#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nqt s PRO 7 N 0.00 1.04 -0.08 0.11 0.02 -1.26 -5.06 135.00 129.77 1nqt s PRO 7 Ca 0.00 -0.18 -0.11 0.00 0.02 0.00 0.00 61.00 60.73 1nqt s PRO 7 Cb 0.00 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.60 1nqt s PRO 7 CO 0.00 -2.18 0.26 -0.80 -0.33 0.00 0.00 177.00 173.95 1nqt s ASN 8 N -4.70 6.55 0.18 2.53 0.01 -1.26 -4.96 114.94 113.28 1nqt s ASN 8 Ca 0.69 0.65 0.16 0.00 -0.71 0.00 0.00 52.86 53.66 1nqt s ASN 8 Cb -0.07 -2.15 0.57 0.00 0.41 0.00 0.00 41.25 40.00 1nqt s ASN 8 CO 0.52 0.34 0.51 2.22 -1.51 0.00 0.00 177.10 179.17 1nqt n PHE 9 N 2.14 0.00 0.13 2.20 1.16 -1.26 0.31 117.46 122.14 1nqt n PHE 9 Ca -0.17 0.00 -0.06 0.00 -1.87 0.00 0.00 57.45 55.35 1nqt n PHE 9 Cb 0.54 -0.16 -0.03 0.00 -1.61 0.00 0.00 39.48 38.21 1nqt n PHE 9 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1nqt h PHE 10 N 0.00 -0.36 0.00 2.97 3.57 -1.93 -2.62 116.94 118.57 1nqt h PHE 10 Ca 0.31 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1nqt h PHE 10 Cb 1.23 0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.09 1nqt h PHE 10 CO -0.00 -0.22 0.00 1.63 -2.23 0.00 0.00 178.31 177.49 1nqt n LYS 11 N -4.25 0.03 -0.06 1.11 4.76 0.15 -0.59 118.16 119.30 1nqt n LYS 11 Ca -0.05 0.45 -0.03 0.00 -2.87 0.00 0.00 58.31 55.81 1nqt n LYS 11 Cb 0.15 -1.58 -0.01 0.00 -1.84 0.00 0.00 35.03 31.76 1nqt n LYS 11 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 1nqt h MET 12 N 0.00 0.00 -0.09 1.97 2.86 -1.52 -3.12 114.93 115.03 1nqt h MET 12 Ca 0.00 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1nqt h MET 12 Cb 0.09 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.69 1nqt h MET 12 CO 0.00 0.00 -0.24 0.28 1.06 0.00 0.00 176.91 178.01 1nqt h VAL 13 N -0.99 0.42 -0.76 -2.22 2.07 -1.12 0.31 116.25 113.95 1nqt h VAL 13 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1nqt h VAL 13 Cb 0.32 0.42 -0.14 0.00 -1.52 0.00 0.00 31.29 30.36 1nqt h VAL 13 CO 0.00 0.00 -0.18 -0.08 0.02 0.00 0.00 177.57 177.33 1nqt h GLU 14 N -0.33 0.01 0.54 1.57 4.81 -1.04 0.18 114.58 120.31 1nqt h GLU 14 Ca 0.09 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1nqt h GLU 14 Cb 0.46 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1nqt h GLU 14 CO -0.28 0.00 -0.38 0.78 -0.73 0.00 0.00 179.01 178.40 1nqt h GLY 15 N 0.01 -1.11 -1.09 1.92 0.00 -0.74 -0.11 103.07 101.94 1nqt h GLY 15 Ca 0.37 0.47 0.44 0.00 0.00 0.00 0.00 47.33 48.61 1nqt h GLY 15 CO -0.78 -0.37 1.01 0.74 0.00 0.00 0.00 176.54 177.15 1nqt h PHE 16 N -0.87 0.24 0.11 5.60 -1.00 0.16 0.18 116.94 121.36 1nqt h PHE 16 Ca -0.07 0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.71 1nqt h PHE 16 Cb 0.72 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.22 1nqt h PHE 16 CO -0.11 -0.06 -0.05 0.35 -1.61 0.00 0.00 178.31 176.83 1nqt h PHE 17 N 0.07 -0.14 -1.15 -0.55 3.57 -0.17 -2.85 116.94 115.72 1nqt h PHE 17 Ca 0.77 -0.00 0.33 0.00 3.53 0.00 0.00 57.97 62.60 1nqt h PHE 17 Cb 2.76 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 41.50 1nqt h PHE 17 CO -0.00 -0.09 0.97 -0.44 -2.23 0.00 0.00 178.31 176.52 1nqt h ASP 18 N -0.35 0.00 -0.00 0.41 3.32 0.10 0.46 116.42 