 -0.04 0.00 0.00 63.50 62.74 1nqt n PRO 121 Cb 0.48 -1.80 -0.10 0.00 -0.04 0.00 0.00 33.50 32.03 1nqt n PRO 121 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1nqt s PHE 122 N 2.31 2.08 0.08 0.54 2.99 -1.26 -4.59 117.98 120.12 1nqt s PHE 122 Ca 0.30 -0.71 0.03 0.00 0.00 0.00 0.00 56.93 56.55 1nqt s PHE 122 Cb 0.14 -1.25 -0.04 0.00 0.00 0.00 0.00 43.02 41.87 1nqt s PHE 122 CO -0.00 0.29 0.11 0.20 -0.00 0.00 0.00 175.22 175.82 1nqt s GLY 123 N -3.50 2.03 0.26 4.36 0.00 -1.07 -4.70 107.32 104.70 1nqt s GLY 123 Ca 0.32 -0.99 -0.29 0.00 0.00 0.00 0.00 44.72 43.75 1nqt s GLY 123 CO 0.14 -0.98 1.20 -0.32 0.00 0.00 0.00 173.10 173.14 1nqt s GLY 124 N -2.46 2.87 0.02 0.20 0.00 -1.26 -1.39 107.32 105.31 1nqt s GLY 124 Ca 0.30 1.03 -0.21 0.00 0.00 0.00 0.00 44.72 45.84 1nqt s GLY 124 CO 0.23 1.76 0.48 0.00 0.00 0.00 0.00 173.10 175.58 1nqt s ALA 125 N -0.71 -1.22 -0.07 3.20 0.00 -0.04 0.25 121.76 123.16 1nqt s ALA 125 Ca 0.49 0.61 -0.21 0.00 0.00 0.00 0.00 51.96 52.85 1nqt s ALA 125 Cb -0.35 0.24 0.05 0.00 0.00 0.00 0.00 23.12 23.06 1nqt s ALA 125 CO 0.42 -0.42 0.48 0.21 0.00 0.00 0.00 175.76 176.46 1nqt s LYS 126 N -2.00 0.77 0.09 0.00 2.47 -0.06 -3.59 119.74 117.42 1nqt s LYS 126 Ca -0.08 0.19 0.03 0.00 -1.56 0.00 0.00 55.97 54.55 1nqt s LYS 126 Cb -0.01 0.36 -0.04 0.00 -1.46 0.00 0.00 37.83 36.68 1nqt s LYS 126 CO 0.02 -0.20 -0.08 0.00 0.16 0.00 0.00 175.35 175.24 1nqt s ALA 127 N -0.87 0.98 -0.01 3.13 0.00 0.45 -0.45 121.76 124.99 1nqt s ALA 127 Ca -0.09 -1.18 -0.10 0.00 0.00 0.00 0.00 51.96 50.58 1nqt s ALA 127 Cb -0.03 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1nqt s ALA 127 CO 0.05 -0.11 0.21 0.20 0.00 0.00 0.00 175.76 176.11 1nqt s GLY 128 N -2.54 -0.04 -0.17 0.00 0.00 0.90 0.91 107.32 106.38 1nqt s GLY 128 Ca 0.05 0.10 -0.00 0.00 0.00 0.00 0.00 44.72 44.87 1nqt s GLY 128 CO -0.02 -0.06 -0.07 0.14 0.00 0.00 0.00 173.10 173.10 1nqt s VAL 129 N -1.23 1.22 -0.84 1.40 1.01 0.22 -0.29 120.40 121.90 1nqt s VAL 129 Ca -0.13 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 1nqt s VAL 129 Cb -0.06 -1.35 -0.12 0.00 0.00 0.00 0.00 36.38 34.85 1nqt s VAL 129 CO 0.02 0.17 2.28 -0.54 0.00 0.00 0.00 175.10 177.04 1nqt s LYS 130 N 1.59 1.83 0.12 2.72 1.02 -0.62 -2.41 119.74 123.99 1nqt s LYS 130 Ca 0.01 0.24 -0.21 0.00 0.02 0.00 0.00 55.97 56.03 1nqt s LYS 130 Cb -0.15 -4.87 0.05 0.00 -0.52 0.00 0.00 37.83 32.35 1nqt s LYS 130 CO -0.08 -4.23 0.52 0.42 -0.92 0.00 0.00 175.35 171.06 1nqt s ILE 131 N 13.69 0.03 -0.49 2.17 1.09 -1.25 -4.54 121.20 131.90 1nqt s ILE 131 Ca 0.86 -0.24 0.03 0.00 -1.10 0.00 0.00 60.65 60.20 1nqt s ILE 131 Cb -0.11 -1.05 0.15 0.00 -1.06 0.00 0.00 42.46 40.39 1nqt s ILE 131 CO 0.06 -0.13 0.31 0.21 -0.10 0.00 0.00 174.94 175.29 1nqt s ASN 132 N -2.59 3.45 0.10 3.58 3.84 -1.26 -1.13 114.94 120.92 1nqt s ASN 132 Ca 0.00 -2.96 0.07 0.00 0.21 0.00 0.00 52.86 50.18 1nqt s ASN 132 Cb 0.00 -1.03 0.35 0.00 -0.55 0.00 0.00 41.25 40.02 1nqt s ASN 132 CO -0.10 -0.21 0.38 -2.65 -2.79 0.00 0.00 177.10 171.73 1nqt n PRO 133 N 3.09 -0.01 -0.20 0.43 -0.02 -1.26 0.11 135.00 137.13 1nqt n PRO 133 Ca 0.15 0.32 0.04 0.00 -2.02 0.00 0.00 63.50 61.99 1nqt n PRO 133 Cb 0.37 -0.61 0.31 0.00 -0.02 0.00 0.00 33.50 33.56 1nqt n PRO 133 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1nqt h LYS 134 N 0.00 0.83 0.00 -0.52 1.79 -1.96 -2.05 116.57 114.66 1nqt h LYS 134 Ca 0.21 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 1nqt h LYS 134 Cb 0.63 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1nqt h LYS 134 CO -0.15 0.55 0.00 0.09 -1.08 0.00 0.00 179.45 178.86 1nqt n ASN 135 N -4.46 0.00 -4.67 0.86 3.02 0.29 -4.85 115.26 105.45 1nqt n ASN 135 Ca 0.10 -0.55 -0.26 0.00 -0.03 0.00 0.00 54.58 53.84 1nqt n ASN 135 Cb 0.15 -0.12 -0.09 0.00 -0.61 0.00 0.00 39.78 39.11 1nqt n ASN 135 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1nqt s TYR 136 N -2.25 2.56 0.17 3.10 2.02 -0.77 -5.09 117.35 117.09 1nqt s TYR 136 Ca 0.35 -0.59 0.01 0.00 -0.37 0.00 0.00 57.07 56.47 1nqt s TYR 136 Cb 0.19 -1.80 -0.04 0.00 -0.40 0.00 0.00 41.96 39.91 1nqt s TYR 136 CO 0.37 0.34 0.33 0.95 -1.57 0.00 0.00 175.55 175.97 1nqt s THR 137 N -2.63 5.27 0.36 -0.71 -4.23 -1.26 -4.88 115.64 107.57 1nqt s THR 137 Ca 0.38 -0.52 0.15 0.00 -1.18 0.00 0.00 61.69 60.51 1nqt s THR 137 Cb 0.05 -3.73 0.36 0.00 1.34 0.00 0.00 72.50 70.52 1nqt s THR 137 CO 0.20 -0.12 1.75 0.44 -0.54 0.00 0.00 174.62 176.35 1nqt h ASP 138 N 2.13 0.54 0.38 3.99 3.32 -1.99 0.80 116.42 125.59 1nqt h ASP 138 Ca -0.48 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 1nqt h ASP 138 Cb 1.19 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1nqt h ASP 138 CO 0.69 0.09 -0.18 -1.13 -1.72 0.00 0.00 179.24 176.98 1nqt h ASN 139 N 0.47 -0.44 -0.33 6.45 -0.73 -2.00 -2.30 115.58 116.70 1nqt h ASN 139 Ca 0.62 -0.11 0.04 0.00 1.87 0.00 0.00 56.30 58.73 1nqt h ASN 139 Cb 1.42 0.11 -0.02 0.00 0.27 0.00 0.00 38.32 40.10 1nqt h ASN 139 CO -0.38 -0.13 0.22 -0.33 -0.37 0.00 0.00 177.43 176.45 1nqt h GLU 140 N -0.77 0.27 -0.30 6.67 5.08 -0.57 -1.00 114.58 123.97 1nqt h GLU 140 Ca -0.05 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1nqt h GLU 140 Cb 0.52 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1nqt h GLU 140 CO 0.09 0.18 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.16 1nqt h LEU 141 N 0.28 0.55 0.00 1.33 3.38 0.44 -2.56 115.31 118.73 1nqt h LEU 141 Ca 0.14 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1nqt h LEU 141 Cb 0.21 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1nqt h LEU 141 CO -0.03 0.76 0.00 1.21 0.09 0.00 0.00 178.44 180.48 1nqt n GLU 142 N -4.52 0.00 -0.14 1.13 2.13 -0.42 -1.07 120.64 117.74 1nqt n GLU 142 Ca -0.03 0.59 0.01 0.00 0.66 0.00 0.00 57.16 58.39 1nqt n GLU 142 Cb 0.29 -1.38 0.03 0.00 0.27 0.00 0.00 31.44 30.66 1nqt n GLU 142 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1nqt n LYS 143 N -2.01 -0.07 -0.11 5.31 5.02 -0.93 0.21 118.16 125.59 1nqt n LYS 143 Ca 0.00 0.58 -0.09 0.00 -2.02 0.00 0.00 58.31 56.78 1nqt n LYS 143 Cb 0.00 -0.86 -0.01 0.00 -0.02 0.00 0.00 35.03 34.14 1nqt n LYS 143 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1nqt h ILE 144 N 0.00 1.16 -0.11 -0.18 2.04 -0.96 -1.68 117.51 117.78 1nqt h ILE 144 Ca 0.15 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 1nqt h ILE 144 Cb 0.24 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1nqt h ILE 144 CO -0.38 0.17 -0.13 0.74 0.00 0.00 0.00 178.15 178.56 1nqt h THR 145 N 0.42 1.15 0.11 -0.27 2.02 0.41 -1.08 112.91 115.69 1nqt h THR 145 Ca 0.12 -0.69 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 1nqt h THR 145 Cb 0.12 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1nqt h THR 145 CO -0.02 0.21 -0.05 0.03 0.37 0.00 0.00 175.52 176.06 1nqt h ARG 146 N 0.16 -0.15 -0.33 6.66 3.08 -0.75 -2.04 114.38 121.01 1nqt h ARG 146 Ca 0.03 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.19 1nqt h ARG 146 Cb 0.33 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1nqt h ARG 146 CO 0.02 0.29 0.26 -0.09 -1.07 0.00 0.00 179.97 179.38 1nqt h ARG 147 N -0.93 0.00 0.17 0.04 9.65 -1.25 0.99 114.38 123.04 1nqt h ARG 147 Ca -0.02 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.86 1nqt h ARG 147 Cb 0.51 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1nqt h ARG 147 CO 0.03 0.00 -0.08 0.35 2.80 0.00 0.00 179.97 183.07 1nqt h PHE 148 N 0.00 -0.21 -0.98 2.20 3.57 -1.16 -2.99 116.94 117.37 1nqt h PHE 148 Ca 0.16 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.90 1nqt h PHE 148 Cb 0.67 0.07 -0.13 0.00 2.79 0.00 0.00 35.95 39.35 1nqt h PHE 148 CO 0.00 0.17 0.55 1.15 -2.23 0.00 0.00 178.31 177.94 1nqt h THR 149 N -0.63 0.49 0.50 4.41 2.02 -0.12 0.14 112.91 119.73 1nqt h THR 149 Ca -0.02 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1nqt h THR 149 Cb 0.46 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1nqt h THR 149 CO 0.04 0.09 -0.24 0.24 0.37 0.00 0.00 175.52 176.02 1nqt h MET 150 N 0.51 -0.65 -0.34 6.66 2.86 -1.08 0.01 114.93 122.90 1nqt h MET 150 Ca 0.64 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 58.35 1nqt h MET 150 Cb 1.24 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 33.03 1nqt h MET 150 CO -0.50 -0.43 0.23 0.93 1.06 0.00 0.00 176.91 178.19 1nqt h GLU 151 N -0.68 0.34 -0.53 1.72 4.39 -1.31 0.24 114.58 118.75 1nqt h GLU 151 Ca -0.07 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 1nqt h GLU 151 Cb 0.52 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1nqt h GLU 151 CO 0.11 0.23 -0.04 1.25 -1.16 0.00 0.00 179.01 179.40 1nqt h LEU 152 N 0.35 0.94 0.23 1.33 5.85 -0.67 -2.97 115.31 120.37 1nqt h LEU 152 Ca 0.14 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1nqt h LEU 152 Cb 0.11 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1nqt h LEU 152 CO -0.03 1.04 -0.11 0.00 -0.34 0.00 0.00 178.44 179.00 1nqt h ALA 153 N 0.93 -0.31 -0.34 1.25 0.00 0.11 0.51 119.26 121.42 1nqt h ALA 153 Ca 0.14 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.95 1nqt h ALA 153 Cb 0.58 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1nqt h ALA 153 CO 0.03 -0.45 0.44 0.87 0.00 0.00 0.00 179.25 180.15 1nqt h LYS 154 N -0.76 0.00 -0.16 0.00 1.57 -0.71 -1.36 116.57 115.15 1nqt h LYS 154 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1nqt h LYS 154 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1nqt h LYS 154 CO 0.05 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.56 1nqt n LYS 155 N -3.55 1.58 -1.47 3.15 4.76 -1.12 -4.99 118.16 116.53 1nqt n LYS 155 Ca 0.06 -1.61 0.00 0.00 -2.87 0.00 0.00 58.31 53.89 1nqt n LYS 155 Cb 0.60 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.51 1nqt n LYS 155 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nqt n GLY 156 N 0.72 0.74 0.00 0.72 0.00 -0.51 -4.97 105.19 101.88 1nqt n GLY 156 Ca 0.10 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1nqt n GLY 156 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nqt n PHE 157 N -1.17 0.00 -3.84 1.61 3.72 0.17 -4.85 117.46 113.10 1nqt n PHE 157 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 1nqt n PHE 157 Cb 0.32 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.71 1nqt n PHE 157 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1nqt s ILE 158 N -0.33 0.04 0.00 4.37 -1.16 -1.16 -4.54 121.20 118.41 1nqt s ILE 158 Ca 0.00 0.14 0.00 0.00 -0.51 0.00 0.00 60.65 60.28 1nqt s ILE 158 Cb 0.00 -0.14 0.00 0.00 0.61 0.00 0.00 42.46 42.93 1nqt s ILE 158 CO 0.00 0.10 0.00 0.61 -2.81 0.00 0.00 174.94 172.84 1nqt n GLY 159 N 4.02 2.31 0.11 1.50 0.00 -0.88 -4.46 105.19 107.79 1nqt n GLY 159 Ca -0.26 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 45.83 1nqt n GLY 159 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nqt n PRO 160 N -0.38 0.13 0.00 1.61 -0.04 -1.26 -1.70 135.00 133.35 1nqt n PRO 160 Ca 0.00 0.50 0.01 0.00 -0.04 0.00 0.00 63.50 63.97 1nqt n PRO 160 Cb 0.00 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 1nqt n PRO 160 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nqt n GLY 161 N -0.73 -0.44 0.34 0.55 0.00 -1.26 -4.87 105.19 98.78 1nqt n GLY 161 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 161 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nqt n ILE 162 N -0.38 0.25 -3.38 -0.61 5.41 -0.93 -3.56 119.36 116.16 1nqt n ILE 162 Ca 0.01 0.32 -0.12 0.00 1.00 0.00 0.00 62.75 63.96 1nqt n ILE 162 Cb 0.03 -1.47 -0.09 0.00 -0.71 0.00 0.00 39.64 37.39 1nqt n ILE 162 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1nqt s ASP 163 N -4.61 0.62 -0.59 4.38 -1.08 -0.69 0.24 116.67 114.93 1nqt s ASP 163 Ca -0.04 0.00 -0.16 0.00 -0.52 0.00 0.00 52.55 51.84 1nqt s ASP 163 Cb 0.00 0.90 0.14 0.00 -1.46 0.00 0.00 42.92 42.51 1nqt s ASP 163 CO 0.05 -0.32 0.55 -0.69 0.52 0.00 0.00 175.17 175.29 1nqt s VAL 164 N 2.48 5.27 0.00 1.11 1.01 0.35 -2.07 120.40 128.55 1nqt s VAL 164 Ca 0.11 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.44 1nqt s VAL 164 Cb -0.15 -4.37 0.00 0.00 0.00 0.00 0.00 36.38 31.86 1nqt s VAL 164 CO -0.17 -0.90 0.00 -2.65 0.00 0.00 0.00 175.10 171.37 1nqt n PRO 165 N 5.06 -0.13 0.00 2.72 -0.02 -1.22 -3.15 135.00 138.25 1nqt n PRO 165 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1nqt n PRO 165 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.89 1nqt n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nqt n ALA 166 N -1.64 0.00 -1.77 3.55 0.00 -1.10 -2.97 120.51 116.58 1nqt n ALA 166 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1nqt n ALA 166 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1nqt n ALA 166 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1nqt s PRO 167 N -2.00 3.76 0.51 0.00 0.02 -1.26 0.08 135.00 136.11 1nqt s PRO 167 Ca 0.00 1.69 0.01 0.00 0.02 0.00 0.00 61.00 62.72 1nqt s PRO 167 Cb 0.00 -2.35 0.01 0.00 0.02 0.00 0.00 34.50 32.18 1nqt s PRO 167 CO 0.00 -0.53 0.09 -3.47 -0.33 0.00 0.00 177.00 172.76 1nqt n ASP 168 N -0.57 3.24 0.00 2.53 -0.08 -1.18 -4.65 116.55 115.84 1nqt n ASP 168 Ca 0.08 -3.13 0.08 0.00 -1.51 0.00 0.00 54.79 50.31 1nqt n ASP 168 Cb 0.49 0.26 0.47 0.00 2.34 0.00 0.00 41.12 44.69 