120.35 1nqt h ASP 18 Ca -0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1nqt h ASP 18 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1nqt h ASP 18 CO 0.03 0.00 -0.03 -0.09 -1.72 0.00 0.00 179.24 177.42 1nqt h ARG 19 N 0.00 0.03 -0.13 3.56 1.12 -0.81 -2.88 114.38 115.27 1nqt h ARG 19 Ca 0.54 -0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 59.37 1nqt h ARG 19 Cb 2.47 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 32.43 1nqt h ARG 19 CO -0.01 0.73 -0.00 0.78 -3.11 0.00 0.00 179.97 178.37 1nqt h GLY 20 N -0.67 0.24 -0.97 2.80 0.00 -0.43 -2.77 103.07 101.28 1nqt h GLY 20 Ca -0.00 -0.18 0.10 0.00 0.00 0.00 0.00 47.33 47.25 1nqt h GLY 20 CO 0.01 0.17 -0.52 0.00 0.00 0.00 0.00 176.54 176.19 1nqt n ALA 21 N -2.30 -0.49 0.35 3.60 0.00 0.13 -0.50 120.51 121.29 1nqt n ALA 21 Ca -0.06 0.86 -0.18 0.00 0.00 0.00 0.00 53.44 54.07 1nqt n ALA 21 Cb 0.21 -0.21 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -0.94 -0.33 0.00 4.64 -1.53 -0.28 113.55 115.11 1nqt h SER 22 Ca 0.20 0.05 0.10 0.00 -0.47 0.00 0.00 61.79 61.67 1nqt h SER 22 Cb 0.44 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 1nqt h SER 22 CO -0.92 -0.59 0.69 0.40 -0.87 0.00 0.00 176.83 175.54 1nqt h ILE 23 N -0.94 0.10 0.00 0.95 2.04 -0.73 -2.04 117.51 116.89 1nqt h ILE 23 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1nqt h ILE 23 Cb 0.76 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1nqt h ILE 23 CO 0.08 0.00 -0.55 0.52 0.00 0.00 0.00 178.15 178.20 1nqt n VAL 24 N -3.11 1.27 0.00 1.67 0.31 0.34 -4.63 118.33 114.19 1nqt n VAL 24 Ca 0.06 0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.63 1nqt n VAL 24 Cb 0.82 -2.28 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 1nqt n VAL 24 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1nqt n GLU 25 N -4.32 0.00 0.00 5.55 2.13 -0.17 -1.14 120.64 122.69 1nqt n GLU 25 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1nqt n GLU 25 Cb 0.29 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.00 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 -0.68 0.00 -0.19 4.31 8.00 -1.25 -1.49 116.55 125.25 1nqt n ASP 26 Ca 0.00 0.71 0.29 0.00 0.71 0.00 0.00 54.79 56.51 1nqt n ASP 26 Cb 0.00 -0.21 0.73 0.00 -0.02 0.00 0.00 41.12 41.61 1nqt n ASP 26 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1nqt h LYS 27 N 0.00 0.00 -1.97 -1.24 1.79 -1.39 -1.56 116.57 112.19 1nqt h LYS 27 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1nqt h LYS 27 Cb 0.00 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 1nqt h LYS 27 CO 0.00 0.00 -0.03 -0.11 -1.08 0.00 0.00 179.45 178.23 1nqt n LEU 28 N -4.19 5.41 0.00 2.94 7.94 -0.50 -3.45 117.00 125.15 1nqt n LEU 28 Ca 0.19 -2.60 0.00 0.00 -1.11 0.00 0.00 56.01 52.49 1nqt n LEU 28 Cb 1.00 -1.17 0.00 0.00 0.53 0.00 0.00 43.42 43.78 1nqt n LEU 28 CO 0.38 1.14 0.00 0.52 -1.11 0.00 0.00 177.39 178.32 1nqt n VAL 29 N 1.58 0.00 -0.19 1.96 0.31 -0.60 -4.87 118.33 116.52 1nqt n VAL 29 Ca 0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.39 1nqt n VAL 29 Cb 0.57 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.53 1nqt n VAL 29 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1nqt h GLU 30 N 0.00 -0.10 -0.02 5.55 4.11 -1.63 -1.13 114.58 121.36 1nqt h GLU 30 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1nqt h GLU 30 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1nqt h GLU 30 CO 0.00 -0.07 -0.31 -0.25 0.07 0.00 0.00 179.01 178.45 1nqt n ASP 31 N -5.43 1.99 -0.78 3.06 8.00 -1.23 -3.30 116.55 118.85 1nqt n ASP 31 Ca 0.05 -1.49 0.03 0.00 0.71 0.00 0.00 54.79 54.09 1nqt n ASP 31 Cb 0.34 0.37 0.20 0.00 -0.02 0.00 0.00 41.12 42.01 1nqt n ASP 31 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1nqt n LEU 32 N 0.18 3.31 0.00 0.64 7.94 -1.09 -4.80 117.00 123.18 1nqt n LEU 32 Ca 0.09 -3.69 0.00 0.00 -1.11 0.00 0.00 56.01 51.30 1nqt n LEU 32 Cb 0.42 -0.56 0.00 0.00 0.53 0.00 0.00 43.42 43.81 1nqt n LEU 32 CO 0.21 1.21 0.00 -2.11 -1.11 0.00 0.00 177.39 175.59 1nqt n ARG 33 N -1.12 0.00 -2.54 1.96 1.85 -0.46 -4.70 116.66 111.65 1nqt n ARG 33 Ca 0.24 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.66 1nqt n ARG 33 Cb 0.83 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.24 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 3.96 0.00 8.89 -1.04 -1.00 -3.25 114.28 121.84 1nqt n THR 34 Ca 0.00 -4.11 0.00 0.00 -2.04 0.00 0.00 64.05 57.90 1nqt n THR 34 Cb 0.00 -2.40 0.00 0.00 -1.82 0.00 0.00 70.33 66.11 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 7.44 0.00 0.02 -2.82 1.74 -1.26 -4.86 116.66 116.92 1nqt n ARG 35 Ca 0.47 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.44 1nqt n ARG 35 Cb 0.44 -0.10 -0.14 0.00 -1.02 0.00 0.00 32.46 31.64 1nqt n ARG 35 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 1nqt h GLU 36 N 0.00 0.07 0.00 5.56 4.11 -2.00 -3.50 114.58 118.82 1nqt h GLU 36 Ca 0.00 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 59.30 1nqt h GLU 36 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1nqt h GLU 36 CO 0.00 0.81 0.00 -1.13 0.07 0.00 0.00 179.01 178.76 1nqt n SER 37 N -3.25 0.00 -3.68 3.06 3.41 -1.25 -4.97 113.62 106.94 1nqt n SER 37 Ca -0.13 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.18 1nqt n SER 37 Cb 1.02 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.82 1nqt n SER 37 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1nqt s GLU 38 N 0.00 0.55 0.00 4.33 2.02 -1.26 -4.84 118.70 119.50 1nqt s GLU 38 Ca 0.00 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.09 1nqt s GLU 38 Cb 0.00 -1.74 0.00 0.00 0.10 0.00 0.00 34.13 32.49 1nqt s GLU 38 CO 0.00 -0.99 0.00 -1.91 0.02 0.00 0.00 175.26 172.38 1nqt n GLU 39 N 4.97 0.00 -1.82 1.61 2.13 -1.26 -2.94 120.64 123.33 1nqt n GLU 39 Ca -0.03 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.64 1nqt n GLU 39 Cb 0.42 -2.43 -0.04 0.00 0.27 0.00 0.00 31.44 29.66 1nqt n GLU 39 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1nqt n GLN 40 N -1.97 -1.11 -0.91 5.31 0.00 -1.26 -4.79 117.38 112.65 1nqt n GLN 40 Ca 0.00 0.89 0.03 0.00 -0.00 0.00 0.00 57.00 57.92 1nqt n GLN 40 Cb 0.00 -5.12 0.36 0.00 0.00 0.00 0.00 30.24 25.48 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1nqt n LYS 41 N -2.51 4.41 0.08 3.69 4.76 -1.15 -3.70 118.16 123.74 1nqt n LYS 41 Ca -0.16 -3.01 -0.10 0.00 -2.87 