1nqt n ASP 168 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 1nqt n MET 169 N -1.37 0.50 -0.01 -0.67 0.00 -1.26 -1.54 117.12 112.77 1nqt n MET 169 Ca -0.17 0.00 0.08 0.00 -0.00 0.00 0.00 57.70 57.62 1nqt n MET 169 Cb 0.63 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 32.23 1nqt n MET 169 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1nqt n SER 170 N -1.00 1.12 -4.52 6.12 3.41 -1.26 -5.01 113.62 112.48 1nqt n SER 170 Ca 0.12 -0.20 -0.25 0.00 -0.26 0.00 0.00 58.87 58.28 1nqt n SER 170 Cb 0.06 1.58 -0.11 0.00 -0.26 0.00 0.00 64.21 65.48 1nqt n SER 170 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nqt s THR 171 N -3.00 1.99 0.34 6.66 -4.23 -0.59 -4.77 115.64 112.04 1nqt s THR 171 Ca -0.03 -2.15 0.05 0.00 -1.18 0.00 0.00 61.69 58.38 1nqt s THR 171 Cb 0.11 -2.64 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 1nqt s THR 171 CO 0.68 -0.19 0.35 0.61 -0.54 0.00 0.00 174.62 175.52 1nqt n GLY 172 N -0.75 2.66 0.24 3.99 0.00 -1.26 -4.10 105.19 105.97 1nqt n GLY 172 Ca -0.05 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1nqt n GLY 172 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nqt h GLU 173 N 0.00 0.04 -0.84 1.61 4.11 -1.96 -1.20 114.58 116.35 1nqt h GLU 173 Ca -0.25 -0.00 0.15 0.00 0.07 0.00 0.00 59.36 59.33 1nqt h GLU 173 Cb 1.22 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.31 1nqt h GLU 173 CO 0.36 0.03 -0.30 0.00 0.07 0.00 0.00 179.01 179.16 1nqt h ARG 174 N 0.05 -0.04 -0.10 1.06 3.08 -1.96 0.37 114.38 116.83 1nqt h ARG 174 Ca 0.32 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.37 1nqt h ARG 174 Cb 0.50 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 1nqt h ARG 174 CO -0.60 -0.03 0.05 0.93 -1.07 0.00 0.00 179.97 179.24 1nqt h GLU 175 N -0.04 0.14 -0.21 0.04 3.07 -1.65 -2.44 114.58 113.49 1nqt h GLU 175 Ca 0.35 -0.02 0.03 0.00 -0.50 0.00 0.00 59.36 59.22 1nqt h GLU 175 Cb 0.60 -0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 28.42 1nqt h GLU 175 CO -0.87 0.22 -0.54 0.52 -1.40 0.00 0.00 179.01 176.94 1nqt h MET 176 N 0.03 -0.50 -1.10 2.33 2.86 -0.39 0.53 114.93 118.69 1nqt h MET 176 Ca 0.03 0.03 0.30 0.00 -2.06 0.00 0.00 59.70 58.01 1nqt h MET 176 Cb 0.13 0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.83 1nqt h MET 176 CO -0.00 -0.33 0.75 1.03 1.06 0.00 0.00 176.91 179.41 1nqt h SER 177 N -0.52 0.21 -0.03 1.22 0.87 -0.19 0.45 113.55 115.55 1nqt h SER 177 Ca 0.04 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 1nqt h SER 177 Cb 0.64 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 1nqt h SER 177 CO -0.47 0.03 -0.16 -0.50 -0.53 0.00 0.00 176.83 175.20 1nqt h TRP 178 N 0.18 0.23 -0.49 2.24 6.55 -0.72 -1.57 115.95 122.37 1nqt h TRP 178 Ca 0.57 -0.10 0.10 0.00 0.95 0.00 0.00 58.89 60.41 1nqt h TRP 178 Cb 1.88 -0.04 -0.10 0.00 -0.86 0.00 0.00 29.16 30.05 1nqt h TRP 178 CO -0.00 0.80 -0.18 0.82 -1.05 0.00 0.00 178.44 178.83 1nqt h ILE 179 N -0.41 0.40 0.29 1.49 2.04 0.19 0.71 117.51 122.23 1nqt h ILE 179 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1nqt h ILE 179 Cb 0.82 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1nqt h ILE 179 CO 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 178.15 177.84 1nqt h ALA 180 N 1.34 -0.99 -0.14 1.87 0.00 -0.89 -1.95 119.26 118.50 1nqt h ALA 180 Ca 0.24 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1nqt h ALA 180 Cb 0.43 0.61 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 1nqt h ALA 180 CO -0.55 -1.02 -0.47 0.22 0.00 0.00 0.00 179.25 177.43 1nqt h ASP 181 N -0.64 -1.48 -0.98 0.00 1.82 -0.41 0.37 116.42 115.10 1nqt h ASP 181 Ca -0.04 0.19 0.26 0.00 -0.39 0.00 0.00 57.03 57.05 1nqt h ASP 181 Cb 0.57 0.59 -0.06 0.00 0.68 0.00 0.00 39.33 41.11 1nqt h ASP 181 CO -0.07 -0.45 0.67 0.74 -1.61 0.00 0.00 179.24 178.52 1nqt h THR 182 N -0.53 0.56 0.42 2.25 2.02 0.42 0.40 112.91 118.45 1nqt h THR 182 Ca 0.06 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 1nqt h THR 182 Cb 0.65 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1nqt h THR 182 CO -0.42 0.04 -0.20 0.22 0.37 0.00 0.00 175.52 175.53 1nqt h TYR 183 N 0.22 -0.52 0.00 3.16 3.20 -0.22 -3.05 116.97 119.77 1nqt h TYR 183 Ca 0.51 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.36 1nqt h TYR 183 Cb 1.58 0.17 0.00 0.00 1.54 0.00 0.00 36.73 40.03 1nqt h TYR 183 CO -0.00 -0.32 0.00 0.00 -1.64 0.00 0.00 178.16 176.20 1nqt n ALA 184 N -2.60 1.14 0.58 1.82 0.00 -0.07 -0.82 120.51 120.55 1nqt n ALA 184 Ca -0.07 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.44 1nqt n ALA 184 Cb 0.22 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 18.73 1nqt n ALA 184 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nqt n SER 185 N -1.36 2.18 0.00 0.00 7.64 0.05 -3.93 113.62 118.19 1nqt n SER 185 Ca 0.00 -1.59 0.00 0.00 1.01 0.00 0.00 58.87 58.29 1nqt n SER 185 Cb 0.00 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1nqt n SER 185 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1nqt n THR 186 N 0.79 0.00 -0.23 0.44 -1.04 -0.00 -4.84 114.28 109.41 1nqt n THR 186 Ca 0.08 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 62.07 1nqt n THR 186 Cb 0.35 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.91 1nqt n THR 186 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1nqt h ILE 187 N 0.00 0.23 -0.00 12.58 1.08 -1.80 0.57 117.51 130.18 1nqt h ILE 187 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1nqt h ILE 187 Cb 0.00 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 33.98 1nqt h ILE 187 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.07 1nqt n GLY 188 N -1.46 -0.25 0.33 5.37 0.00 -0.69 -4.43 105.19 104.06 1nqt n GLY 188 Ca 0.07 -0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.29 1nqt n GLY 188 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1nqt h HIS 189 N 0.00 0.42 -0.01 1.61 6.17 -0.98 -0.10 115.15 122.26 1nqt h HIS 189 Ca 0.00 0.05 0.00 0.00 0.71 0.00 0.00 60.37 61.13 1nqt h HIS 189 Cb 0.15 -0.03 0.00 0.00 2.52 0.00 0.00 27.41 30.05 1nqt h HIS 189 CO 0.00 -0.36 -0.31 0.66 0.71 0.00 0.00 177.93 178.63 1nqt n TYR 190 N -5.31 0.00 -2.60 5.26 4.02 -1.26 -4.89 117.16 112.39 1nqt n TYR 190 Ca 0.28 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.75 1nqt n TYR 190 Cb 0.92 -0.10 -0.03 0.00 -0.02 0.00 0.00 39.34 40.12 1nqt n TYR 190 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1nqt s ASP 191 N -2.51 7.17 0.00 7.72 3.68 -0.05 -4.87 116.67 127.81 1nqt s ASP 191 Ca 0.23 1.64 0.00 0.00 2.13 0.00 0.00 52.55 56.54 1nqt s ASP 191 Cb 0.19 -2.56 0.00 0.00 -1.45 0.00 0.00 42.92 39.10 1nqt s ASP 191 CO 0.54 -0.51 0.67 0.00 0.13 0.00 0.00 175.17 176.00 1nqt n ILE 192 N 4.60 0.00 -2.21 4.11 3.06 -1.26 -2.32 119.36 125.34 1nqt n ILE 192 Ca 0.10 0.00 0.03 0.00 -2.50 0.00 0.00 62.75 60.38 1nqt n ILE 192 Cb 0.48 -0.18 0.03 0.00 0.54 0.00 0.00 39.64 40.51 1nqt n ILE 192 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1nqt n ASN 193 N -0.37 0.81 -0.33 9.51 3.02 -1.26 -4.89 115.26 121.75 1nqt n ASN 193 Ca 0.00 -2.21 0.08 0.00 -0.03 0.00 0.00 54.58 52.42 1nqt n ASN 193 Cb 0.04 -0.29 0.24 0.00 -0.61 0.00 0.00 39.78 39.16 1nqt n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nqt h ALA 194 N 0.65 1.43 0.00 5.41 0.00 -1.73 0.17 119.26 125.18 1nqt h ALA 194 Ca -0.13 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1nqt h ALA 194 Cb 1.63 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1nqt h ALA 194 CO 0.06 0.06 0.00 0.72 0.00 0.00 0.00 179.25 180.09 1nqt n HIS 195 N -4.74 0.00 -0.10 0.00 8.25 -1.26 -0.67 115.22 116.70 1nqt n HIS 195 Ca 0.19 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.77 1nqt n HIS 195 Cb 0.41 0.00 0.28 0.00 1.12 0.00 0.00 29.99 31.81 1nqt n HIS 195 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nqt n ALA 196 N -0.77 2.40 0.29 -1.41 0.00 0.58 -4.24 120.51 117.35 1nqt n ALA 196 Ca 0.06 -1.18 0.16 0.00 0.00 0.00 0.00 53.44 52.48 1nqt n ALA 196 Cb 0.03 -0.92 0.57 0.00 0.00 0.00 0.00 19.45 19.13 1nqt n ALA 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nqt s VAL 198 N -3.54 0.02 0.52 0.00 0.11 -1.26 -3.46 120.40 112.79 1nqt s VAL 198 Ca 0.03 -0.20 0.06 0.00 -2.93 0.00 0.00 61.98 58.94 1nqt s VAL 198 Cb 0.08 -0.63 0.03 0.00 -1.53 0.00 0.00 36.38 34.33 1nqt s VAL 198 CO 0.55 -0.11 0.40 0.42 -3.33 0.00 0.00 175.10 173.03 1nqt s THR 199 N -0.56 1.86 0.00 5.04 -4.23 -1.16 -4.63 115.64 111.96 1nqt s THR 199 Ca -0.07 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1nqt s THR 199 Cb -0.04 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1nqt s THR 199 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1nqt n GLY 200 N -1.71 0.76 3.85 3.99 0.00 -1.26 -4.34 105.19 106.48 1nqt n GLY 200 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1nqt n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nqt s LYS 201 N -0.34 1.66 0.94 1.61 -2.85 -1.26 -4.33 119.74 115.17 1nqt s LYS 201 Ca 0.00 0.21 -0.11 0.00 -1.00 0.00 0.00 55.97 55.07 1nqt s LYS 201 Cb 0.00 -1.91 0.14 0.00 -2.06 0.00 0.00 37.83 34.00 1nqt s LYS 201 CO 0.00 -1.82 1.02 -2.30 0.10 0.00 0.00 175.35 172.35 1nqt n PRO 202 N -3.49 -0.52 0.12 1.78 -0.02 -1.26 -3.68 135.00 127.93 1nqt n PRO 202 Ca 0.07 -0.09 -0.02 0.00 -2.02 0.00 0.00 63.50 61.44 1nqt n PRO 202 Cb 0.60 -2.29 0.15 0.00 -0.02 0.00 0.00 33.50 31.94 1nqt n PRO 202 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1nqt h ILE 203 N -1.89 1.44 -0.02 4.25 1.08 -1.92 1.87 117.51 122.32 1nqt h ILE 203 Ca -0.44 -2.13 -0.10 0.00 -0.39 0.00 0.00 64.86 61.80 1nqt h ILE 203 Cb 1.27 2.14 -0.01 0.00 -3.07 0.00 0.00 36.82 37.15 1nqt h ILE 203 CO 0.40 0.61 -0.44 0.77 -0.69 0.00 0.00 178.15 178.81 1nqt h SER 204 N 0.04 0.05 -0.50 1.72 4.64 -1.91 -2.98 113.55 114.60 1nqt h SER 204 Ca -0.01 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1nqt h SER 204 Cb 1.12 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1nqt h SER 204 CO 0.09 0.49 0.04 0.00 -0.87 0.00 0.00 176.83 176.57 1nqt n GLN 205 N -4.01 4.10 -0.03 4.77 1.13 -1.03 -4.93 117.38 117.37 1nqt n GLN 205 Ca -0.02 -3.07 0.00 0.00 -1.94 0.00 0.00 57.00 51.97 1nqt n GLN 205 Cb 0.47 -2.13 0.00 0.00 0.11 0.00 0.00 30.24 28.69 1nqt n GLN 205 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nqt n GLY 206 N 0.13 1.25 3.83 1.08 0.00 -0.95 -4.79 105.19 105.75 1nqt n GLY 206 Ca 0.28 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 206 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nqt s GLY 207 N -2.03 1.60 0.05 -0.02 0.00 0.63 -4.77 107.32 102.78 1nqt s GLY 207 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 44.72 44.14 1nqt s GLY 207 CO 0.00 -0.08 -0.16 -1.50 0.00 0.00 0.00 173.10 171.37 1nqt s ILE 208 N -3.42 2.97 0.29 0.90 2.07 -1.26 -4.63 121.20 118.13 1nqt s ILE 208 Ca 0.64 -1.16 -0.29 0.00 -1.41 0.00 0.00 60.65 58.44 1nqt s ILE 208 Cb -0.12 -2.28 -0.10 0.00 0.13 0.00 0.00 42.46 40.09 1nqt s ILE 208 CO 0.52 0.31 1.14 -1.00 -1.91 0.00 0.00 174.94 174.00 1nqt s HIS 209 N -0.98 3.46 0.00 3.50 3.76 -1.26 -3.79 115.29 119.98 1nqt s HIS 209 Ca 0.16 1.64 0.00 0.00 -0.15 0.00 0.00 55.06 56.71 1nqt s HIS 209 Cb -0.11 -3.36 0.00 0.00 1.11 0.00 0.00 32.58 30.23 1nqt s HIS 209 CO 0.07 -0.81 0.00 0.41 -0.85 0.00 0.00 174.74 173.56 1nqt n GLY 210 N 1.09 0.89 0.14 -2.22 0.00 -1.26 -4.31 105.19 99.52 1nqt n GLY 210 Ca -0.01 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 1nqt n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nqt h ARG 211 N 0.00 0.29 -0.00 1.61 2.43 -2.00 -3.29 114.38 113.42 1nqt h ARG 211 Ca 0.00 -0.50 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1nqt h ARG 211 Cb 0.80 0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1nqt h ARG 211 CO 0.00 1.21 -0.00 -0.84 -1.51 0.00 0.00 179.97 178.83 1nqt h ILE 212 N 0.08 1.25 -0.01 1.20 3.07 -1.94 -3.04 117.51 118.12 1nqt h ILE 212 Ca -0.39 -0.75 -0.08 0.00 1.55 0.00 0.00 64.86 65.20 1nqt h ILE 212 Cb 2.05 1.76 -0.01 0.00 -0.27 0.00 0.00 36.82 40.35 1nqt h ILE 212 CO 0.12 0.19 -0.35 0.28 -1.05 0.00 0.00 178.15 177.34 1nqt h SER 213 N -0.31 0.02 0.00 2.16 0.02 -2.00 -3.38 113.55 110.06 1nqt h SER 213 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1nqt h SER 213 Cb 0.32 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1nqt h SER 213 CO 0.00 0.37 0.00 0.00 -1.14 0.00 0.00 176.83 176.06 1nqt n ALA 214 N -2.47 0.00 -0.17 3.77 0.00 -1.15 -0.27 120.51 120.22 1nqt n ALA 214 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 1nqt n ALA 214 Cb 0.39 0.14 0.07 0.00 0.00 0.00 0.00 19.45 20.06 1nqt n ALA 214 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1nqt h THR 215 N 0.00 0.66 -0.33 0.00 2.02 -1.76 -0.42 112.91 113.07 1nqt h THR 215 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1nqt h THR 215 Cb 0.00 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1nqt h THR 215 CO 0.00 0.03 0.21 1.23 0.37 0.00 0.00 175.52 177.37 1nqt h GLY 216 N 0.19 0.47 2.00 2.16 0.00 -1.36 0.72 103.07 107.25 1nqt h GLY 216 Ca 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1nqt h GLY 216 CO -0.38 0.18 0.00 0.54 0.00 0.00 0.00 176.54 176.88 1nqt n ARG 217 N -4.84 0.09 0.02 4.80 1.74 0.63 -1.93 116.66 