0.00 0.00 58.31 52.17 1nqt n LYS 41 Cb 0.56 -2.23 -0.06 0.00 -1.84 0.00 0.00 35.03 31.46 1nqt n LYS 41 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1nqt h ARG 42 N 3.44 0.19 -0.37 1.97 2.47 -1.87 -2.47 114.38 117.74 1nqt h ARG 42 Ca 0.08 -0.25 0.11 0.00 -1.26 0.00 0.00 59.98 58.67 1nqt h ARG 42 Cb 2.05 0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 30.43 1nqt h ARG 42 CO 0.56 1.03 0.33 -0.97 0.56 0.00 0.00 179.97 181.48 1nqt h ASN 43 N 0.08 0.00 0.13 7.04 -1.24 -1.96 1.27 115.58 120.90 1nqt h ASN 43 Ca -0.06 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.95 1nqt h ASN 43 Cb 1.67 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.72 1nqt h ASN 43 CO 0.15 0.00 -0.04 -1.14 -1.29 0.00 0.00 177.43 175.12 1nqt n ARG 44 N -4.02 1.06 -0.29 6.67 3.00 -0.93 -2.99 116.66 119.16 1nqt n ARG 44 Ca 0.06 -0.33 0.07 0.00 -0.00 0.00 0.00 57.85 57.64 1nqt n ARG 44 Cb 0.51 -1.49 0.21 0.00 0.00 0.00 0.00 32.46 31.68 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1nqt n VAL 45 N -0.68 0.81 0.32 5.15 3.14 0.44 -3.69 118.33 123.82 1nqt n VAL 45 Ca 0.19 -0.65 -0.04 0.00 -2.96 0.00 0.00 64.34 60.89 1nqt n VAL 45 Cb 0.23 0.16 0.08 0.00 -1.06 0.00 0.00 33.84 33.26 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 0.72 1.71 0.05 1.45 1.85 -1.16 -2.63 116.66 118.65 1nqt n ARG 46 Ca 0.15 -0.99 0.11 0.00 -1.00 0.00 0.00 57.85 56.13 1nqt n ARG 46 Cb 0.47 -1.51 -0.04 0.00 -1.05 0.00 0.00 32.46 30.32 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 0.05 -1.26 0.35 2.89 0.00 -1.24 -3.58 105.19 102.40 1nqt n GLY 47 Ca 0.16 -0.37 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.02 -0.61 2.04 -1.82 0.35 117.51 118.68 1nqt h ILE 48 Ca 0.00 -0.61 -0.14 0.00 1.00 0.00 0.00 64.86 65.11 1nqt h ILE 48 Cb 0.92 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1nqt h ILE 48 CO 0.00 0.27 -0.65 -0.07 0.00 0.00 0.00 178.15 177.70 1nqt h LEU 49 N 1.12 0.12 -1.87 1.44 4.07 -1.81 0.27 115.31 118.65 1nqt h LEU 49 Ca 0.28 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 1nqt h LEU 49 Cb 0.04 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 41.74 1nqt h LEU 49 CO -0.04 0.73 -0.02 0.03 -1.08 0.00 0.00 178.44 178.06 1nqt h ARG 50 N 0.07 0.05 0.07 1.13 3.08 -1.06 -1.45 114.38 116.28 1nqt h ARG 50 Ca -0.01 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1nqt h ARG 50 Cb 1.16 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1nqt h ARG 50 CO 0.09 0.08 -0.03 0.82 -1.07 0.00 0.00 179.97 179.86 1nqt h ILE 51 N 0.06 0.99 -1.02 2.04 2.04 -0.29 -3.33 117.51 118.00 1nqt h ILE 51 Ca 0.01 -1.51 0.25 0.00 1.00 0.00 0.00 64.86 64.62 1nqt h ILE 51 Cb 0.08 1.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.85 1nqt h ILE 51 CO 0.00 0.30 0.66 0.40 0.00 0.00 0.00 178.15 179.52 1nqt h ILE 52 N -0.93 0.56 0.37 -0.67 2.04 -0.04 -3.22 117.51 115.62 1nqt h ILE 52 Ca -0.01 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1nqt h ILE 52 Cb 0.56 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1nqt h ILE 52 CO 0.02 0.07 -0.30 0.50 0.00 0.00 0.00 178.15 178.44 1nqt h LYS 53 N 0.38 -0.65 -6.77 2.37 3.64 -1.39 -3.45 116.57 110.71 1nqt h LYS 53 Ca 0.56 0.04 -0.49 