117.16 1nqt n ARG 217 Ca -0.01 0.27 -0.01 0.00 -0.77 0.00 0.00 57.85 57.33 1nqt n ARG 217 Cb 0.03 -1.65 -0.00 0.00 -1.02 0.00 0.00 32.46 29.82 1nqt n ARG 217 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1nqt h GLY 218 N 2.99 -0.06 -0.82 -0.13 0.00 0.25 -3.02 103.07 102.29 1nqt h GLY 218 Ca 0.00 0.02 0.31 0.00 0.00 0.00 0.00 47.33 47.66 1nqt h GLY 218 CO 0.00 -0.02 0.31 -0.62 0.00 0.00 0.00 176.54 176.20 1nqt n VAL 219 N -2.49 -0.34 0.01 4.60 0.31 0.12 -0.43 118.33 120.10 1nqt n VAL 219 Ca -0.01 1.71 -0.12 0.00 -0.01 0.00 0.00 64.34 65.91 1nqt n VAL 219 Cb 0.02 -2.68 -0.06 0.00 -0.91 0.00 0.00 33.84 30.21 1nqt n VAL 219 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1nqt h PHE 220 N 0.00 0.07 -0.28 3.52 3.04 -1.44 -2.43 116.94 119.42 1nqt h PHE 220 Ca 0.63 -0.00 -0.08 0.00 3.98 0.00 0.00 57.97 62.51 1nqt h PHE 220 Cb 1.58 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 40.06 1nqt h PHE 220 CO -0.14 0.09 -0.12 0.45 -2.02 0.00 0.00 178.31 176.57 1nqt h HIS 221 N 0.02 0.65 -0.75 0.41 3.86 -0.61 0.25 115.15 118.98 1nqt h HIS 221 Ca 0.02 -0.16 0.07 0.00 -1.16 0.00 0.00 60.37 59.14 1nqt h HIS 221 Cb 0.05 -0.15 -0.09 0.00 1.06 0.00 0.00 27.41 28.27 1nqt h HIS 221 CO -0.06 0.81 -0.45 0.41 0.86 0.00 0.00 177.93 179.50 1nqt n GLY 222 N -0.06 -2.61 0.00 2.45 0.00 -0.49 0.94 105.19 105.42 1nqt n GLY 222 Ca -0.04 1.02 0.00 0.00 0.00 0.00 0.00 46.02 47.01 1nqt n GLY 222 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nqt n ILE 223 N -4.72 0.00 -0.17 -0.61 5.41 -0.93 -2.84 119.36 115.50 1nqt n ILE 223 Ca 0.02 1.27 0.16 0.00 1.00 0.00 0.00 62.75 65.20 1nqt n ILE 223 Cb 0.20 -2.11 0.28 0.00 -0.71 0.00 0.00 39.64 37.30 1nqt n ILE 223 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1nqt n GLU 224 N -1.58 -0.02 0.12 0.38 2.13 0.07 0.65 120.64 122.39 1nqt n GLU 224 Ca 0.00 0.60 -0.02 0.00 0.66 0.00 0.00 57.16 58.40 1nqt n GLU 224 Cb 0.00 -1.11 0.09 0.00 0.27 0.00 0.00 31.44 30.69 1nqt n GLU 224 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1nqt h ASN 225 N 0.00 0.00 0.03 4.31 2.35 0.72 -3.28 115.58 119.71 1nqt h ASN 225 Ca 0.39 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.91 1nqt h ASN 225 Cb 1.10 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.45 1nqt h ASN 225 CO -0.30 0.71 -1.22 -0.26 -1.65 0.00 0.00 177.43 174.71 1nqt h PHE 226 N 0.00 0.11 0.00 1.19 -1.00 0.22 -3.36 116.94 114.10 1nqt h PHE 226 Ca -0.01 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1nqt h PHE 226 Cb 1.30 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.85 1nqt h PHE 226 CO 0.00 1.48 0.00 1.51 -1.61 0.00 0.00 178.31 179.69 1nqt n ILE 227 N -4.29 0.09 -0.89 -0.55 3.06 -0.52 0.37 119.36 116.64 1nqt n ILE 227 Ca -0.29 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 59.96 1nqt n ILE 227 Cb 0.73 -0.31 0.00 0.00 0.54 0.00 0.00 39.64 40.60 1nqt n ILE 227 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1nqt n ASN 228 N 0.45 0.21 -4.23 9.51 4.13 -1.24 -4.85 115.26 119.24 1nqt n ASN 228 Ca 0.00 -1.10 -0.42 0.00 1.68 0.00 0.00 54.58 54.74 1nqt n ASN 228 Cb 0.11 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.31 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1nqt s GLU 229 N -0.10 3.38 0.00 3.52 2.56 0.16 -4.97 118.70 123.26 1nqt s GLU 229 Ca 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 54.97 52.19 1nqt s GLU 229 Cb 0.00 -4.18 0.00 0.00 2.00 0.00 0.00 34.13 31.95 1nqt s GLU 229 CO 0.00 -1.25 0.00 0.00 -0.56 0.00 0.00 175.26 173.45 1nqt n ALA 230 N 3.29 0.00 -0.02 6.30 0.00 -1.26 -0.52 120.51 128.30 1nqt n ALA 230 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.59 1nqt n ALA 230 Cb 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.86 1nqt n ALA 230 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nqt n SER 231 N -1.37 -0.04 0.08 0.00 7.64 -1.26 0.91 113.62 119.58 1nqt n SER 231 Ca 0.00 0.70 0.07 0.00 1.01 0.00 0.00 58.87 60.65 1nqt n SER 231 Cb 0.00 -0.32 0.52 0.00 -1.01 0.00 0.00 64.21 63.39 1nqt n SER 231 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1nqt h TYR 232 N 0.00 0.31 0.00 1.43 -1.99 -1.13 -1.43 116.97 114.16 1nqt h TYR 232 Ca 0.01 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1nqt h TYR 232 Cb 0.01 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 38.64 1nqt h TYR 232 CO -0.63 0.19 0.00 0.52 -0.00 0.00 0.00 178.16 178.24 1nqt h MET 233 N 0.33 0.00 0.11 4.88 2.86 0.15 -3.20 114.93 120.06 1nqt h MET 233 Ca 0.12 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1nqt h MET 233 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1nqt h MET 233 CO -0.03 0.00 -0.05 0.66 1.06 0.00 0.00 176.91 178.55 1nqt h SER 234 N 0.00 -0.12 0.00 1.22 4.64 0.88 0.58 113.55 120.75 1nqt h SER 234 Ca 0.00 -0.42 -0.02 0.00 -0.47 0.00 0.00 61.79 60.89 1nqt h SER 234 Cb 0.78 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1nqt h SER 234 CO 0.00 0.50 0.18 -0.38 -0.87 0.00 0.00 176.83 176.26 1nqt n ILE 235 N -4.85 0.45 0.00 0.95 2.08 -1.09 0.36 119.36 117.26 1nqt n ILE 235 Ca -0.07 -0.18 0.00 0.00 0.56 0.00 0.00 62.75 63.06 1nqt n ILE 235 Cb 0.26 -1.35 0.00 0.00 -0.75 0.00 0.00 39.64 37.80 1nqt n ILE 235 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1nqt n LEU 236 N 2.43 0.00 0.00 1.39 4.77 -1.20 -4.96 117.00 119.42 1nqt n LEU 236 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1nqt n LEU 236 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1nqt n LEU 236 CO 0.12 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1nqt n GLY 237 N -0.35 0.74 0.00 -0.72 0.00 1.12 -5.06 105.19 100.92 1nqt n GLY 237 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nqt n GLY 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nqt n MET 238 N -2.34 3.53 -3.83 1.61 2.81 0.17 -4.75 117.12 114.33 1nqt n MET 238 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 1nqt n MET 238 Cb 0.00 0.00 0.01 0.00 -0.71 0.00 0.00 33.22 32.52 1nqt n MET 238 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1nqt n THR 239 N 0.00 -3.97 -0.38 2.03 5.66 -1.26 -4.81 114.28 111.55 1nqt n THR 239 Ca 0.00 -0.58 -0.23 0.00 -3.05 0.00 0.00 64.05 60.19 1nqt n THR 239 Cb 0.00 -3.28 0.22 0.00 -1.55 0.00 0.00 70.33 65.72 1nqt n THR 239 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1nqt n PRO 240 N -4.32 -3.51 -1.06 1.09 -0.02 -1.26 -5.05 135.00 120.86 1nqt n PRO 240 Ca -0.27 -1.04 -0.01 0.00 -2.02 0.00 0.00 63.50 60.16 1nqt n PRO 240 Cb 0.67 -1.68 -0.02 0.00 -0.02 0.00 0.00 33.50 32.45 1nqt n PRO 240 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nqt n GLY 241 N 2.19 0.76 1.59 -1.23 0.00 -1.26 -4.66 105.19 102.57 1nqt n GLY 241 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1nqt n GLY 241 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nqt n PHE 242 N 0.20 -0.63 -0.02 1.61 3.01 -1.26 -4.91 117.46 115.46 1nqt n PHE 242 Ca -0.07 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.48 1nqt n PHE 242 Cb 0.85 0.40 -0.17 0.00 -0.01 0.00 0.00 39.48 40.55 1nqt n PHE 242 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nqt n GLY 243 N 0.55 -0.99 5.40 1.37 0.00 -1.26 -5.01 105.19 105.24 1nqt n GLY 243 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1nqt n GLY 243 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nqt n ASP 244 N -2.29 0.00 -3.58 1.61 -0.08 -1.26 -4.61 116.55 106.34 1nqt n ASP 244 Ca -0.06 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.06 1nqt n ASP 244 Cb 0.61 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 44.00 1nqt n ASP 244 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1nqt s LYS 245 N 0.00 0.94 -0.13 -0.67 1.02 -1.26 -4.15 119.74 115.48 1nqt s LYS 245 Ca 0.00 0.43 -0.04 0.00 0.02 0.00 0.00 55.97 56.38 1nqt s LYS 245 Cb 0.00 0.45 0.07 0.00 -0.52 0.00 0.00 37.83 37.82 1nqt s LYS 245 CO 0.00 -0.24 0.21 0.99 -0.92 0.00 0.00 175.35 175.38 1nqt s THR 246 N -0.73 -0.32 0.41 2.17 2.01 -1.26 -1.87 115.64 116.05 1nqt s THR 246 Ca -0.08 0.18 0.07 0.00 0.31 0.00 0.00 61.69 62.18 1nqt s THR 246 Cb -0.02 -0.46 -0.07 0.00 0.01 0.00 0.00 72.50 71.96 1nqt s THR 246 CO 0.07 0.03 0.06 0.72 -0.69 0.00 0.00 174.62 174.80 1nqt s PHE 247 N 2.34 2.55 0.04 4.92 -0.71 -0.44 0.13 117.98 126.80 1nqt s PHE 247 Ca 0.04 -0.64 0.00 0.00 -1.04 0.00 0.00 56.93 55.29 1nqt s PHE 247 Cb -0.13 -1.83 -0.03 0.00 -1.21 0.00 0.00 43.02 39.83 1nqt s PHE 247 CO -0.08 0.37 -0.04 0.08 -1.34 0.00 0.00 175.22 174.20 1nqt s VAL 248 N -2.67 0.29 0.00 -2.49 1.01 -0.27 -0.37 120.40 115.90 1nqt s VAL 248 Ca 0.37 -1.25 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1nqt s VAL 248 Cb 0.08 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1nqt s VAL 248 CO 0.19 -0.62 -0.06 0.68 0.00 0.00 0.00 175.10 175.29 1nqt s VAL 249 N -2.21 0.45 -0.45 2.92 -7.23 -0.86 -0.70 120.40 112.32 1nqt s VAL 249 Ca -0.07 -0.38 0.04 0.00 -1.81 0.00 0.00 61.98 59.76 1nqt s VAL 249 Cb -0.04 -0.41 0.12 0.00 0.56 0.00 0.00 36.38 36.61 1nqt s VAL 249 CO -0.03 0.03 0.19 -1.58 -0.31 0.00 0.00 175.10 173.39 1nqt s GLN 250 N -0.39 1.75 0.00 4.82 -0.44 -0.44 -2.52 119.66 122.44 1nqt s GLN 250 Ca -0.00 -2.32 0.00 0.00 -2.50 0.00 0.00 55.36 50.54 1nqt s GLN 250 Cb -0.03 -3.21 0.00 0.00 -1.64 0.00 0.00 33.01 28.12 1nqt s GLN 250 CO -0.00 -1.05 0.00 0.41 0.50 0.00 0.00 175.29 175.15 1nqt n GLY 251 N 3.54 1.94 3.45 2.59 0.00 -1.26 -1.76 105.19 113.69 1nqt n GLY 251 Ca 0.05 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.19 1nqt n GLY 251 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nqt s PHE 252 N 0.00 3.08 -0.29 1.61 5.99 -1.26 -3.71 117.98 123.39 1nqt s PHE 252 Ca 0.00 -1.33 0.05 0.00 0.00 0.00 0.00 56.93 55.64 1nqt s PHE 252 Cb 0.00 -4.30 0.20 0.00 0.00 0.00 0.00 43.02 38.92 1nqt s PHE 252 CO 0.00 -1.51 0.61 0.20 -0.00 0.00 0.00 175.22 174.52 1nqt s GLY 253 N 3.69 -1.24 0.00 13.12 0.00 -1.26 -4.90 107.32 116.73 1nqt s GLY 253 Ca 0.33 1.15 0.00 0.00 0.00 0.00 0.00 44.72 46.19 1nqt s GLY 253 CO -0.09 3.70 0.00 -2.01 0.00 0.00 0.00 173.10 174.70 1nqt n ASN 254 N 5.41 0.00 -0.29 1.64 5.15 -1.26 -2.77 115.26 123.14 1nqt n ASN 254 Ca 0.05 0.00 0.28 0.00 -0.60 0.00 0.00 54.58 54.31 1nqt n ASN 254 Cb 0.54 0.00 0.64 0.00 -0.53 0.00 0.00 39.78 40.43 1nqt n ASN 254 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1nqt h VAL 255 N 0.00 0.50 -0.04 3.44 3.04 -1.91 0.23 116.25 121.51 1nqt h VAL 255 Ca 0.00 -0.06 -0.17 0.00 -1.01 0.00 0.00 66.70 65.46 1nqt h VAL 255 Cb 0.00 0.31 0.01 0.00 -2.01 0.00 0.00 31.29 29.60 1nqt h VAL 255 CO 0.00 0.03 -0.63 1.23 -1.01 0.00 0.00 177.57 177.19 1nqt h GLY 256 N 0.17 0.56 0.60 3.17 0.00 -1.60 -2.72 103.07 103.25 1nqt h GLY 256 Ca 0.54 -0.90 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 1nqt h GLY 256 CO -0.12 0.80 -0.39 -2.00 0.00 0.00 0.00 176.54 174.82 1nqt h LEU 257 N 0.06 -0.99 -2.13 3.11 5.85 -1.18 -1.04 115.31 118.99 1nqt h LEU 257 Ca -0.07 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.78 1nqt h LEU 257 Cb 1.31 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.63 1nqt h LEU 257 CO 0.13 -0.59 0.20 0.45 -0.34 0.00 0.00 178.44 178.29 1nqt h HIS 258 N -0.93 0.00 -0.40 1.25 3.86 -1.52 0.37 115.15 117.78 1nqt h HIS 258 Ca -0.08 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.02 1nqt h HIS 258 Cb 0.75 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 1nqt h HIS 258 CO -0.08 0.00 -0.18 0.77 0.86 0.00 0.00 177.93 179.30 1nqt h SER 259 N 0.00 0.85 -0.18 2.45 0.02 -1.07 -1.48 113.55 114.14 1nqt h SER 259 Ca 0.11 -0.40 -0.02 0.00 -0.84 0.00 0.00 61.79 60.64 1nqt h SER 259 Cb 0.52 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1nqt h SER 259 CO -0.00 1.06 0.05 -0.03 -1.14 0.00 0.00 176.83 176.77 1nqt h MET 260 N 0.63 0.28 0.00 3.45 1.85 0.71 -0.19 114.93 121.66 1nqt h MET 260 Ca 0.09 -0.07 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1nqt h MET 260 Cb 0.74 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.73 1nqt h MET 260 CO 0.06 0.41 0.00 0.54 -0.40 0.00 0.00 176.91 177.52 1nqt n ARG 261 N -4.80 0.00 0.05 0.39 5.12 0.97 -0.30 116.66 118.09 1nqt n ARG 261 Ca -0.04 0.63 0.07 0.00 -1.93 0.00 0.00 57.85 56.58 1nqt n ARG 261 Cb 0.16 -1.26 0.51 0.00 -1.16 0.00 0.00 32.46 30.71 1nqt n ARG 261 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1nqt h TYR 262 N 0.00 0.34 -0.18 -1.55 0.05 -1.30 0.10 116.97 114.43 1nqt h TYR 262 Ca 0.00 0.01 -0.20 0.00 0.05 0.00 0.00 58.73 58.59 1nqt h TYR 262 Cb 0.00 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 37.63 1nqt h TYR 262 CO -0.33 0.20 -0.69 1.25 -1.05 0.00 0.00 178.16 177.54 1nqt h LEU 263 N 0.35 0.85 0.73 3.88 5.85 -0.84 -3.21 115.31 122.91 1nqt h LEU 263 Ca 0.14 -0.52 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 1nqt h LEU 263 Cb 0.12 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 40.91 1nqt h LEU 263 CO -0.03 1.30 -0.35 -0.74 -0.34 0.00 0.00 178.44 178.28 1nqt h HIS 264 N 0.52 -0.90 -1.16 1.25 2.76 0.77 -2.90 115.15 115.49 1nqt h HIS 264 Ca -0.03 -0.02 0.39 0.00 -2.20 0.00 0.00 60.37 58.51 1nqt h HIS 264 Cb 1.29 0.30 -0.10 0.00 1.55 0.00 0.00 27.41 30.45 1nqt h HIS 264 CO 0.07 -0.54 0.76 -2.13 -1.30 0.00 0.00 177.93 174.79 1nqt n ARG 265 N -5.44 -0.02 -1.32 5.26 0.63 0.22 -0.59 116.66 115.38 1nqt n ARG 265 Ca -0.13 0.98 -0.34 0.00 -0.92 0.00 0.00 57.85 57.44 1nqt n ARG 265 Cb 0.40 -1.97 0.09 0.00 0.45 0.00 0.00 32.46 31.43 1nqt n ARG 265 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1nqt n PHE 266 N -4.17 3.21 0.00 -0.14 3.72 -1.10 -4.95 117.46 114.03 1nqt n PHE 266 Ca 0.33 -2.89 0.00 0.00 -0.05 0.00 0.00 57.45 54.84 1nqt n PHE 266 Cb 1.30 -1.