0.00 -1.27 0.00 0.00 60.65 59.49 1nqt h LYS 53 Cb 1.46 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 33.41 1nqt h LYS 53 CO -0.25 -0.43 0.11 -1.25 -2.27 0.00 0.00 179.45 175.35 1nqt s PRO 54 N -6.05 3.93 0.17 1.90 0.04 -1.22 -5.02 135.00 128.76 1nqt s PRO 54 Ca -0.16 0.61 -0.31 0.00 0.04 0.00 0.00 61.00 61.18 1nqt s PRO 54 Cb 0.06 -2.41 -0.09 0.00 0.04 0.00 0.00 34.50 32.09 1nqt s PRO 54 CO 0.63 0.09 1.37 0.00 0.04 0.00 0.00 177.00 179.14 1nqt h ASN 56 N 5.91 -0.18 -4.34 0.00 2.35 -0.88 -3.45 115.58 114.98 1nqt h ASN 56 Ca -0.44 -0.32 -0.47 0.00 -0.55 0.00 0.00 56.30 54.52 1nqt h ASN 56 Cb 1.21 0.05 -0.23 0.00 0.05 0.00 0.00 38.32 39.39 1nqt h ASN 56 CO 0.81 0.26 -0.80 -1.00 -1.65 0.00 0.00 177.43 175.06 1nqt s HIS 57 N -4.27 1.38 -0.19 1.19 3.76 -1.05 -5.04 115.29 111.07 1nqt s HIS 57 Ca -0.14 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.33 1nqt s HIS 57 Cb 0.02 -0.80 0.09 0.00 1.11 0.00 0.00 32.58 33.00 1nqt s HIS 57 CO 0.58 0.07 0.25 0.54 -0.85 0.00 0.00 174.74 175.33 1nqt s VAL 58 N -1.01 -0.38 -0.20 -0.90 0.11 -1.26 -0.48 120.40 116.28 1nqt s VAL 58 Ca 0.02 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 58.93 1nqt s VAL 58 Cb -0.09 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 1nqt s VAL 58 CO 0.02 -0.10 0.34 -0.22 -3.33 0.00 0.00 175.10 171.81 1nqt s LEU 59 N 2.38 4.17 0.17 2.54 2.96 0.00 -4.94 118.68 125.96 1nqt s LEU 59 Ca 0.06 0.45 0.07 0.00 -0.22 0.00 0.00 54.13 54.50 1nqt s LEU 59 Cb -0.15 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.08 1nqt s LEU 59 CO -0.11 -0.02 0.00 -0.44 -1.32 0.00 0.00 176.35 174.46 1nqt s SER 60 N 0.93 4.78 -0.13 3.68 0.01 -1.26 -1.13 113.70 120.58 1nqt s SER 60 Ca 0.17 -0.39 -0.30 0.00 1.31 0.00 0.00 55.95 56.74 1nqt s SER 60 Cb -0.14 -1.02 0.11 0.00 0.21 0.00 0.00 66.02 65.17 1nqt s SER 60 CO 0.07 0.09 0.90 -1.48 0.41 0.00 0.00 173.24 173.22 1nqt s LEU 61 N -2.93 -0.46 -0.25 2.44 0.05 -0.35 -4.98 118.68 112.20 1nqt s LEU 61 Ca 0.27 0.51 0.00 0.00 0.05 0.00 0.00 54.13 54.97 1nqt s LEU 61 Cb -0.09 2.08 0.07 0.00 -2.05 0.00 0.00 46.19 46.20 1nqt s LEU 61 CO 0.19 -0.43 0.00 -0.94 -0.55 0.00 0.00 176.35 174.62 1nqt s SER 62 N -1.12 3.84 0.31 1.48 1.04 -1.26 -1.70 113.70 116.29 1nqt s SER 62 Ca -0.05 -1.31 0.09 0.00 0.48 0.00 0.00 55.95 55.15 1nqt s SER 62 Cb -0.00 -1.08 -0.04 0.00 0.10 0.00 0.00 66.02 65.00 1nqt s SER 62 CO 0.04 -0.30 0.09 0.72 0.98 0.00 0.00 173.24 174.78 1nqt s PHE 63 N 1.46 2.73 0.33 5.02 -0.12 -0.44 -4.82 117.98 122.14 1nqt s PHE 63 Ca -0.00 -0.31 0.07 0.00 -0.05 0.00 0.00 56.93 56.65 1nqt s PHE 63 Cb -0.18 -1.46 -0.03 0.00 -0.63 0.00 0.00 43.02 40.72 1nqt s PHE 63 CO -0.10 0.45 0.28 -1.25 -0.05 0.00 0.00 175.22 174.55 1nqt s PRO 64 N -3.78 2.73 0.02 1.99 0.04 -1.26 0.23 135.00 134.96 1nqt s PRO 64 Ca 0.35 -1.28 -0.16 0.00 0.04 0.00 0.00 61.00 59.94 1nqt s PRO 64 Cb -0.04 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 32.05 1nqt s PRO 64 CO 0.22 0.13 0.36 0.96 0.04 0.00 0.00 177.00 178.70 1nqt s ILE 65 N -2.29 0.06 -0.69 0.56 -4.36 -0.58 -4.88 121.20 109.02 1nqt s ILE 65 Ca 0.40 -0.51 -0.07 0.00 -0.26 0.00 0.00 60.65 60.21 1nqt s ILE 65 Cb -0.06 -0.84 0.18 0.00 1.25 0.00 0.00 42.46 43.00 1nqt s ILE 65 CO 0.26 -0.28 0.55 -0.60 0.24 0.00 0.00 174.94 175.11 1nqt s ARG 66 N -2.03 2.93 0.15 0.37 3.52 -1.26 -1.71 118.95 120.93 1nqt s ARG 66 Ca -0.08 -2.46 -0.33 0.00 -0.13 0.00 0.00 55.73 52.72 1nqt s ARG 66 Cb -0.02 -3.99 -0.16 0.00 -1.56 0.00 0.00 34.95 29.21 1nqt s ARG 66 CO 0.00 -1.22 1.06 0.54 -0.81 0.00 0.00 175.30 174.87 1nqt n ARG 67 N 3.74 0.83 -0.15 5.12 1.74 -1.26 -4.68 116.66 122.01 1nqt n ARG 67 Ca 0.09 0.30 0.13 0.00 -0.77 0.00 0.00 57.85 57.60 1nqt n ARG 67 Cb 0.41 -1.72 0.24 0.00 -1.02 0.00 0.00 32.46 30.37 1nqt n ARG 67 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1nqt n ASP 68 N 1.91 0.12 0.00 0.55 8.00 -1.26 0.16 116.55 126.03 1nqt n ASP 68 Ca 0.16 0.75 0.02 0.00 0.71 0.00 0.00 54.79 56.43 1nqt n ASP 68 Cb 0.22 -0.35 0.11 0.00 -0.02 0.00 0.00 41.12 41.08 1nqt n ASP 68 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1nqt n ASP 69 N -4.10 0.00 0.00 -2.24 3.85 -1.26 -4.85 116.55 107.95 1nqt n ASP 69 Ca 0.16 -1.15 0.00 0.00 -0.71 0.00 0.00 54.79 53.09 1nqt n ASP 69 Cb 0.54 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.31 1nqt n ASP 69 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1nqt n GLY 70 N 0.16 0.93 0.00 6.12 0.00 0.43 -5.04 105.19 107.78 1nqt n GLY 70 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 -3.65 1.61 3.41 -1.23 -4.89 113.62 108.88 1nqt n SER 71 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1nqt n SER 71 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.00 -1.24 -0.05 7.33 0.51 -1.26 -4.22 118.94 120.01 1nqt s TRP 72 Ca 0.00 2.24 -0.05 0.00 -2.12 0.00 0.00 56.10 56.17 1nqt s TRP 72 Cb 0.00 0.73 0.01 0.00 -0.81 0.00 0.00 33.47 33.41 1nqt s TRP 72 CO 0.00 -0.62 0.13 -2.00 -0.51 0.00 0.00 176.95 173.96 1nqt s GLU 73 N 2.49 0.16 0.15 4.98 2.12 -0.69 -5.01 118.70 122.90 1nqt s GLU 73 Ca -0.07 0.17 -0.19 0.00 0.36 0.00 0.00 54.97 55.23 1nqt s GLU 73 Cb -0.10 0.08 -0.07 0.00 0.26 0.00 0.00 34.13 34.30 1nqt s GLU 73 CO -0.19 -0.02 0.65 0.14 -0.54 0.00 0.00 175.26 175.30 1nqt s VAL 74 N 0.03 4.65 0.11 3.70 -7.23 -1.26 -1.52 120.40 118.87 1nqt s VAL 74 Ca -0.00 1.24 0.07 0.00 -1.81 0.00 0.00 61.98 61.48 1nqt s VAL 74 Cb -0.01 -3.89 -0.04 0.00 0.56 0.00 0.00 36.38 32.99 1nqt s VAL 74 CO 0.00 0.38 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.44 1nqt s ILE 75 N -1.31 3.31 0.10 -0.62 1.09 0.61 -4.91 121.20 119.47 1nqt s ILE 75 Ca 0.36 -1.30 0.09 0.00 -1.10 0.00 0.00 60.65 58.70 1nqt s ILE 75 Cb -0.18 -2.55 -0.04 0.00 -1.06 0.00 0.00 42.46 38.63 1nqt s ILE 75 CO 0.21 0.11 -0.22 -1.61 -0.10 0.00 0.00 174.94 173.32 1nqt s GLU 76 N -2.21 1.70 -0.00 2.79 2.02 -1.26 -1.33 118.70 120.41 1nqt s GLU 76 Ca 0.21 -1.20 -0.29 0.00 0.02 0.00 0.00 54.97 53.72 1nqt s GLU 76 Cb -0.11 -2.03 0.10 0.00 0.10 0.00 0.00 34.13 32.19 1nqt s GLU 76 CO 0.13 0.48 0.96 0.20 0.02 0.00 0.00 175.26 177.06 1nqt s GLY 77 N -1.87 -0.40 0.32 -1.39 0.00 -0.69 -1.33 107.32 101.97 1nqt s GLY 77 Ca 0.15 0.92 0.04 0.00 0.00 0.00 0.00 44.72 45.83 1nqt s GLY 77 CO 0.07 0.29 0.19 -0.19 0.00 0.00 0.00 173.10 173.46 1nqt s TYR 78 N -3.03 1.63 -0.30 1.90 1.51 0.24 -1.21 117.35 