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.45 1nqt n PHE 266 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nqt n GLY 267 N -0.95 2.77 3.28 1.37 0.00 0.24 -5.05 105.19 106.85 1nqt n GLY 267 Ca 0.62 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1nqt n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 268 N 0.00 -2.86 -4.03 4.61 0.00 -1.23 -4.82 120.51 112.19 1nqt n ALA 268 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 1nqt n ALA 268 Cb 0.00 -1.46 -0.16 0.00 0.00 0.00 0.00 19.45 17.83 1nqt n ALA 268 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nqt s LYS 269 N -1.10 3.01 0.33 0.00 -0.14 -0.78 -4.38 119.74 116.69 1nqt s LYS 269 Ca 0.58 -0.82 -0.28 0.00 -1.36 0.00 0.00 55.97 54.09 1nqt s LYS 269 Cb -0.52 -2.57 -0.10 0.00 -1.68 0.00 0.00 37.83 32.96 1nqt s LYS 269 CO 0.64 -0.18 1.27 0.00 -0.76 0.00 0.00 175.35 176.33 1nqt n ILE 271 N 0.76 0.11 -3.84 0.00 3.06 0.50 -2.49 119.36 117.47 1nqt n ILE 271 Ca 0.00 -0.04 -0.13 0.00 -2.50 0.00 0.00 62.75 60.09 1nqt n ILE 271 Cb 0.42 -0.98 -0.14 0.00 0.54 0.00 0.00 39.64 39.48 1nqt n ILE 271 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1nqt s ALA 272 N -2.04 -0.04 -0.05 1.51 0.00 -1.25 -2.42 121.76 117.47 1nqt s ALA 272 Ca -0.03 0.15 0.05 0.00 0.00 0.00 0.00 51.96 52.12 1nqt s ALA 272 Cb 0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 1nqt s ALA 272 CO 0.04 -0.04 -0.19 0.08 0.00 0.00 0.00 175.76 175.65 1nqt s VAL 273 N 0.29 1.57 0.00 0.00 1.01 -1.19 -2.02 120.40 120.05 1nqt s VAL 273 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1nqt s VAL 273 Cb -0.03 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.00 1nqt s VAL 273 CO -0.01 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1nqt n GLY 274 N 3.16 0.48 0.00 4.51 0.00 -1.05 -0.37 105.19 111.93 1nqt n GLY 274 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1nqt n GLY 274 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nqt n GLU 275 N 0.00 -0.42 -0.15 1.61 -0.58 -1.23 -4.35 120.64 115.52 1nqt n GLU 275 Ca 0.00 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.79 1nqt n GLU 275 Cb 0.00 0.00 0.12 0.00 -0.57 0.00 0.00 31.44 30.99 1nqt n GLU 275 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1nqt n SER 276 N 1.18 2.72 0.00 1.62 3.41 -1.26 -4.55 113.62 116.74 1nqt n SER 276 Ca 0.00 -2.27 0.00 0.00 -0.26 0.00 0.00 58.87 56.34 1nqt n SER 276 Cb 0.00 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 1nqt n SER 276 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1nqt n ASP 277 N -0.17 3.38 0.00 4.04 8.00 -1.26 -5.14 116.55 125.40 1nqt n ASP 277 Ca 0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.60 1nqt n ASP 277 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 1nqt n ASP 277 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nqt n GLY 278 N 3.31 2.20 3.85 0.44 0.00 -1.26 -5.04 105.19 108.69 1nqt n GLY 278 Ca 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 46.02 46.23 1nqt n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt s SER 279 N 2.00 -0.03 0.09 1.61 0.01 -1.25 -3.50 113.70 112.62 1nqt s SER 279 Ca 0.00 -0.38 -0.08 0.00 1.31 0.00 0.00 55.95 56.79 1nqt s SER 279 Cb 0.00 0.31 -0.00 0.00 0.21 0.00 0.00 66.02 66.54 1nqt s SER 279 CO 0.00 -0.61 0.18 -0.63 0.41 0.00 0.00 173.24 172.59 1nqt s ILE 280 N -2.29 0.15 0.13 1.44 1.01 0.51 -3.90 121.20 118.24 1nqt s ILE 280 Ca 0.22 -1.20 -0.19 0.00 0.00 0.00 0.00 60.65 59.48 1nqt s ILE 280 Cb -0.00 -1.33 0.05 0.00 0.01 0.00 0.00 42.46 41.18 1nqt s ILE 280 CO 0.01 -0.66 0.48 0.86 0.00 0.00 0.00 174.94 175.63 1nqt s TRP 281 N -3.83 -0.35 0.00 3.97 -0.11 -1.21 -3.20 118.94 114.22 1nqt s TRP 281 Ca 0.05 0.12 0.00 0.00 1.22 0.00 0.00 56.10 57.49 1nqt s TRP 281 Cb 0.05 0.37 0.00 0.00 -1.50 0.00 0.00 33.47 32.39 1nqt s TRP 281 CO -0.11 -0.74 0.00 -1.71 -4.62 0.00 0.00 176.95 169.77 1nqt n ASN 282 N -0.19 0.00 0.00 5.86 2.85 -1.02 -1.52 115.26 121.25 1nqt n ASN 282 Ca -0.17 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.30 1nqt n ASN 282 Cb 0.64 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.66 1nqt n ASN 282 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1nqt n PRO 283 N 0.00 0.00 -0.67 1.20 -0.02 -1.26 -0.88 135.00 133.37 1nqt n PRO 283 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1nqt n PRO 283 Cb 0.00 -1.50 0.21 0.00 -0.02 0.00 0.00 33.50 32.18 1nqt n PRO 283 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nqt n ASP 284 N -0.72 2.62 0.00 2.55 4.64 -1.26 -5.06 116.55 119.31 1nqt n ASP 284 Ca 0.00 -3.62 0.00 0.00 -1.38 0.00 0.00 54.79 49.79 1nqt n ASP 284 Cb 0.00 -0.60 0.00 0.00 -1.04 0.00 0.00 41.12 39.49 1nqt n ASP 284 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1nqt n GLY 285 N -1.04 -1.92 3.39 0.27 0.00 -0.06 -5.06 105.19 100.76 1nqt n GLY 285 Ca 0.28 -1.39 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 1nqt n GLY 285 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 286 N -3.58 2.12 -0.18 -0.61 1.01 -1.04 -4.92 121.20 114.01 1nqt s ILE 286 Ca 0.00 -2.04 -0.00 0.00 0.00 0.00 0.00 60.65 58.61 1nqt s ILE 286 Cb 0.00 -2.02 0.00 0.00 0.01 0.00 0.00 42.46 40.45 1nqt s ILE 286 CO 0.00 -0.25 -0.14 -0.62 0.00 0.00 0.00 174.94 173.92 1nqt s ASP 287 N -2.80 3.64 0.03 3.58 2.15 -1.26 -4.52 116.67 117.50 1nqt s ASP 287 Ca 0.20 -0.50 -0.06 0.00 0.43 0.00 0.00 52.55 52.61 1nqt s ASP 287 Cb -0.06 -1.58 -0.02 0.00 -0.30 0.00 0.00 42.92 40.96 1nqt s ASP 287 CO 0.09 0.04 1.10 -0.65 -0.17 0.00 0.00 175.17 175.58 1nqt h PRO 288 N 7.65 -0.03 -0.62 4.34 0.11 -1.95 -1.44 132.00 140.05 1nqt h PRO 288 Ca -0.38 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.79 1nqt h PRO 288 Cb 1.17 0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 1nqt h PRO 288 CO 0.60 -0.02 -0.37 1.17 -0.21 0.00 0.00 178.00 179.17 1nqt n LYS 289 N -3.33 -0.27 -0.02 1.05 4.81 -1.26 0.16 118.16 119.29 1nqt n LYS 289 Ca -0.00 1.16 -0.13 0.00 -0.87 0.00 0.00 58.31 58.48 1nqt n LYS 289 Cb 0.06 -1.71 -0.08 0.00 0.02 0.00 0.00 35.03 33.31 1nqt n LYS 289 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1nqt h GLU 290 N 0.00 -0.45 -0.04 1.64 5.08 -1.88 0.15 114.58 119.08 1nqt h GLU 290 Ca 0.10 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1nqt h GLU 290 Cb 0.25 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1nqt h GLU 290 CO -0.58 -0.30 0.05 1.25 -1.00 0.00 0.00 179.01 178.42 1nqt h LEU 291 N -0.47 0.00 0.33 1.33 5.85 -0.02 0.05 115.31 122.39 1nqt h LEU 291 Ca 0.03 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1nqt h LEU 291 Cb 0.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1nqt h LEU 291 CO -0.38 0.00 -0.16 -0.08 -0.34 0.00 0.00 178.44 177.48 1nqt h GLU 292 N 0.00 -0.43 -0.13 1.25 4.22 0.33 -2.34 114.58 117.48 1nqt h GLU 292 Ca 0.02 0.03 0.03 0.00 0.08 0.00 0.00 59.36 59.52 1nqt h GLU 292 Cb 0.11 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 1nqt h GLU 292 CO -0.00 -0.11 -0.09 -0.44 -2.18 0.00 0.00 179.01 176.19 1nqt h ASP 293 N -0.93 -0.28 -0.89 1.04 3.32 -0.15 -2.28 116.42 116.25 1nqt h ASP 293 Ca -0.05 0.06 0.16 0.00 0.02 0.00 0.00 57.03 57.23 1nqt h ASP 293 Cb 0.52 0.15 -0.10 0.00 0.22 0.00 0.00 39.33 40.12 1nqt h ASP 293 CO 0.08 -0.12 0.47 0.15 -1.72 0.00 0.00 179.24 178.09 1nqt h PHE 294 N -0.09 0.82 0.00 4.55 3.57 -1.07 1.27 116.94 125.98 1nqt h PHE 294 Ca 0.08 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1nqt h PHE 294 Cb 0.21 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1nqt h PHE 294 CO -0.21 0.17 -0.27 -0.22 -2.23 0.00 0.00 178.31 175.55 1nqt h LYS 295 N 0.63 0.00 0.04 1.11 3.64 -1.01 -3.21 116.57 117.76 1nqt h LYS 295 Ca 0.50 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.57 1nqt h LYS 295 Cb 0.75 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 1nqt h LYS 295 CO -0.38 0.27 -1.69 -0.07 -2.27 0.00 0.00 179.45 175.30 1nqt h LEU 296 N 0.00 0.14 0.25 5.20 -0.00 0.48 -3.38 115.31 117.99 1nqt h LEU 296 Ca -0.00 -0.27 -0.01 0.00 -0.00 0.00 0.00 57.88 57.60 1nqt h LEU 296 Cb 0.83 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 1nqt h LEU 296 CO 0.04 1.24 -0.12 1.56 -0.00 0.00 0.00 178.44 181.15 1nqt h GLN 297 N 0.02 -0.32 -2.99 1.13 4.20 0.12 -3.45 115.11 113.82 1nqt h GLN 297 Ca -0.29 0.02 -0.17 0.00 0.06 0.00 0.00 58.65 58.28 1nqt h GLN 297 Cb 2.00 0.07 -0.27 0.00 0.30 0.00 0.00 27.48 29.58 1nqt h GLN 297 CO 0.10 -0.15 -0.42 -3.38 -0.67 0.00 0.00 178.83 174.31 1nqt s HIS 298 N -5.76 -0.35 0.00 2.96 -3.43 -1.21 -5.10 115.29 102.39 1nqt s HIS 298 Ca -0.15 0.83 0.00 0.00 -0.80 0.00 0.00 55.06 54.94 1nqt s HIS 298 Cb 0.04 0.10 0.00 0.00 -1.43 0.00 0.00 32.58 31.30 1nqt s HIS 298 CO 0.63 -0.21 0.00 0.41 -2.00 0.00 0.00 174.74 173.58 1nqt n GLY 299 N 3.61 0.46 0.00 -1.38 0.00 -1.26 -4.59 105.19 102.02 1nqt n GLY 299 Ca -0.19 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1nqt n GLY 299 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nqt n SER 300 N -0.31 -0.85 -0.43 1.61 2.88 -1.26 -4.51 113.62 110.74 1nqt n SER 300 Ca 0.00 -0.48 0.14 0.00 -1.33 0.00 0.00 58.87 57.19 1nqt n SER 300 Cb 0.00 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 63.91 1nqt n SER 300 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1nqt n ILE 301 N -2.29 0.00 -2.21 2.46 -6.64 -1.26 -4.35 119.36 105.07 1nqt n ILE 301 Ca 0.00 -0.23 -0.42 0.00 -1.77 0.00 0.00 62.75 60.34 1nqt n ILE 301 Cb 0.00 0.53 -0.03 0.00 -1.44 0.00 0.00 39.64 38.70 1nqt n ILE 301 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 1nqt s LEU 302 N -2.16 4.40 -0.20 7.28 1.02 -1.26 -3.55 118.68 124.22 1nqt s LEU 302 Ca 0.33 2.37 -0.00 0.00 0.02 0.00 0.00 54.13 56.85 1nqt s LEU 302 Cb 0.20 -3.60 0.00 0.00 0.02 0.00 0.00 46.19 42.81 1nqt s LEU 302 CO 0.39 -0.56 0.17 0.61 0.02 0.00 0.00 176.35 176.98 1nqt n GLY 303 N 2.66 0.37 3.68 -3.19 0.00 -1.26 -5.04 105.19 102.41 1nqt n GLY 303 Ca 0.08 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1nqt n GLY 303 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nqt s PHE 304 N -3.06 3.34 1.16 1.61 5.36 -1.23 -5.09 117.98 120.07 1nqt s PHE 304 Ca 0.02 0.25 -0.14 0.00 -0.96 0.00 0.00 56.93 56.10 1nqt s PHE 304 Cb -0.01 -2.25 0.25 0.00 -0.34 0.00 0.00 43.02 40.67 1nqt s PHE 304 CO 0.12 0.11 0.80 -2.30 -1.46 0.00 0.00 175.22 172.49 1nqt n PRO 305 N 4.12 -2.27 -1.62 10.12 -0.02 -1.26 -3.27 135.00 140.80 1nqt n PRO 305 Ca -0.15 -0.64 -0.16 0.00 -2.02 0.00 0.00 63.50 60.53 1nqt n PRO 305 Cb 0.52 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 1nqt n PRO 305 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1nqt n LYS 306 N -4.33 -1.45 -3.63 -0.52 4.81 -1.26 -4.90 118.16 106.87 1nqt n LYS 306 Ca 0.03 0.94 -0.12 0.00 -0.87 0.00 0.00 58.31 58.29 1nqt n LYS 306 Cb 0.56 -5.29 -0.07 0.00 0.02 0.00 0.00 35.03 30.25 1nqt n LYS 306 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nqt s ALA 307 N -2.45 -1.85 -0.33 3.14 0.00 -1.20 -4.89 121.76 114.18 1nqt s ALA 307 Ca 0.00 2.07 -0.08 0.00 0.00 0.00 0.00 51.96 53.95 1nqt s ALA 307 Cb 0.00 -1.29 0.02 0.00 0.00 0.00 0.00 23.12 21.85 1nqt s ALA 307 CO 0.00 -0.33 0.12 0.21 0.00 0.00 0.00 175.76 175.76 1nqt s LYS 308 N 0.57 2.92 -0.17 0.00 2.20 -0.57 -4.67 119.74 120.02 1nqt s LYS 308 Ca -0.01 -0.98 -0.35 0.00 -0.36 0.00 0.00 55.97 54.27 1nqt s LYS 308 Cb -0.05 -3.49 -0.16 0.00 -1.51 0.00 0.00 37.83 32.62 1nqt s LYS 308 CO -0.04 -0.56 1.04 -2.30 -0.36 0.00 0.00 175.35 173.13 1nqt n PRO 309 N 4.89 0.00 -4.75 4.03 -0.02 -1.26 -3.30 135.00 134.59 1nqt n PRO 309 Ca -0.13 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.02 1nqt n PRO 309 Cb 0.47 -1.21 -0.14 0.00 -0.02 0.00 0.00 33.50 32.60 1nqt n PRO 309 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1nqt s TYR 310 N 1.02 2.82 0.41 6.00 5.04 -1.25 -4.91 117.35 126.47 1nqt s TYR 310 Ca 0.78 -0.56 -0.25 0.00 -2.44 0.00 0.00 57.07 54.60 1nqt s TYR 310 Cb -1.10 -1.83 -0.08 0.00 0.35 0.00 0.00 41.96 39.29 1nqt s TYR 310 CO 0.54 -0.15 1.17 -2.00 -1.34 0.00 0.00 175.55 173.77 1nqt s GLU 311 N 0.23 4.02 4.59 4.97 2.56 -1.26 -3.93 118.70 129.87 1nqt s GLU 311 Ca -0.08 1.83 0.00 0.00 0.00 0.00 0.00 54.97 56.72 1nqt s GLU 311 Cb -0.15 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.34 1nqt s GLU 311 CO 0.05 -0.35 0.00 0.41 -0.56 0.00 0.00 175.26 174.81 1nqt n GLY 312 N 0.60 1.20 3.95 -1.50 0.00 -1.26 -4.85 105.19 103.33 1nqt n GLY 312 Ca 0.05 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.09 1nqt n GLY 312 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nqt s SER 313 N -4.00 6.01 0.11 1.61 1.04 -1.26 -4.41 113.70 112.79 1nqt s SER 313 Ca 0.00 0.31 0.23 0.00 0.48 0.00 0.00 55.95 56.97 1nqt s SER 313 Cb 0.00 -1.69 0.03 0.00 0.10 0.00 0.00 66.02 64.46 1nqt s SER 313 CO 0.00 -0.54 1.01 2.30 0.98 0.00 0.00 173.24 176.99 1nqt n ILE 314 N -1.95 0.35 -0.22 -1.02 -0.00 -1.26 -4.38 119.36 110.88 1nqt n ILE 314 Ca -0.01 -0.40 0.28 0.00 -0.00 0.00 0.00 62.75 62.63 1nqt n ILE 314 Cb 0.57 -0.08 0.44 0.00 -0.00 0.00 0.00 39.64 40.57 1nqt n ILE 314 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 1nqt n LEU 315 N -2.29 0.00 -0.08 7.28 4.32 -1.26 0.39 117.00 125.36 1nqt n LEU 315 Ca 0.01 0.76 -0.22 0.00 -0.02 0.00 0.00 56.01 56.53 1nqt n LEU 315 Cb 0.50 -0.26 -0.12 0.00 -1.62 0.00 0.00 43.42 41.91 1nqt n LEU 315 CO 0.40 -0.76 -0.72 -1.84 -1.22 0.00 0.00 177.39 173.26 1nqt n GLU 316 N -3.23 0.62 0.00 3.23 0.28 -1.26 -4.61 120.64 115.66 1nqt n GLU 316 Ca 0.24 0.45 0.00 0.00 -0.16 0.00 0.00 57.16 57.69 1nqt n GLU 316 Cb 1.53 -1.71 0.00 0.00 1.43 0.00 0.00 31.44 32.70 1nqt n GLU 316 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1nqt n ALA 317 N -3.39 -0.38 -2.47 -1.84 0.00 0.16 -3.39 120.51 109.20 1nqt n ALA 317 Ca -0.35 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.67 1nqt n ALA 317 Cb 0.81 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.23 1nqt n ALA 317 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nqt s ASP 318 N 0.00 7.12 0.00 0.00 2.15 -1.26 -4.49 116.67 120.19 1nqt s ASP 318 Ca 0.00 1.93 0.00 0.00 0.43 0.00 0.00 52.55 54.91 1nqt s ASP 318 Cb 0.00 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1nqt s ASP 318 CO 0.00 -0.46 0.00 0.00 -0.17 0.00 0.00 175.17 174.54 1nqt n ASP 320 N -0.69 1.40 -4.43 0.00 8.00 0.34 -4.04 116.55 117.14 1nqt n ASP 320 Ca 0.00 0.32 -0.34 0.00 0.71 0.00 0.00 54.79 55.48 1nqt n ASP 320 Cb 0.00 -0.70 -0.13 0.00 -0.02 0.00 0.00 41.12 40.27 1nqt n ASP 320 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1nqt s ILE 321 N -2.27 3.63 -0.14 0.53 -4.36 -1.05 -0.67 121.20 116.87 1nqt s ILE 321 Ca -0.18 -0.44 -0.05 0.00 -0.26 0.00 0.00 60.65 59.71 1nqt s ILE 321 Cb 0.03 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 41.10 1nqt s ILE 321 CO 0.27 0.48 0.05 -0.22 0.24 0.00 0.00 174.94 175.76 1nqt s LEU 322 N 0.62 3.79 -0.42 0.37 1.98 0.91 -1.12 118.68 124.81 1nqt s LEU 322 Ca -0.03 0.15 0.02 0.00 -2.89 0.00 0.00 54.13 51.38 1nqt s LEU 322 Cb -0.15 -1.92 0.12 0.00 0.66 0.00 0.00 46.19 44.91 1nqt s LEU 322 CO 0.03 0.28 0.19 -0.63 -1.89 0.00 0.00 176.35 174.32 1nqt s ILE 323 N -0.27 1.77 -1.12 6.68 1.01 0.12 -0.40 121.20 128.99 1nqt s ILE 323 Ca 0.08 -2.53 -0.23 0.00 0.00 0.00 0.00 60.65 57.97 1nqt s ILE 323 Cb -0.12 -2.26 -0.09 0.00 0.01 0.00 0.00 42.46 40.00 1nqt s ILE 323 CO 0.02 -0.79 1.95 -2.84 0.00 0.00 0.00 174.94 173.29 1nqt s PRO 324 N 0.49 2.42 -0.29 2.79 0.02 -1.24 -1.33 135.00 137.85 1nqt s PRO 324 Ca 0.15 -0.93 0.03 0.00 0.02 0.00 0.00 61.00 60.27 1nqt s PRO 324 Cb -0.23 -5.19 0.45 0.00 0.02 0.00 0.00 34.50 29.56 1nqt s PRO 324 CO -0.05 -3.96 1.59 0.00 -0.33 0.00 0.00 177.00 174.26 1nqt n ALA 325 N 14.66 4.49 -2.60 -1.55 0.00 -0.72 -2.80 120.51 131.99 1nqt n ALA 325 Ca 0.44 -1.89 0.00 0.00 0.00 0.00 0.00 53.44 51.99 1nqt n ALA 325 Cb 0.47 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1nqt n ALA 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nqt n ALA 326 N -0.53 0.00 -0.78 0.00 0.00 -1.20 -4.56 120.51 113.44 1nqt n ALA 326 Ca 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.78 1nqt n ALA 326 Cb 1.26 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.78 1nqt n ALA 326 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1nqt n SER 327 N 0.00 -2.04 -4.50 0.00 2.88 -1.26 -4.71 113.62 103.98 1nqt n SER 327 Ca 0.00 -0.21 -0.34 0.00 -1.33 0.00 0.00 58.87 56.99 1nqt n SER 327 Cb 0.00 -0.31 -0.12 0.00 -0.75 0.00 0.00 64.21 63.03 1nqt n SER 327 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1nqt s GLU 328 N -2.62 3.69 -0.15 -1.46 2.12 -1.26 -4.49 118.70 114.52 1nqt s GLU 328 Ca 0.16 -0.50 -0.00 0.00 0.36 0.00 0.00 54.97 54.98 1nqt s GLU 328 Cb -0.03 -2.98 -0.00 0.00 0.26 0.00 0.00 34.13 31.38 1nqt s GLU 328 CO 0.13 0.20 0.14 1.63 -0.54 0.00 0.00 175.26 176.82 1nqt n LYS 329 N 3.68 -0.29 -0.06 4.30 5.02 -0.63 -4.97 118.16 125.21 1nqt n LYS 329 Ca -0.17 0.58 0.04 0.00 -2.02 0.00 0.00 58.31 56.74 1nqt n LYS 329 Cb 0.52 -2.32 0.07 0.00 -0.02 0.00 0.00 35.03 33.28 1nqt n LYS 329 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1nqt n GLN 330 N -1.29 1.39 -3.41 1.97 -0.06 -1.25 -4.80 117.38 109.93 1nqt n GLN 330 Ca -0.00 -1.42 -0.22 0.00 -2.00 0.00 0.00 57.00 53.35 1nqt n GLN 330 Cb 0.50 -1.19 -0.10 0.00 -4.06 0.00 0.00 30.24 25.40 1nqt n GLN 330 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1nqt s LEU 331 N -0.85 0.36 0.00 1.69 1.43 -1.23 -4.96 118.68 115.12 1nqt s LEU 331 Ca 0.14 -1.74 0.02 0.00 -1.03 0.00 0.00 54.13 51.52 1nqt s LEU 331 Cb 0.08 0.13 0.12 0.00 0.03 0.00 0.00 46.19 46.55 1nqt s LEU 331 CO 0.12 -0.30 0.85 0.35 0.23 0.00 0.00 176.35 177.60 1nqt n THR 332 N 4.31 0.00 0.20 5.49 -2.24 -1.26 -1.50 114.28 119.28 1nqt n THR 332 Ca 0.09 -1.48 0.07 0.00 -2.27 0.00 0.00 64.05 60.46 1nqt n THR 332 Cb 0.42 -0.85 0.60 0.00 -2.10 0.00 0.00 70.33 68.39 1nqt n THR 332 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1nqt h LYS 333 N 0.00 0.11 0.00 -0.78 3.64 -1.90 -1.87 116.57 115.77 1nqt h LYS 333 Ca -0.28 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1nqt h LYS 333 Cb 1.10 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1nqt h LYS 333 CO 0.32 0.08 0.00 0.45 -2.27 0.00 0.00 179.45 178.03 1nqt n SER 334 N -4.52 0.00 -0.32 4.20 2.88 -1.26 -3.97 113.62 110.63 1nqt n SER 334 Ca -0.01 0.00 0.29 0.00 -1.33 0.00 0.00 58.87 57.82 1nqt n SER 334 Cb 0.10 0.00 0.64 0.00 -0.75 0.00 0.00 64.21 64.19 1nqt n SER 334 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1nqt h ASN 335 N 0.00 0.21 0.00 -3.46 -0.00 -1.97 -3.32 115.58 107.04 1nqt h ASN 335 Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1nqt h ASN 335 Cb 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 38.32 38.33 1nqt h ASN 335 CO 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 177.43 177.46 1nqt n ALA 336 N -2.62 0.00 -0.07 4.14 0.00 -0.70 -0.44 120.51 120.82 1nqt n ALA 336 Ca 0.25 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.60 1nqt n ALA 336 Cb 1.07 0.07 -0.03 0.00 0.00 0.00 0.00 19.45 20.56 1nqt n ALA 336 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1nqt h PRO 337 N 0.00 -0.30 0.00 0.00 0.11 -1.79 -2.81 132.00 127.20 1nqt h PRO 337 Ca 0.00 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1nqt h PRO 337 Cb 0.00 0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1nqt h PRO 337 CO 0.00 -0.20 0.00 -2.13 -0.21 0.00 0.00 178.00 175.46 1nqt n ARG 338 N -5.41 0.00 -3.67 1.05 0.63 0.42 -4.70 116.66 104.98 1nqt n ARG 338 Ca -0.01 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.58 1nqt n ARG 338 Cb 0.33 -0.87 -0.05 0.00 0.45 0.00 0.00 32.46 32.32 1nqt n ARG 338 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1nqt s VAL 339 N -0.83 5.20 -1.41 5.15 -7.23 -1.06 -4.63 120.40 115.58 1nqt s VAL 339 Ca 0.00 0.31 0.13 0.00 -1.81 0.00 0.00 61.98 60.61 1nqt s VAL 339 Cb 0.00 -3.61 0.22 0.00 0.56 0.00 0.00 36.38 33.56 1nqt s VAL 339 CO 0.00 0.34 1.10 0.29 -0.31 0.00 0.00 175.10 176.51 1nqt n LYS 340 N 1.05 1.75 -2.21 4.82 5.02 -1.22 -5.00 118.16 122.38 1nqt n LYS 340 Ca -0.10 -1.69 -0.30 0.00 -2.02 0.00 0.00 58.31 54.20 1nqt n LYS 340 Cb 0.53 -1.29 -0.00 0.00 -0.02 0.00 0.00 35.03 34.25 1nqt n LYS 340 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt s ALA 341 N -1.06 3.19 -0.49 7.82 0.00 -1.26 -4.36 121.76 125.60 1nqt s ALA 341 Ca 0.21 -0.17 0.07 0.00 0.00 0.00 0.00 51.96 52.07 1nqt s ALA 341 Cb 0.13 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 1nqt s ALA 341 CO 0.18 -0.49 0.42 1.63 0.00 0.00 0.00 175.76 177.50 1nqt n LYS 342 N -2.35 3.31 -3.50 0.00 4.76 0.15 -4.94 118.16 115.59 1nqt n LYS 342 Ca 0.04 -0.30 -0.19 0.00 -2.87 0.00 0.00 58.31 54.99 1nqt n LYS 342 Cb 0.54 -0.91 -0.13 0.00 -1.84 0.00 0.00 35.03 32.69 1nqt n LYS 342 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1nqt s ILE 343 N -1.28 -0.30 -0.22 -0.18 1.01 -0.91 -1.87 121.20 117.45 1nqt s ILE 343 Ca 0.04 -0.18 -0.14 0.00 0.00 0.00 0.00 60.65 60.37 1nqt s ILE 343 Cb 0.05 -0.71 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 1nqt s ILE 343 CO 0.21 -0.26 0.34 -0.63 0.00 0.00 0.00 174.94 174.60 1nqt s ILE 344 N 2.30 5.23 -0.57 2.92 1.01 -0.03 -0.06 121.20 132.00 1nqt s ILE 344 Ca 0.07 0.55 -0.04 0.00 0.00 0.00 0.00 60.65 61.23 1nqt s ILE 344 Cb -0.16 -3.67 0.15 0.00 0.01 0.00 0.00 42.46 38.79 1nqt s ILE 344 CO -0.14 0.25 0.40 0.00 0.00 0.00 0.00 174.94 175.45 1nqt s ALA 345 N 1.41 3.50 -0.81 9.38 0.00 0.46 -0.40 121.76 135.29 1nqt s ALA 345 Ca 0.15 -3.02 -0.20 0.00 0.00 0.00 0.00 51.96 48.89 1nqt s ALA 345 Cb -0.15 -2.68 -0.18 0.00 0.00 0.00 0.00 23.12 20.11 1nqt s ALA 345 CO 0.08 -2.02 1.93 0.39 0.00 0.00 0.00 175.76 176.13 1nqt n GLU 346 N 3.93 0.13 -0.74 0.00 1.02 -0.41 -3.69 120.64 120.88 1nqt n GLU 346 Ca 0.04 -1.15 -0.08 0.00 -0.02 0.00 0.00 57.16 55.95 1nqt n GLU 346 Cb 0.40 -3.16 -0.01 0.00 -0.02 0.00 0.00 31.44 28.64 1nqt n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nqt n GLY 347 N 5.86 3.16 0.00 0.62 0.00 -1.12 -3.87 105.19 109.83 1nqt n GLY 347 Ca 0.35 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1nqt n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 348 N 1.25 0.00 -2.58 4.61 0.00 -1.22 -4.23 120.51 118.34 1nqt n ALA 348 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.19 1nqt n ALA 348 Cb 0.58 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 1nqt n ALA 348 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1nqt s ASN 349 N 0.00 7.08 -1.13 0.00 0.01 -1.26 -4.13 114.94 115.50 1nqt s ASN 349 Ca 0.00 1.54 -0.07 0.00 -0.71 0.00 0.00 52.86 53.62 1nqt s ASN 349 Cb 0.00 -2.54 0.01 0.00 0.41 0.00 0.00 41.25 39.12 1nqt s ASN 349 CO 0.00 -0.65 0.99 0.61 -1.51 0.00 0.00 177.10 176.54 1nqt n GLY 350 N 3.37 -0.29 2.10 0.66 0.00 -1.26 -4.66 105.19 105.10 1nqt n GLY 350 Ca 0.12 0.10 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 1nqt n GLY 350 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nqt n PRO 351 N -4.25 2.15 -3.55 1.61 -0.04 -1.26 -1.60 135.00 128.06 1nqt n PRO 351 Ca 0.01 -2.21 -0.01 0.00 -0.04 0.00 0.00 63.50 61.25 1nqt n PRO 351 Cb 0.55 -1.88 -0.05 0.00 -0.04 0.00 0.00 33.50 32.08 1nqt n PRO 351 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1nqt s THR 352 N -3.14 -0.43 0.40 0.52 -1.32 -1.26 -3.52 115.64 106.89 1nqt s THR 352 Ca 0.44 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.81 1nqt s THR 352 Cb 0.34 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 70.27 1nqt s THR 352 CO -0.04 0.00 0.77 0.42 -2.21 0.00 0.00 174.62 173.56 1nqt s THR 353 N 2.17 4.78 0.16 5.08 -4.23 -0.56 -4.89 115.64 118.16 1nqt s THR 353 Ca -0.06 0.64 -0.30 0.00 -1.18 0.00 0.00 61.69 60.79 1nqt s THR 353 Cb -0.07 -3.73 -0.05 0.00 1.34 0.00 0.00 72.50 70.00 1nqt s THR 353 CO -0.18 -0.50 1.54 -0.65 -0.54 0.00 0.00 174.62 174.29 1nqt h PRO 354 N 1.31 -0.06 -0.93 3.99 0.11 -2.00 1.19 132.00 135.60 1nqt h PRO 354 Ca -0.47 0.00 0.27 0.00 0.11 0.00 0.00 66.00 65.91 1nqt h PRO 354 Cb 1.19 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1nqt h PRO 354 CO 0.64 -0.04 0.67 0.93 -0.21 0.00 0.00 178.00 179.98 1nqt h GLU 355 N -0.07 0.03 -0.18 1.05 4.39 -1.94 0.82 114.58 118.69 1nqt h GLU 355 Ca 0.16 -0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.64 1nqt h GLU 355 Cb 0.46 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1nqt h GLU 355 CO -0.89 0.02 -0.73 0.00 -1.16 0.00 0.00 179.01 176.25 1nqt h ALA 356 N 1.54 0.34 0.31 3.43 0.00 0.11 -3.08 119.26 121.92 1nqt h ALA 356 Ca 0.45 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1nqt h ALA 356 Cb 1.74 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1nqt h ALA 356 CO -0.02 0.68 -0.28 -0.44 0.00 0.00 0.00 179.25 179.20 1nqt h ASP 357 N 0.57 -0.75 0.00 0.00 3.32 0.22 -1.56 116.42 118.22 1nqt h ASP 357 Ca -0.04 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1nqt h ASP 357 Cb 1.36 0.24 0.00 0.00 0.22 0.00 0.00 39.33 41.15 1nqt h ASP 357 CO 0.15 -0.38 0.33 0.29 -1.72 0.00 0.00 179.24 177.92 1nqt n LYS 358 N -4.05 0.04 -0.07 3.56 5.02 -0.89 -0.02 118.16 121.75 1nqt n LYS 358 Ca -0.07 0.39 -0.20 0.00 -2.02 0.00 0.00 58.31 56.41 1nqt n LYS 358 Cb 0.26 -1.95 -0.13 0.00 -0.02 0.00 0.00 35.03 33.19 1nqt n LYS 358 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1nqt n ILE 359 N -1.61 1.62 -0.01 -0.18 -0.00 -0.83 -3.38 119.36 114.98 1nqt n ILE 359 Ca -0.00 -0.57 -0.02 0.00 -0.00 0.00 0.00 62.75 62.16 1nqt n ILE 359 Cb 0.34 -1.62 0.23 0.00 -0.00 0.00 0.00 39.64 38.59 1nqt n ILE 359 CO 0.00 0.00 0.00 -0.26 -0.00 0.00 0.00 176.55 176.29 1nqt h PHE 360 N -0.09 0.60 -0.09 1.39 0.04 0.53 -2.22 116.94 117.10 1nqt h PHE 360 Ca -0.51 -0.09 -0.10 0.00 2.80 0.00 0.00 57.97 60.07 1nqt h PHE 360 Cb 1.91 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 39.89 1nqt h PHE 360 CO 0.05 0.65 -0.40 1.25 -0.60 0.00 0.00 178.31 179.26 1nqt h LEU 361 N 0.51 0.19 -0.25 1.54 5.85 -1.06 0.27 115.31 122.36 1nqt h LEU 361 Ca 0.09 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.60 