118.10 1nqt s TYR 78 Ca 0.07 -1.46 -0.11 0.00 -1.01 0.00 0.00 57.07 54.56 1nqt s TYR 78 Cb -0.01 -0.82 0.16 0.00 -0.11 0.00 0.00 41.96 41.19 1nqt s TYR 78 CO -0.06 -0.62 0.86 0.50 -1.11 0.00 0.00 175.55 175.11 1nqt s ARG 79 N -3.72 0.38 -0.15 -0.62 6.06 -0.28 -1.46 118.95 119.16 1nqt s ARG 79 Ca 0.36 0.86 0.00 0.00 -2.50 0.00 0.00 55.73 54.45 1nqt s ARG 79 Cb 0.04 0.50 -0.01 0.00 0.06 0.00 0.00 34.95 35.55 1nqt s ARG 79 CO 0.20 -0.24 -0.14 0.00 -2.50 0.00 0.00 175.30 172.62 1nqt s ALA 80 N 2.71 2.53 -0.40 6.12 0.00 0.93 -0.82 121.76 132.84 1nqt s ALA 80 Ca 0.01 -1.00 -0.15 0.00 0.00 0.00 0.00 51.96 50.83 1nqt s ALA 80 Cb -0.10 -1.22 0.02 0.00 0.00 0.00 0.00 23.12 21.82 1nqt s ALA 80 CO -0.17 0.05 0.30 -0.65 0.00 0.00 0.00 175.76 175.29 1nqt s GLN 81 N 0.68 3.04 0.00 0.00 -0.21 0.37 -1.26 119.66 122.27 1nqt s GLN 81 Ca -0.07 -0.97 0.00 0.00 0.02 0.00 0.00 55.36 54.34 1nqt s GLN 81 Cb -0.16 -3.96 0.00 0.00 1.00 0.00 0.00 33.01 29.90 1nqt s GLN 81 CO 0.02 -0.72 0.58 1.58 -2.12 0.00 0.00 175.29 174.64 1nqt n HIS 82 N 5.17 0.00 -4.45 0.91 -0.00 0.61 -2.53 115.22 114.92 1nqt n HIS 82 Ca -0.11 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.35 1nqt n HIS 82 Cb 0.47 -0.34 -0.10 0.00 -0.00 0.00 0.00 29.99 30.02 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 -2.12 3.98 0.00 0.26 0.15 -1.24 -1.18 113.70 113.55 1nqt s SER 83 Ca 0.00 -1.15 0.00 0.00 0.70 0.00 0.00 55.95 55.50 1nqt s SER 83 Cb 0.00 -0.43 0.00 0.00 -1.71 0.00 0.00 66.02 63.88 1nqt s SER 83 CO 0.00 -0.29 0.46 1.41 1.20 0.00 0.00 173.24 176.02 1nqt n HIS 84 N -0.92 0.00 -0.55 3.44 -0.00 -1.26 -3.99 115.22 111.94 1nqt n HIS 84 Ca -0.04 -0.10 0.45 0.00 -0.00 0.00 0.00 57.72 58.02 1nqt n HIS 84 Cb 0.64 -0.01 0.76 0.00 -0.00 0.00 0.00 29.99 31.38 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 0.03 -4.80 -0.41 3.07 -1.97 -3.03 115.11 108.00 1nqt h GLN 85 Ca 0.00 -0.00 -0.64 0.00 0.09 0.00 0.00 58.65 58.10 1nqt h GLN 85 Cb 0.55 -0.01 -0.36 0.00 0.08 0.00 0.00 27.48 27.75 1nqt h GLN 85 CO 0.00 0.02 -0.83 0.50 0.09 0.00 0.00 178.83 178.61 1nqt s ARG 86 N -5.00 2.44 0.00 0.06 6.06 -1.26 -4.96 118.95 116.28 1nqt s ARG 86 Ca -0.06 -0.85 0.00 0.00 -2.50 0.00 0.00 55.73 52.33 1nqt s ARG 86 Cb 0.27 -2.46 0.00 0.00 0.06 0.00 0.00 34.95 32.81 1nqt s ARG 86 CO 0.86 -0.33 0.15 2.41 -2.50 0.00 0.00 175.30 175.89 1nqt n THR 87 N 4.65 0.00 -2.12 4.11 -1.04 -1.15 -2.81 114.28 115.91 1nqt n THR 87 Ca -0.17 0.34 -0.43 0.00 -2.04 0.00 0.00 64.05 61.75 1nqt n THR 87 Cb 0.48 -0.53 -0.02 0.00 -1.82 0.00 0.00 70.33 68.44 1nqt n THR 87 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1nqt s PRO 88 N -0.83 3.59 0.68 -2.82 0.02 -1.24 -4.71 135.00 129.69 1nqt s PRO 88 Ca 0.00 1.44 -0.15 0.00 0.02 0.00 0.00 61.00 62.30 1nqt s PRO 88 Cb 0.00 -4.09 0.01 0.00 0.02 0.00 0.00 34.50 30.44 1nqt s PRO 88 CO 0.00 -1.54 1.15 0.00 -0.33 0.00 0.00 177.00 176.28 1nqt s LYS 90 N -3.95 0.78 0.00 0.00 2.47 -0.01 0.09 119.74 119.11 1nqt s LYS 90 Ca 0.71 -1.16 0.00 0.00 -1.56 0.00 0.00 55.97 53.96 1nqt s LYS 90 Cb -0.25 -0.36 0.00 0.00 -1.46 0.00 0.00 37.83 35.77 1nqt s LYS 90 CO 0.42 0.04 0.00 0.41 0.16 0.00 0.00 175.35 176.38 