1nqt h LEU 361 Cb 0.50 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1nqt h LEU 361 CO 0.03 0.57 -0.38 -0.33 -0.34 0.00 0.00 178.44 177.99 1nqt h GLU 362 N 0.16 0.70 -0.81 1.25 4.39 -1.43 -3.18 114.58 115.65 1nqt h GLU 362 Ca 0.01 -0.42 -0.10 0.00 0.34 0.00 0.00 59.36 59.20 1nqt h GLU 362 Cb 0.77 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.40 1nqt h GLU 362 CO 0.06 1.04 0.12 2.89 -1.16 0.00 0.00 179.01 181.96 1nqt n ARG 363 N -4.21 3.00 -3.61 2.33 1.85 -0.89 -4.93 116.66 110.20 1nqt n ARG 363 Ca -0.05 -1.98 -0.23 0.00 -1.00 0.00 0.00 57.85 54.59 1nqt n ARG 363 Cb 0.53 -1.92 0.04 0.00 -1.05 0.00 0.00 32.46 30.06 1nqt n ARG 363 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1nqt n ASN 364 N 0.12 -3.26 -4.51 2.89 5.03 -0.78 -5.01 115.26 109.73 1nqt n ASN 364 Ca 0.24 -0.85 -0.36 0.00 0.87 0.00 0.00 54.58 54.47 1nqt n ASN 364 Cb 0.97 -4.09 -0.12 0.00 -1.02 0.00 0.00 39.78 35.53 1nqt n ASN 364 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1nqt s ILE 365 N -3.56 4.52 -0.33 2.41 -1.09 0.89 -4.86 121.20 119.17 1nqt s ILE 365 Ca 0.21 -0.11 -0.28 0.00 -2.23 0.00 0.00 60.65 58.24 1nqt s ILE 365 Cb -0.06 -3.09 0.02 0.00 -1.58 0.00 0.00 42.46 37.75 1nqt s ILE 365 CO 0.81 0.37 1.02 -0.32 -1.23 0.00 0.00 174.94 175.59 1nqt s MET 366 N 1.24 4.01 -0.32 2.79 -2.45 -0.78 -4.54 119.30 119.26 1nqt s MET 366 Ca 0.05 0.93 -0.07 0.00 -1.25 0.00 0.00 55.69 55.35 1nqt s MET 366 Cb -0.14 -3.75 0.02 0.00 1.25 0.00 0.00 34.83 32.21 1nqt s MET 366 CO 0.04 -0.89 0.09 0.14 1.05 0.00 0.00 175.02 175.45 1nqt s VAL 367 N 3.57 3.90 -0.51 10.11 -7.23 -1.25 -0.85 120.40 128.14 1nqt s VAL 367 Ca 0.43 -0.89 -0.22 0.00 -1.81 0.00 0.00 61.98 59.49 1nqt s VAL 367 Cb -0.12 -3.10 0.04 0.00 0.56 0.00 0.00 36.38 33.76 1nqt s VAL 367 CO 0.16 -0.04 0.77 -0.63 -0.31 0.00 0.00 175.10 175.04 1nqt s ILE 368 N 1.46 4.66 0.14 -0.62 1.01 0.46 -4.17 121.20 124.14 1nqt s ILE 368 Ca 0.01 -0.00 -0.33 0.00 0.00 0.00 0.00 60.65 60.32 1nqt s ILE 368 Cb -0.18 -4.38 -0.17 0.00 0.01 0.00 0.00 42.46 37.74 1nqt s ILE 368 CO 0.03 -0.88 1.04 -2.65 0.00 0.00 0.00 174.94 172.48 1nqt n PRO 369 N 6.73 0.74 -0.28 2.79 -0.02 -1.26 -1.29 135.00 142.41 1nqt n PRO 369 Ca -0.02 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1nqt n PRO 369 Cb 0.47 -1.68 0.13 0.00 -0.02 0.00 0.00 33.50 32.40 1nqt n PRO 369 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1nqt h ASP 370 N 2.90 0.72 -0.88 2.55 -0.00 -1.82 1.23 116.42 121.12 1nqt h ASP 370 Ca -0.42 0.02 0.26 0.00 -0.00 0.00 0.00 57.03 56.89 1nqt h ASP 370 Cb 1.38 -0.12 -0.04 0.00 -0.00 0.00 0.00 39.33 40.55 1nqt h ASP 370 CO 0.67 0.46 0.69 0.25 -0.00 0.00 0.00 179.24 181.31 1nqt h LEU 371 N 0.85 0.00 0.00 0.15 5.85 -1.91 -2.34 115.31 117.91 1nqt h LEU 371 Ca 0.35 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.01 1nqt h LEU 371 Cb 0.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1nqt h LEU 371 CO -0.18 0.00 -1.01 0.00 -0.34 0.00 0.00 178.44 176.91 1nqt n TYR 372 N -4.07 0.00 0.08 1.25 4.19 -0.29 -4.57 117.16 113.75 1nqt n TYR 372 Ca 0.18 0.00 -0.12 0.00 3.31 0.00 0.00 57.90 61.28 1nqt n TYR 372 Cb 1.00 -0.16 -0.05 0.00 0.49 0.00 0.00 39.34 40.63 1nqt n TYR 372 CO 0.00 0.00 0.00 1.25 0.91 0.00 0.00 176.86 179.02 1nqt h LEU 373 N -0.18 -0.75 -0.75 2.98 5.85 0.15 -2.44 115.31 120.17 1nqt h LEU 373 Ca -0.09 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1nqt h LEU 373 Cb 0.88 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1nqt h LEU 373 CO -0.06 -0.33 0.00 -3.20 -0.34 0.00 0.00 178.44 174.51 1nqt n ASN 374 N -5.37 0.58 -0.65 1.25 5.15 -0.88 -3.73 115.26 111.60 1nqt n ASN 374 Ca -0.05 -1.54 0.13 0.00 -0.60 0.00 0.00 54.58 52.51 1nqt n ASN 374 Cb 0.29 -0.29 0.38 0.00 -0.53 0.00 0.00 39.78 39.63 1nqt n ASN 374 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nqt n ALA 375 N -0.04 2.53 0.19 5.20 0.00 -0.92 -4.15 120.51 123.31 1nqt n ALA 375 Ca 0.00 -0.56 0.07 0.00 0.00 0.00 0.00 53.44 52.95 1nqt n ALA 375 Cb 0.14 -1.05 0.58 0.00 0.00 0.00 0.00 19.45 19.12 1nqt n ALA 375 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1nqt h GLY 376 N 4.84 0.16 0.90 0.00 0.00 -1.79 -0.57 103.07 106.60 1nqt h GLY 376 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1nqt h GLY 376 CO 0.00 0.06 -0.33 -1.33 0.00 0.00 0.00 176.54 174.94 1nqt h GLY 377 N 0.16 -0.96 0.12 4.60 0.00 -1.76 -2.40 103.07 102.82 1nqt h GLY 377 Ca 0.04 0.36 0.09 0.00 0.00 0.00 0.00 47.33 47.82 1nqt h GLY 377 CO -0.01 -0.35 -0.10 -2.08 0.00 0.00 0.00 176.54 174.01 1nqt h VAL 378 N -1.03 0.56 -0.53 4.60 2.07 -1.73 -1.09 116.25 119.10 1nqt h VAL 378 Ca -0.09 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.53 1nqt h VAL 378 Cb 0.73 0.54 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 1nqt h VAL 378 CO 0.15 0.00 -0.14 0.74 0.02 0.00 0.00 177.57 178.35 1nqt h THR 379 N 0.02 0.46 0.15 2.57 2.02 -0.96 0.10 112.91 117.27 1nqt h THR 379 Ca 0.22 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.40 1nqt h THR 379 Cb 0.33 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1nqt h THR 379 CO -0.45 0.00 -0.10 0.58 0.37 0.00 0.00 175.52 175.92 1nqt h VAL 380 N -0.00 0.78 -0.39 3.16 2.07 -0.76 -2.43 116.25 118.68 1nqt h VAL 380 Ca 0.26 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.89 1nqt h VAL 380 Cb 0.39 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1nqt h VAL 380 CO -0.55 0.00 0.47 0.77 0.02 0.00 0.00 177.57 178.28 1nqt h SER 381 N -0.25 0.00 -0.01 0.57 4.64 0.12 0.96 113.55 119.58 1nqt h SER 381 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1nqt h SER 381 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1nqt h SER 381 CO 0.00 0.00 0.00 0.22 -0.87 0.00 0.00 176.83 176.19 1nqt h TYR 382 N 0.00 0.01 -0.54 4.77 -0.00 -0.55 -2.64 116.97 118.03 1nqt h TYR 382 Ca 0.18 -0.00 0.05 0.00 -0.00 0.00 0.00 58.73 58.96 1nqt h TYR 382 Cb 1.13 -0.00 -0.05 0.00 -0.00 0.00 0.00 36.73 37.80 1nqt h TYR 382 CO 0.00 0.27 0.26 0.74 -0.00 0.00 0.00 178.16 179.43 1nqt h PHE 383 N -0.24 0.47 -0.99 -3.82 0.05 0.96 -1.63 116.94 111.74 1nqt h PHE 383 Ca 0.00 0.02 0.08 0.00 3.82 0.00 0.00 57.97 61.89 1nqt h PHE 383 Cb 0.26 -0.13 -0.07 0.00 2.00 0.00 0.00 35.95 38.00 1nqt h PHE 383 CO 0.01 0.22 0.64 1.49 -0.18 0.00 0.00 178.31 180.49 1nqt h GLU 384 N 0.50 1.08 0.83 1.51 4.81 -1.22 0.47 114.58 122.56 1nqt h GLU 384 Ca 0.24 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1nqt h GLU 384 Cb 0.18 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.32 1nqt h GLU 384 CO -0.18 0.72 -0.40 2.35 -0.73 0.00 0.00 179.01 180.76 1nqt h TRP 385 N 1.12 -1.04 0.18 0.92 7.01 -0.93 -1.14 115.95 122.07 1nqt h TRP 385 Ca 0.45 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.43 1nqt h TRP 385 Cb 0.25 0.34 -0.04 0.00 -2.10 0.00 0.00 29.16 27.62 1nqt h TRP 385 CO -0.00 -0.65 -0.44 -0.07 -2.79 0.00 0.00 178.44 174.48 1nqt h LEU 386 N -1.12 -1.31 -0.84 0.65 3.38 -0.97 0.16 115.31 115.26 1nqt h LEU 386 Ca -0.11 0.13 0.34 0.00 0.09 0.00 0.00 57.88 58.32 1nqt h LEU 386 Cb 0.86 0.47 -0.15 0.00 0.09 0.00 0.00 40.66 41.93 1nqt h LEU 386 CO 0.19 -0.50 0.40 1.17 0.09 0.00 0.00 178.44 179.79 1nqt n LYS 387 N -5.01 -0.05 -0.06 1.13 4.81 0.16 0.27 118.16 119.41 1nqt n LYS 387 Ca -0.08 1.17 -0.12 0.00 -0.87 0.00 0.00 58.31 58.41 1nqt n LYS 387 Cb 0.36 -2.07 -0.06 0.00 0.02 0.00 0.00 35.03 33.28 1nqt n LYS 387 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1nqt h ASN 388 N 0.00 0.36 0.18 3.14 2.35 0.55 -2.31 115.58 119.84 1nqt h ASN 388 Ca 0.69 -0.39 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 1nqt h ASN 388 Cb 1.79 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 40.06 1nqt h ASN 388 CO -0.66 0.67 -0.09 -0.07 -1.65 0.00 0.00 177.43 175.63 1nqt h LEU 389 N 0.04 0.00 0.00 1.61 3.38 0.52 -2.47 115.31 118.39 1nqt h LEU 389 Ca 0.04 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 1nqt h LEU 389 Cb 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1nqt h LEU 389 CO 0.02 0.09 -1.15 0.78 0.09 0.00 0.00 178.44 178.27 1nqt h ASN 390 N 0.00 0.00 -1.01 -0.43 2.35 0.16 -3.48 115.58 113.17 1nqt h ASN 390 Ca -0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.44 1nqt h ASN 390 Cb 0.20 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.47 1nqt h ASN 390 CO 0.01 0.92 -0.30 1.41 -1.65 0.00 0.00 177.43 177.82 1nqt n HIS 391 N -3.23 -0.15 -3.76 1.19 8.25 -0.88 -4.98 115.22 111.66 1nqt n HIS 391 Ca -0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.28 1nqt n HIS 391 Cb 0.94 -2.75 -0.10 0.00 1.12 0.00 0.00 29.99 29.20 1nqt n HIS 391 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1nqt s VAL 392 N -2.60 0.02 -0.27 1.59 1.01 -1.25 -5.09 120.40 113.81 1nqt s VAL 392 Ca 0.00 -0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1nqt s VAL 392 Cb 0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.85 1nqt s VAL 392 CO 0.00 -0.07 1.64 -0.94 0.00 0.00 0.00 175.10 175.73 1nqt s SER 393 N -0.22 6.25 -0.20 3.32 1.04 -1.26 -4.82 113.70 117.81 1nqt s SER 393 Ca -0.04 1.45 -0.29 0.00 0.48 0.00 0.00 55.95 57.56 1nqt s SER 393 Cb -0.03 -2.53 -0.13 0.00 0.10 0.00 0.00 66.02 63.43 1nqt s SER 393 CO 0.01 -1.39 0.92 -1.22 0.98 0.00 0.00 173.24 172.54 1nqt n TYR 394 N 8.94 0.87 0.00 5.02 4.02 -1.26 -0.60 117.16 134.15 1nqt n TYR 394 Ca 0.20 0.73 0.00 0.00 -0.01 0.00 0.00 57.90 58.82 1nqt n TYR 394 Cb 0.46 -1.43 0.00 0.00 -0.02 0.00 0.00 39.34 38.35 1nqt n TYR 394 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nqt n GLY 395 N 1.99 2.96 0.43 2.72 0.00 -1.26 -4.14 105.19 107.89 1nqt n GLY 395 Ca 0.18 -0.21 0.31 0.00 0.00 0.00 0.00 46.02 46.29 1nqt n GLY 395 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nqt n ARG 396 N 0.00 0.00 -0.05 1.61 0.00 0.23 0.26 116.66 118.71 1nqt n ARG 396 Ca 0.00 0.66 -0.01 0.00 -0.00 0.00 0.00 57.85 58.50 1nqt n ARG 396 Cb 0.00 -1.54 -0.12 0.00 0.00 0.00 0.00 32.46 30.80 1nqt n ARG 396 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1nqt n LEU 397 N -3.10 0.00 -0.08 6.15 4.77 -1.26 -4.76 117.00 118.72 1nqt n LEU 397 Ca 0.26 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.08 1nqt n LEU 397 Cb 1.21 0.22 -0.13 0.00 -2.33 0.00 0.00 43.42 42.39 1nqt n LEU 397 CO 0.26 0.22 -1.11 0.35 -1.33 0.00 0.00 177.39 175.78 1nqt n THR 398 N -2.37 1.55 -0.31 -5.08 -2.24 0.14 -4.47 114.28 101.50 1nqt n THR 398 Ca -0.16 -0.66 -0.07 0.00 -2.27 0.00 0.00 64.05 60.88 1nqt n THR 398 Cb 0.77 -1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 67.65 1nqt n THR 398 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1nqt n PHE 399 N -3.20 -0.29 0.29 4.78 0.99 -0.90 0.06 117.46 119.19 1nqt n PHE 399 Ca -0.38 0.93 -0.17 0.00 -0.00 0.00 0.00 57.45 57.84 1nqt n PHE 399 Cb 1.04 -0.58 -0.08 0.00 -1.00 0.00 0.00 39.48 38.85 1nqt n PHE 399 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1nqt h LYS 400 N 0.00 -0.72 -0.52 -1.08 1.63 -1.85 0.89 116.57 114.91 1nqt h LYS 400 Ca 0.13 0.05 0.08 0.00 -0.85 0.00 0.00 60.65 60.07 1nqt h LYS 400 Cb 0.32 0.16 -0.10 0.00 -0.60 0.00 0.00 32.23 32.01 1nqt h LYS 400 CO -0.70 -0.48 -0.41 -0.92 -3.45 0.00 0.00 179.45 173.48 1nqt h TYR 401 N -0.75 -1.19 0.12 1.91 3.20 -0.60 -0.70 116.97 118.97 1nqt h TYR 401 Ca -0.06 0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.89 1nqt h TYR 401 Cb 0.60 0.59 -0.04 0.00 1.54 0.00 0.00 36.73 39.42 1nqt h TYR 401 CO -0.08 -0.42 -0.51 1.49 -1.64 0.00 0.00 178.16 177.01 1nqt h GLU 402 N -0.25 -0.70 -0.55 1.82 4.81 -0.50 0.06 114.58 119.26 1nqt h GLU 402 Ca 0.17 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.50 1nqt h GLU 402 Cb 0.57 0.16 -0.07 0.00 0.63 0.00 0.00 28.75 30.04 1nqt h GLU 402 CO -0.64 -0.47 -0.33 -2.13 -0.73 0.00 0.00 179.01 174.71 1nqt n ARG 403 N -5.33 -0.24 -0.03 1.92 0.63 0.28 -0.57 116.66 113.32 1nqt n ARG 403 Ca -0.08 0.98 -0.11 0.00 -0.92 0.00 0.00 57.85 57.73 1nqt n ARG 403 Cb 0.40 -1.45 -0.05 0.00 0.45 0.00 0.00 32.46 31.81 1nqt n ARG 403 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1nqt h ASP 404 N 0.00 -1.20 -0.71 6.15 3.45 -0.19 -1.26 116.42 122.67 1nqt h ASP 404 Ca 0.09 0.17 0.18 0.00 0.43 0.00 0.00 57.03 57.90 1nqt h ASP 404 Cb 0.23 0.51 -0.04 0.00 -0.56 0.00 0.00 39.33 39.47 1nqt h ASP 404 CO -0.52 -0.38 0.49 0.28 -1.57 0.00 0.00 179.24 177.54 1nqt h SER 405 N -0.40 0.17 0.56 6.45 0.02 0.11 -1.17 113.55 119.29 1nqt h SER 405 Ca 0.11 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1nqt h SER 405 Cb 0.58 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 63.11 1nqt h SER 405 CO -0.43 0.08 -0.27 0.78 -1.14 0.00 0.00 176.83 175.85 1nqt h ASN 406 N 0.18 -0.64 -0.73 3.07 -0.26 0.13 -1.53 115.58 115.79 1nqt h ASN 406 Ca 0.34 0.02 0.14 0.00 -0.56 0.00 0.00 56.30 56.24 1nqt h ASN 406 Cb 1.09 0.17 -0.14 0.00 -1.06 0.00 0.00 38.32 38.38 1nqt h ASN 406 CO -0.06 -0.37 -0.25 1.88 -1.06 0.00 0.00 177.43 177.57 1nqt h TYR 407 N -0.93 -0.62 -0.86 1.19 0.05 -1.11 1.05 116.97 115.74 1nqt h TYR 407 Ca -0.08 0.07 0.13 0.00 0.05 0.00 0.00 58.73 58.91 1nqt h TYR 407 Cb 0.58 0.39 -0.07 0.00 1.01 0.00 0.00 36.73 38.64 1nqt h TYR 407 CO 0.05 -0.35 0.56 0.45 -1.05 0.00 0.00 178.16 177.81 1nqt h HIS 408 N -0.05 0.80 0.26 4.88 3.86 -1.22 0.82 115.15 124.50 1nqt h HIS 408 Ca 0.33 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.55 1nqt h HIS 408 Cb 0.56 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.78 1nqt h HIS 408 CO -0.64 0.32 -0.12 -0.07 0.86 0.00 0.00 177.93 178.28 1nqt h LEU 409 N 0.70 -0.29 -0.80 2.43 -0.00 0.22 -2.05 115.31 115.52 1nqt h LEU 409 Ca 0.42 0.01 0.18 0.00 -0.00 0.00 0.00 57.88 58.50 1nqt h LEU 409 Cb 0.64 0.08 -0.14 0.00 -0.00 0.00 0.00 40.66 41.23 1nqt h LEU 409 CO -0.18 -0.20 -0.03 -0.07 -0.00 0.00 0.00 178.44 177.96 1nqt h LEU 410 N -0.37 -0.44 -2.66 1.67 3.38 -0.51 0.22 115.31 116.60 1nqt h LEU 410 Ca -0.04 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1nqt h LEU 410 Cb 0.26 0.39 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1nqt h LEU 410 CO 0.06 -0.22 0.02 -0.03 0.09 0.00 0.00 178.44 178.35 1nqt h MET 411 N 0.07 0.00 0.16 1.13 4.05 0.71 -0.01 114.93 121.05 1nqt h MET 411 Ca 0.43 0.00 -0.32 0.00 -0.28 0.00 0.00 59.70 59.54 1nqt h MET 411 Cb 0.77 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.58 1nqt h MET 411 CO -0.73 0.00 -1.57 0.77 0.23 0.00 0.00 176.91 175.60 1nqt h SER 412 N 0.00 0.55 -0.02 1.39 0.02 0.16 -2.54 113.55 113.10 1nqt h SER 412 Ca 0.00 -0.91 0.01 0.00 -0.84 0.00 0.00 61.79 60.05 1nqt h SER 412 Cb 0.03 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1nqt h SER 412 CO -0.00 1.71 0.02 1.62 -1.14 0.00 0.00 176.83 179.03 1nqt h VAL 413 N -0.06 0.94 0.18 2.27 3.04 -0.44 0.21 116.25 122.40 1nqt h VAL 413 Ca -0.32 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.37 1nqt h VAL 413 Cb 1.96 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 32.24 1nqt h VAL 413 CO 0.14 0.00 -0.09 -0.61 -1.01 0.00 0.00 177.57 176.00 1nqt h GLN 414 N 0.00 -0.24 -0.58 4.17 4.15 -1.06 -2.47 115.11 119.08 1nqt h GLN 414 Ca 0.01 0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.53 1nqt h GLN 414 Cb 0.04 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.72 1nqt h GLN 414 CO -0.00 -0.07 0.21 0.93 -1.93 0.00 0.00 178.83 177.97 1nqt h GLU 415 N -1.04 0.38 0.52 1.69 5.08 -1.23 0.26 114.58 120.24 1nqt h GLU 415 Ca -0.03 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1nqt h GLU 415 Cb 0.28 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1nqt h GLU 415 CO 0.04 0.25 -0.37 0.77 -1.00 0.00 0.00 179.01 178.70 1nqt h SER 416 N 0.39 -0.96 -0.73 1.42 0.02 -1.09 -0.56 113.55 112.04 1nqt h SER 416 Ca 0.29 0.06 0.15 0.00 -0.84 0.00 0.00 61.79 61.45 1nqt h SER 416 Cb 0.34 0.30 -0.10 0.00 0.14 0.00 0.00 62.40 63.07 1nqt h SER 416 CO -0.29 -0.56 0.21 0.25 -1.14 0.00 0.00 176.83 175.31 1nqt h LEU 417 N -0.87 0.09 -0.12 5.07 5.85 -0.88 0.52 115.31 124.99 1nqt h LEU 417 Ca -0.06 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1nqt h LEU 417 Cb 0.72 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1nqt h LEU 417 CO 0.03 0.01 0.00 -0.62 -0.34 0.00 0.00 178.44 177.51 1nqt n GLU 418 N -5.11 0.02 0.17 1.25 1.02 0.85 -1.43 120.64 117.41 1nqt n GLU 418 Ca 0.14 0.33 0.12 0.00 -0.02 0.00 0.00 57.16 57.73 1nqt n GLU 418 Cb 0.44 -1.55 0.20 0.00 -0.02 0.00 0.00 31.44 30.50 1nqt n GLU 418 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nqt h ARG 419 N 0.00 0.00 -0.32 3.49 3.08 0.17 -3.25 114.38 117.55 1nqt h ARG 419 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1nqt h ARG 419 Cb 0.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1nqt h ARG 419 CO 0.00 0.00 0.17 -0.22 -1.07 0.00 0.00 179.97 178.85 1nqt h LYS 420 N 0.00 0.45 -6.32 0.04 3.64 -1.25 -3.42 116.57 109.71 1nqt h LYS 420 Ca 0.00 -0.06 -0.69 0.00 -1.27 0.00 0.00 60.65 58.63 1nqt h LYS 420 Cb 0.93 -0.08 -0.24 0.00 -0.41 0.00 0.00 32.23 32.43 1nqt h LYS 420 CO 0.00 0.39 -0.77 0.12 -2.27 0.00 0.00 179.45 176.92 1nqt s PHE 421 N -5.81 2.69 0.00 1.91 2.19 -1.23 -5.03 117.98 112.70 1nqt s PHE 421 Ca -0.13 -0.18 -0.30 0.00 0.33 0.00 0.00 56.93 56.65 1nqt s PHE 421 Cb 0.09 -1.63 -0.36 0.00 -1.31 0.00 0.00 43.02 39.81 1nqt s PHE 421 CO 0.72 0.17 1.55 0.41 1.83 0.00 0.00 175.22 179.90 1nqt n GLY 422 N 2.34 0.51 3.26 13.12 0.00 -1.26 -4.77 105.19 118.39 1nqt n GLY 422 Ca -0.17 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 44.86 1nqt n GLY 422 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nqt s LYS 423 N 6.85 0.95 0.00 1.61 2.47 -1.26 -5.07 119.74 125.29 1nqt s LYS 423 Ca 0.66 -0.86 0.05 0.00 -1.56 0.00 0.00 55.97 54.26 1nqt s LYS 423 Cb 0.14 0.40 0.08 0.00 -1.46 0.00 0.00 37.83 36.99 1nqt s LYS 423 CO 0.34 -0.34 0.82 -2.39 0.16 0.00 0.00 175.35 173.94 1nqt n HIS 424 N -0.14 0.07 -1.99 4.03 1.44 -1.26 -4.68 115.22 112.70 1nqt n HIS 424 Ca -0.15 -0.16 0.00 0.00 -2.01 0.00 0.00 57.72 55.39 1nqt n HIS 424 Cb 0.63 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.73 1nqt n HIS 424 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1nqt n GLY 425 N 0.20 0.94 0.10 -1.39 0.00 -1.26 -5.01 105.19 98.77 1nqt n GLY 425 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1nqt n GLY 425 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nqt h GLY 426 N 0.00 -0.18 -5.42 -0.02 0.00 -1.95 -3.43 103.07 92.07 1nqt h GLY 426 Ca 0.00 0.07 -0.67 0.00 0.00 0.00 0.00 47.33 46.73 1nqt h GLY 426 CO 0.00 -0.06 -0.52 -0.51 0.00 0.00 0.00 176.54 175.44 1nqt s THR 427 N -5.94 5.17 -0.61 4.70 -4.23 -1.26 -5.07 115.64 108.40 1nqt s THR 427 Ca -0.14 -0.02 0.05 0.00 -1.18 0.00 0.00 61.69 60.40 1nqt s THR 427 Cb 0.05 -3.28 0.34 0.00 1.34 0.00 0.00 72.50 70.95 1nqt s THR 427 CO 0.65 0.54 1.00 -0.38 -0.54 0.00 0.00 174.62 175.89 1nqt n ILE 428 N 1.74 3.27 0.30 2.99 2.08 -1.26 -4.82 119.36 123.67 1nqt n ILE 428 Ca -0.17 -5.61 0.17 0.00 0.56 0.00 0.00 62.75 57.70 1nqt n ILE 428 Cb 0.54 -1.43 0.74 0.00 -0.75 0.00 0.00 39.64 38.74 1nqt n ILE 428 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1nqt h PRO 429 N 3.09 0.00 -1.61 0.38 0.11 -1.91 -3.18 132.00 128.88 1nqt h PRO 429 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1nqt h PRO 429 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.60 1nqt h PRO 429 CO 0.84 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 179.07 1nqt n ILE 430 N -2.92 0.03 -3.92 4.15 -5.35 -1.26 -4.43 119.36 105.66 1nqt n ILE 430 Ca 0.00 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.18 1nqt n ILE 430 Cb 0.25 -0.43 -0.15 0.00 -1.74 0.00 0.00 39.64 37.57 1nqt n ILE 430 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1nqt s VAL 431 N 0.60 1.76 1.03 7.28 0.11 -1.20 -4.95 120.40 125.04 1nqt s VAL 431 Ca 0.00 -1.96 -0.16 0.00 -2.93 0.00 0.00 61.98 56.93 1nqt s VAL 431 Cb 0.00 -2.29 0.05 0.00 -1.53 0.00 0.00 36.38 32.60 1nqt s VAL 431 CO 0.00 -0.59 0.07 -2.65 -3.33 0.00 0.00 175.10 168.60 1nqt n PRO 432 N 4.48 -0.84 -0.43 1.54 -0.02 -1.26 -4.95 135.00 133.51 1nqt n PRO 432 Ca 0.01 -0.22 -0.18 0.00 -2.02 0.00 0.00 63.50 61.09 1nqt n PRO 432 Cb 0.42 -1.70 0.16 0.00 -0.02 0.00 0.00 33.50 32.36 1nqt n PRO 432 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1nqt n THR 433 N -3.90 0.00 -0.00 3.45 -2.24 -1.26 -4.79 114.28 105.55 1nqt n THR 433 Ca 0.03 -0.18 -0.06 0.00 -2.27 0.00 0.00 64.05 61.57 1nqt n THR 433 Cb 0.59 -0.93 -0.05 0.00 -2.10 0.00 0.00 70.33 67.84 1nqt n THR 433 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nqt h ALA 434 N -2.64 -0.12 -0.19 6.98 0.00 -2.00 -2.94 119.26 118.35 1nqt h ALA 434 Ca -0.24 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.56 1nqt h ALA 434 Cb 0.76 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1nqt h ALA 434 CO 0.15 -0.13 0.42 0.93 0.00 0.00 0.00 179.25 180.62 1nqt h GLU 435 N -0.99 0.00 0.07 0.00 3.07 -1.99 0.64 114.58 115.37 1nqt h GLU 435 Ca -0.01 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1nqt h GLU 435 Cb 0.38 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.30 1nqt h GLU 435 CO 0.02 0.00 -0.42 0.35 -1.40 0.00 0.00 179.01 177.56 1nqt h PHE 436 N 0.00 0.29 -0.16 4.33 -0.00 -1.91 -2.78 116.94 116.71 1nqt h PHE 436 Ca 0.09 -0.21 0.04 0.00 -0.00 0.00 0.00 57.97 57.89 1nqt h PHE 436 Cb 0.93 -0.01 -0.04 0.00 -0.00 0.00 0.00 35.95 36.83 1nqt h PHE 436 CO 0.00 1.15 -0.07 0.37 -0.00 0.00 0.00 178.31 179.76 1nqt h GLN 437 N -0.66 -0.05 -0.11 1.11 5.75 -0.77 0.94 115.11 121.32 1nqt h GLN 437 Ca -0.07 0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.46 1nqt h GLN 437 Cb 1.32 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.82 1nqt h GLN 437 CO 0.08 -0.03 -0.52 0.22 -2.65 0.00 0.00 178.83 175.92 1nqt h ASP 438 N -0.05 -1.66 -0.25 -0.69 3.58 -1.17 0.22 116.42 116.39 1nqt h ASP 438 Ca 0.09 0.19 0.07 0.00 0.42 0.00 0.00 57.03 57.80 1nqt h ASP 438 Cb 0.18 0.64 -0.01 0.00 1.72 0.00 0.00 39.33 41.87 1nqt h ASP 438 CO -0.19 -0.47 0.31 -0.09 -2.88 0.00 0.00 179.24 175.91 1nqt h ARG 439 N -0.58 0.00 0.08 0.28 2.43 -1.13 -1.45 114.38 114.02 1nqt h ARG 439 Ca 0.03 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.87 1nqt h ARG 439 Cb 0.66 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1nqt h ARG 439 CO -0.41 0.00 -1.78 0.82 -1.51 0.00 0.00 179.97 177.09 1nqt h ILE 440 N 0.00 0.83 -0.38 1.20 2.04 0.62 -3.14 117.51 118.68 1nqt h ILE 440 Ca 0.12 -2.58 0.00 0.00 1.00 0.00 0.00 64.86 63.40 1nqt h ILE 440 Cb 0.73 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.35 1nqt h ILE 440 CO -0.00 0.74 0.00 -1.20 0.00 0.00 0.00 178.15 177.69 1nqt n SER 441 N -3.32 3.63 -0.22 1.72 7.64 0.62 -3.73 113.62 119.96 1nqt n SER 441 Ca -0.23 -2.45 0.00 0.00 1.01 0.00 0.00 58.87 57.20 1nqt n SER 441 Cb 1.05 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1nqt n SER 441 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nqt n GLY 442 N 0.58 -0.34 3.62 0.23 0.00 -0.85 -5.03 105.19 103.40 1nqt n GLY 442 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1nqt n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 443 N 0.00 0.17 -3.53 4.61 0.00 -1.19 -4.97 120.51 115.60 1nqt n ALA 443 Ca 0.00 0.39 -0.08 0.00 0.00 0.00 0.00 53.44 53.75 1nqt n ALA 443 Cb 0.55 -2.08 -0.04 0.00 0.00 0.00 0.00 19.45 17.88 1nqt n ALA 443 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nqt s SER 444 N -0.45 -0.19 0.21 0.00 1.04 -1.26 -5.05 113.70 108.00 1nqt s SER 444 Ca 0.59 -0.73 -0.09 0.00 0.48 0.00 0.00 55.95 56.20 1nqt s SER 444 Cb -0.67 0.66 0.29 0.00 0.10 0.00 0.00 66.02 66.40 1nqt s SER 444 CO 0.60 -1.24 1.75 -0.08 0.98 0.00 0.00 173.24 175.25 1nqt h GLU 445 N 2.12 0.43 -0.77 4.02 4.81 -1.94 -2.01 114.58 121.24 1nqt h GLU 445 Ca -0.23 -0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.08 1nqt h GLU 445 Cb 1.25 -0.10 -0.11 0.00 0.63 0.00 0.00 28.75 30.42 1nqt h GLU 445 CO 0.29 0.28 -0.35 1.17 -0.73 0.00 0.00 179.01 179.67 1nqt n LYS 446 N -4.98 -0.23 -0.12 1.92 4.81 -1.26 0.08 118.16 118.39 1nqt n LYS 446 Ca 0.09 1.18 -0.05 0.00 -0.87 0.00 0.00 58.31 58.66 1nqt n LYS 446 Cb 0.28 -1.74 0.01 0.00 0.02 0.00 0.00 35.03 33.60 1nqt n LYS 446 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1nqt h ASP 447 N 0.00 -0.45 0.48 3.14 5.19 -1.72 0.91 116.42 123.97 1nqt h ASP 447 Ca 0.22 0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 56.74 1nqt h ASP 447 Cb 0.41 0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.21 1nqt h ASP 447 CO -0.75 -0.16 -0.23 0.40 -3.12 0.00 0.00 179.24 175.38 1nqt h ILE 448 N -0.03 0.00 0.00 0.35 1.08 -0.33 -2.01 117.51 116.57 1nqt h ILE 448 Ca 0.19 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.61 1nqt h ILE 448 Cb 0.33 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.08 1nqt h ILE 448 CO -0.43 0.00 0.00 0.52 -0.69 0.00 0.00 178.15 177.55 1nqt n VAL 449 N -3.88 0.00 -0.31 1.67 0.31 0.11 -0.65 118.33 115.59 1nqt n VAL 449 Ca -0.08 1.18 -0.01 0.00 -0.01 0.00 0.00 64.34 65.43 1nqt n VAL 449 Cb 0.25 -1.60 0.04 0.00 -0.91 0.00 0.00 33.84 31.62 1nqt n VAL 449 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1nqt n HIS 450 N -2.54 0.04 0.14 3.52 8.25 0.31 0.27 115.22 125.21 1nqt n HIS 450 Ca 0.00 0.99 -0.14 0.00 -0.26 0.00 0.00 57.72 58.31 1nqt n HIS 450 Cb 0.00 -0.81 -0.06 0.00 1.12 0.00 0.00 29.99 30.24 1nqt n HIS 450 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1nqt h SER 451 N 0.00 -0.84 -0.73 0.41 0.87 -0.10 -0.36 113.55 112.79 1nqt h SER 451 Ca 0.28 0.09 0.16 0.00 -1.23 0.00 0.00 61.79 61.10 1nqt h SER 451 Cb 0.48 0.31 -0.11 0.00 -0.44 0.00 0.00 62.40 62.64 1nqt h SER 451 CO -0.80 -0.40 0.15 1.23 -0.53 0.00 0.00 176.83 176.48 1nqt h GLY 452 N -0.55 0.99 0.68 5.77 0.00 0.20 0.10 103.07 110.26 1nqt h GLY 452 Ca 0.02 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.37 1nqt h GLY 452 CO -0.14 -0.22 0.00 -2.00 0.00 0.00 0.00 176.54 174.18 1nqt h LEU 453 N 0.23 -0.07 0.38 3.11 6.46 -0.22 -1.41 115.31 123.79 1nqt h LEU 453 Ca 0.41 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 58.21 1nqt h LEU 453 Cb 0.72 0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.70 1nqt h LEU 453 CO -0.54 -0.01 -0.47 0.00 -0.62 0.00 0.00 178.44 176.81 1nqt h ALA 454 N 1.18 -1.09 -0.68 1.25 0.00 0.85 -1.22 119.26 119.55 1nqt h ALA 454 Ca 0.10 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.93 1nqt h ALA 454 Cb 0.12 0.73 -0.11 0.00 0.00 0.00 0.00 17.79 18.54 1nqt h ALA 454 CO -0.16 -1.13 -0.53 -0.92 0.00 0.00 0.00 179.25 176.50 1nqt h TYR 455 N -0.87 -1.63 -0.14 0.00 5.03 -0.99 0.32 116.97 118.68 1nqt h TYR 455 Ca -0.05 0.10 0.02 0.00 2.58 0.00 0.00 58.73 61.38 1nqt h TYR 455 Cb 0.77 0.80 -0.03 0.00 1.55 0.00 0.00 36.73 39.83 1nqt h TYR 455 CO -0.28 -0.43 -0.18 1.15 -1.32 0.00 0.00 178.16 177.10 1nqt h THR 456 N -0.20 0.00 -0.96 1.81 2.02 -1.00 0.13 112.91 114.71 1nqt h THR 456 Ca 0.14 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.55 1nqt h THR 456 Cb 0.53 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 66.76 1nqt h THR 456 CO -0.76 0.00 -0.10 0.24 0.37 0.00 0.00 175.52 175.28 1nqt h MET 457 N -0.12 0.01 0.05 6.66 2.86 -0.12 0.11 114.93 124.39 1nqt h MET 457 Ca 0.02 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1nqt h MET 457 Cb 0.18 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1nqt h MET 457 CO -0.20 0.01 -0.02 1.49 1.06 0.00 0.00 176.91 179.25 1nqt h GLU 458 N 0.01 -0.06 -0.71 1.72 4.81 -0.02 0.76 114.58 121.09 1nqt h GLU 458 Ca 0.52 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.86 1nqt h GLU 458 Cb 0.94 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 30.22 1nqt h GLU 458 CO -0.93 -0.04 -0.28 -2.13 -0.73 0.00 0.00 179.01 174.89 1nqt n ARG 459 N -2.20 -0.17 -0.01 1.92 0.63 0.37 0.94 116.66 118.14 1nqt n ARG 459 Ca -0.01 1.09 -0.11 0.00 -0.92 0.00 0.00 57.85 57.91 1nqt n ARG 459 Cb 0.03 -1.62 -0.05 0.00 0.45 0.00 0.00 32.46 31.26 1nqt n ARG 459 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1nqt h SER 460 N 0.00 0.13 -0.27 6.15 0.87 -0.77 -1.57 113.55 118.09 1nqt h SER 460 Ca 0.24 -0.04 0.07 0.00 -1.23 0.00 0.00 61.79 60.83 1nqt h SER 460 Cb 0.42 -0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 62.27 1nqt h SER 460 CO -0.71 0.13 -0.29 0.00 -0.53 0.00 0.00 176.83 175.44 1nqt h ALA 461 N 1.01 -0.20 -0.62 6.23 0.00 0.31 0.21 119.26 126.19 1nqt h ALA 461 Ca 0.04 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.14 1nqt h ALA 461 Cb 0.02 0.60 -0.09 0.00 0.00 0.00 0.00 17.79 18.32 1nqt h ALA 461 CO -0.01 -0.72 0.12 0.00 0.00 0.00 0.00 179.25 178.65 1nqt h ARG 462 N -0.28 0.24 -0.23 0.00 2.47 -0.82 0.32 114.38 116.08 1nqt h ARG 462 Ca 0.14 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.85 1nqt h ARG 462 Cb 0.51 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 1nqt h ARG 462 CO -0.43 0.16 0.15 1.96 0.56 0.00 0.00 179.97 182.37 1nqt h GLN 463 N 0.25 0.30 0.39 0.04 4.20 0.28 0.51 115.11 121.08 1nqt h GLN 463 Ca 0.33 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 1nqt h GLN 463 Cb 0.50 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1nqt h GLN 463 CO -0.43 0.20 -0.19 0.82 -0.67 0.00 0.00 178.83 178.57 1nqt h ILE 464 N 0.31 0.39 0.00 2.54 2.04 0.22 -2.48 117.51 120.53 1nqt h ILE 464 Ca 0.09 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1nqt h ILE 464 Cb -0.03 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1nqt h ILE 464 CO -0.02 0.08 0.00 0.23 0.00 0.00 0.00 178.15 178.44 1nqt n MET 465 N -5.15 0.00 -0.16 2.37 2.81 0.11 -0.92 117.12 116.19 1nqt n MET 465 Ca -0.09 0.21 0.05 0.00 -1.81 0.00 0.00 57.70 56.07 1nqt n MET 465 Cb 0.28 -0.71 0.11 0.00 -0.71 0.00 0.00 33.22 32.18 1nqt n MET 465 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1nqt n ARG 466 N -0.43 -0.04 -0.02 0.03 1.74 0.09 0.28 116.66 118.33 1nqt n ARG 466 Ca 0.00 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 1nqt n ARG 466 Cb 0.00 -1.04 0.01 0.00 -1.02 0.00 0.00 32.46 30.40 1nqt n ARG 466 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1nqt n THR 467 N -4.56 0.06 -0.02 0.55 -1.04 -0.10 -0.96 114.28 108.22 1nqt n THR 467 Ca 0.09 -0.03 -0.06 0.00 -2.04 0.00 0.00 64.05 62.01 1nqt n THR 467 Cb 0.30 -0.37 -0.02 0.00 -1.82 0.00 0.00 70.33 68.42 1nqt n THR 467 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nqt n ALA 468 N -0.10 2.46 0.17 2.41 0.00 0.81 -4.40 120.51 121.87 1nqt n ALA 468 Ca 0.01 -0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.28 1nqt n ALA 468 Cb 0.21 0.31 0.60 0.00 0.00 0.00 0.00 19.45 20.57 1nqt n ALA 468 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1nqt h MET 469 N -0.28 0.00 0.12 0.00 -1.53 -1.09 -0.91 114.93 111.24 1nqt h MET 469 Ca -0.11 0.00 -0.32 0.00 -3.44 0.00 0.00 59.70 55.82 1nqt h MET 469 Cb 0.80 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.84 1nqt h MET 469 CO -0.07 0.00 -1.70 -0.22 0.14 0.00 0.00 176.91 175.06 1nqt h LYS 470 N 0.00 0.26 -1.57 0.39 3.64 -1.29 -3.34 116.57 114.67 1nqt h LYS 470 Ca 0.00 -0.44 -0.71 0.00 -1.27 0.00 0.00 60.65 58.23 1nqt h LYS 470 Cb 0.08 0.17 -0.30 0.00 -0.41 0.00 0.00 32.23 31.76 1nqt h LYS 470 CO 0.00 1.21 0.70 0.66 -2.27 0.00 0.00 179.45 179.76 1nqt n TYR 471 N -3.74 3.09 -0.21 1.91 4.01 -0.55 -4.93 117.16 116.75 1nqt n TYR 471 Ca -0.28 -2.62 0.00 0.00 -0.16 0.00 0.00 57.90 54.84 1nqt n TYR 471 Cb 0.97 -1.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.90 1nqt n TYR 471 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1nqt n ASN 472 N -0.66 0.00 -3.21 7.72 4.05 -0.59 -4.84 115.26 117.74 1nqt n ASN 472 Ca 0.55 0.00 -0.25 0.00 0.45 0.00 0.00 54.58 55.33 1nqt n ASN 472 Cb 0.45 0.00 0.24 0.00 1.23 0.00 0.00 39.78 41.70 1nqt n ASN 472 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1nqt n LEU 473 N 0.00 0.00 0.00 1.20 4.32 -0.46 -4.94 117.00 117.12 1nqt n LEU 473 Ca 0.00 -0.71 0.00 0.00 -0.02 0.00 0.00 56.01 55.28 1nqt n LEU 473 Cb 0.00 -0.83 0.00 0.00 -1.62 0.00 0.00 43.42 40.97 1nqt n LEU 473 CO 0.00 -2.62 0.00 0.61 -1.22 0.00 0.00 177.39 174.16 1nqt n GLY 474 N -4.59 1.02 1.57 -0.72 0.00 -1.26 -4.67 105.19 96.55 1nqt n GLY 474 Ca 0.11 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.17 1nqt n GLY 474 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nqt n LEU 475 N 0.00 5.15 -1.95 0.99 4.32 -1.26 -4.61 117.00 119.64 1nqt n LEU 475 Ca 0.00 -2.96 -0.12 0.00 -0.02 0.00 0.00 56.01 52.91 1nqt n LEU 475 Cb 0.00 -0.64 -0.09 0.00 -1.62 0.00 0.00 43.42 41.07 1nqt n LEU 475 CO 0.00 0.65 1.42 -0.67 -1.22 0.00 0.00 177.39 177.57 1nqt n ASP 476 N 0.26 5.61 -0.33 -1.43 2.03 -1.26 -3.96 116.55 117.47 1nqt n ASP 476 Ca 0.26 -2.65 0.04 0.00 0.52 0.00 0.00 54.79 52.96 1nqt n ASP 476 Cb 1.10 -1.28 0.10 0.00 -0.72 0.00 0.00 41.12 40.33 1nqt n ASP 476 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1nqt n LEU 477 N 1.75 -0.39 0.00 -2.67 4.32 -1.26 -1.20 117.00 117.55 1nqt n LEU 477 Ca 0.32 1.55 0.00 0.00 -0.02 0.00 0.00 56.01 57.86 1nqt n LEU 477 Cb 0.72 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 42.08 1nqt n LEU 477 CO 0.15 -1.46 0.47 -1.14 -1.22 0.00 0.00 177.39 174.19 1nqt n ARG 478 N -5.43 0.00 0.25 3.23 0.63 -1.26 -0.72 116.66 113.36 1nqt n ARG 478 Ca 0.13 0.81 0.17 0.00 -0.92 0.00 0.00 57.85 58.04 1nqt n ARG 478 Cb 0.43 -1.44 0.86 0.00 0.45 0.00 0.00 32.46 32.75 1nqt n ARG 478 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1nqt h THR 479 N 0.00 0.00 0.00 5.15 1.35 -1.67 0.49 112.91 118.23 1nqt h THR 479 Ca 0.00 -0.09 -0.09 0.00 -0.55 0.00 0.00 66.41 65.68 1nqt h THR 479 Cb 0.00 0.88 -0.01 0.00 -1.73 0.00 0.00 68.15 67.29 1nqt h THR 479 CO 0.00 0.00 -0.44 0.00 -0.25 0.00 0.00 175.52 174.83 1nqt h ALA 480 N 2.03 0.91 0.02 6.62 0.00 0.56 -2.17 119.26 127.22 1nqt h ALA 480 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1nqt h ALA 480 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1nqt h ALA 480 CO 0.00 0.54 -0.01 0.00 0.00 0.00 0.00 179.25 179.78 1nqt h ALA 481 N 1.56 -0.07 -0.92 0.00 0.00 0.21 -2.04 119.26 118.00 1nqt h ALA 481 Ca -0.00 -0.01 0.27 0.00 0.00 0.00 0.00 54.91 55.17 1nqt h ALA 481 Cb 1.03 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1nqt h ALA 481 CO 0.06 -0.07 0.92 1.88 0.00 0.00 0.00 179.25 182.04 1nqt h TYR 482 N -0.29 0.00 -0.02 0.00 0.05 -1.37 2.00 116.97 117.35 1nqt h TYR 482 Ca -0.00 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1nqt h TYR 482 Cb 0.02 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.77 1nqt h TYR 482 CO 0.01 0.00 -0.28 0.28 -1.05 0.00 0.00 178.16 177.12 1nqt h VAL 483 N 0.00 1.51 -0.36 -2.88 2.07 -1.42 -1.69 116.25 113.47 1nqt h VAL 483 Ca 0.44 -1.88 0.08 0.00 0.82 0.00 0.00 66.70 66.15 1nqt h VAL 483 Cb 2.28 2.64 -0.09 0.00 -1.52 0.00 0.00 31.29 34.61 1nqt h VAL 483 CO -0.00 0.52 -0.25 -1.13 0.02 0.00 0.00 177.57 176.73 1nqt h ASN 484 N -0.40 -0.83 0.00 0.57 -1.24 0.38 0.10 115.58 114.16 1nqt h ASN 484 Ca -0.03 0.16 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1nqt h ASN 484 Cb 1.00 0.41 0.00 0.00 0.73 0.00 0.00 38.32 40.47 1nqt h ASN 484 CO 0.06 -0.27 0.00 0.00 -1.29 0.00 0.00 177.43 175.92 1nqt n ALA 485 N -2.91 -0.26 -0.29 1.57 0.00 0.75 -2.29 120.51 117.08 1nqt n ALA 485 Ca 0.01 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.68 1nqt n ALA 485 Cb 0.31 0.19 0.42 0.00 0.00 0.00 0.00 19.45 20.37 1nqt n ALA 485 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1nqt n ILE 486 N -2.19 -0.37 0.21 0.00 2.08 -0.64 0.79 119.36 119.24 1nqt n ILE 486 Ca 0.00 1.86 -0.15 0.00 0.56 0.00 0.00 62.75 65.02 1nqt n ILE 486 Cb 0.00 -2.90 -0.07 0.00 -0.75 0.00 0.00 39.64 35.92 1nqt n ILE 486 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1nqt h GLU 487 N 0.00 -0.69 0.18 0.38 5.08 -0.56 -0.57 114.58 118.41 1nqt h GLU 487 Ca 0.67 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 59.08 1nqt h GLU 487 Cb 1.65 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 31.02 1nqt h GLU 487 CO -0.74 -0.46 -0.43 0.87 -1.00 0.00 0.00 179.01 177.25 1nqt h LYS 488 N -0.71 -0.65 -0.80 2.33 1.57 0.68 0.24 116.57 119.23 1nqt h LYS 488 Ca -0.02 0.04 0.19 0.00 -1.87 0.00 0.00 60.65 59.00 1nqt h LYS 488 Cb 0.65 0.15 -0.13 0.00 0.08 0.00 0.00 32.23 32.97 1nqt h LYS 488 CO -0.08 -0.43 0.10 0.28 -0.57 0.00 0.00 179.45 178.76 1nqt h VAL 489 N -0.67 0.34 -0.51 0.50 2.07 -1.44 0.18 116.25 116.72 1nqt h VAL 489 Ca -0.02 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 1nqt h VAL 489 Cb 0.65 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1nqt h VAL 489 CO -0.19 0.03 0.07 0.15 0.02 0.00 0.00 177.57 177.65 1nqt h PHE 490 N 0.16 0.91 -0.05 1.57 3.57 -0.22 -2.14 116.94 120.73 1nqt h PHE 490 Ca 0.47 -0.13 0.03 0.00 3.53 0.00 0.00 57.97 61.86 1nqt h PHE 490 Cb 0.87 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1nqt h PHE 490 CO -0.35 0.82 -0.12 -0.22 -2.23 0.00 0.00 178.31 176.21 1nqt h LYS 491 N 0.72 -0.17 -0.29 1.11 3.64 0.25 0.82 116.57 122.65 1nqt h LYS 491 Ca 0.15 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.61 1nqt h LYS 491 Cb 0.41 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1nqt h LYS 491 CO 0.01 -0.11 -0.14 0.28 -2.27 0.00 0.00 179.45 177.22 1nqt h VAL 492 N -0.17 0.56 0.16 2.00 2.07 -1.21 0.10 116.25 119.75 1nqt h VAL 492 Ca 0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1nqt h VAL 492 Cb 0.26 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1nqt h VAL 492 CO -0.15 0.00 -0.07 1.88 0.02 0.00 0.00 177.57 179.24 1nqt h TYR 493 N -0.10 -0.19 0.18 1.57 0.05 -0.80 -3.15 116.97 114.53 1nqt h TYR 493 Ca 0.15 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.94 1nqt h TYR 493 Cb 0.33 0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.10 1nqt h TYR 493 CO -0.34 -0.11 -0.35 -0.97 -1.05 0.00 0.00 178.16 175.35 1nqt h ASN 494 N -0.23 -0.99 0.00 3.88 -0.00 0.13 -2.40 115.58 115.97 1nqt h ASN 494 Ca -0.02 0.11 -0.00 0.00 -0.00 0.00 0.00 56.30 56.38 1nqt h ASN 494 Cb 0.17 0.36 -0.00 0.00 -0.00 0.00 0.00 38.32 38.85 1nqt h ASN 494 CO 0.04 -0.45 0.02 -0.62 -0.00 0.00 0.00 177.43 176.41 1nqt n GLU 495 N -5.44 0.36 0.00 6.67 1.02 0.30 -3.41 120.64 120.14 1nqt n GLU 495 Ca -0.08 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1nqt n GLU 495 Cb 0.35 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1nqt n GLU 495 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nqt n ALA 496 N 1.91 0.00 0.00 0.62 0.00 -1.17 -5.01 120.51 116.86 1nqt n ALA 496 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1nqt n ALA 496 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.63 1nqt n ALA 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nqt n GLY 497 N -0.87 -0.69 0.00 0.00 0.00 -0.91 -4.08 105.19 98.63 1nqt n GLY 497 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1nqt n GLY 497 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1nqt n VAL 498 N 0.00 0.00 0.06 1.61 0.24 -1.26 -4.71 118.33 114.27 1nqt n VAL 498 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 1nqt n VAL 498 Cb 0.00 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.23 1nqt n VAL 498 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nqt h THR 499 N 0.00 1.19 -2.32 3.34 1.03 -2.02 -3.24 112.91 110.88 1nqt h THR 499 Ca 0.00 -2.84 -0.72 0.00 -0.01 0.00 0.00 66.41 62.85 1nqt h THR 499 Cb 0.00 2.77 -0.33 0.00 -1.07 0.00 0.00 68.15 69.52 1nqt h THR 499 CO 0.00 0.82 0.30 0.49 -0.01 0.00 0.00 175.52 177.12 1nqt n PHE 500 N -3.45 3.24 1.13 0.00 3.01 -1.26 -5.27 117.46 114.87 1nqt n PHE 500 Ca -0.15 -3.18 0.13 0.00 1.01 0.00 0.00 57.45 55.25 1nqt n PHE 500 Cb 1.04 -0.91 0.21 0.00 -0.01 0.00 0.00 39.48 39.81 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40