1nqt n GLY 91 N 0.48 4.38 3.92 5.54 0.00 -1.22 -0.16 105.19 118.13 1nqt n GLY 91 Ca -0.16 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 1nqt n GLY 91 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nqt s GLY 92 N 0.00 1.71 -0.16 -0.02 0.00 -1.26 -2.66 107.32 104.94 1nqt s GLY 92 Ca 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 44.72 43.70 1nqt s GLY 92 CO 0.00 -0.33 -0.08 -0.42 0.00 0.00 0.00 173.10 172.27 1nqt s ILE 93 N -3.77 3.41 -0.09 0.90 -1.09 0.12 -1.37 121.20 119.31 1nqt s ILE 93 Ca 0.70 -0.52 0.01 0.00 -2.23 0.00 0.00 60.65 58.61 1nqt s ILE 93 Cb -0.06 -2.48 -0.02 0.00 -1.58 0.00 0.00 42.46 38.31 1nqt s ILE 93 CO 0.52 0.49 -0.13 -0.60 -1.23 0.00 0.00 174.94 173.99 1nqt s ARG 94 N 0.62 3.00 -0.34 2.79 3.52 0.09 -3.27 118.95 125.37 1nqt s ARG 94 Ca -0.05 -0.67 -0.02 0.00 -0.13 0.00 0.00 55.73 54.86 1nqt s ARG 94 Cb -0.15 -2.54 0.07 0.00 -1.56 0.00 0.00 34.95 30.78 1nqt s ARG 94 CO 0.03 0.41 0.07 0.71 -0.81 0.00 0.00 175.30 175.70 1nqt s TYR 95 N -0.16 3.41 -0.24 5.12 4.12 -1.26 -0.34 117.35 128.00 1nqt s TYR 95 Ca -0.00 -2.15 -0.27 0.00 0.02 0.00 0.00 57.07 54.67 1nqt s TYR 95 Cb -0.13 -2.53 0.14 0.00 -1.52 0.00 0.00 41.96 37.92 1nqt s TYR 95 CO 0.03 -0.87 1.08 0.45 0.02 0.00 0.00 175.55 176.27 1nqt s SER 96 N 1.39 -0.35 0.45 2.29 0.15 0.61 -4.65 113.70 113.60 1nqt s SER 96 Ca 0.00 0.57 0.15 0.00 0.70 0.00 0.00 55.95 57.38 1nqt s SER 96 Cb -0.21 0.54 1.09 0.00 -1.71 0.00 0.00 66.02 65.73 1nqt s SER 96 CO -0.03 -0.20 2.01 0.71 1.20 0.00 0.00 173.24 176.93 1nqt h THR 97 N 3.09 0.91 -0.76 6.45 1.35 -1.77 -2.97 112.91 119.20 1nqt h THR 97 Ca -0.24 -0.11 -0.45 0.00 -0.55 0.00 0.00 66.41 65.06 1nqt h THR 97 Cb 1.17 0.55 -0.18 0.00 -1.73 0.00 0.00 68.15 67.97 1nqt h THR 97 CO 0.19 0.06 0.53 -0.90 -0.25 0.00 0.00 175.52 175.15 1nqt n ASP 98 N -4.47 6.76 -4.73 5.36 5.68 -1.26 -4.79 116.55 119.11 1nqt n ASP 98 Ca 0.08 -3.27 -0.35 0.00 -0.50 0.00 0.00 54.79 50.75 1nqt n ASP 98 Cb 0.34 -1.08 -0.08 0.00 -1.14 0.00 0.00 41.12 39.16 1nqt n ASP 98 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1nqt s VAL 99 N -2.90 5.35 0.09 2.12 -7.23 -1.13 -5.06 120.40 111.64 1nqt s VAL 99 Ca 0.44 0.17 0.09 0.00 -1.81 0.00 0.00 61.98 60.87 1nqt s VAL 99 Cb 0.33 -3.43 -0.03 0.00 0.56 0.00 0.00 36.38 33.81 1nqt s VAL 99 CO -0.07 0.45 -0.24 -0.55 -0.31 0.00 0.00 175.10 174.39 1nqt s SER 100 N 0.28 2.86 0.22 4.85 0.15 -1.26 -4.82 113.70 115.98 1nqt s SER 100 Ca 0.08 -0.66 -0.13 0.00 0.70 0.00 0.00 55.95 55.93 1nqt s SER 100 Cb -0.11 -0.20 0.26 0.00 -1.71 0.00 0.00 66.02 64.26 1nqt s SER 100 CO -0.01 0.14 1.61 -0.37 1.20 0.00 0.00 173.24 175.81 1nqt h VAL 101 N 4.09 0.29 -1.00 4.45 -1.51 -1.99 0.41 116.25 120.99 1nqt h VAL 101 Ca -0.47 0.00 0.16 0.00 -1.23 0.00 0.00 66.70 65.16 1nqt h VAL 101 Cb 1.17 0.29 -0.10 0.00 -2.13 0.00 0.00 31.29 30.52 1nqt h VAL 101 CO 0.41 0.00 0.62 0.44 -1.23 0.00 0.00 177.57 177.81 1nqt h ASP 102 N -0.02 0.83 0.33 4.19 3.45 -1.98 -0.15 116.42 123.08 1nqt h ASP 102 Ca 0.32 0.07 -0.02 0.00 0.43 0.00 0.00 57.03 57.84 1nqt h ASP 102 Cb 0.51 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.20 1nqt h ASP 102 CO -0.71 0.36 -0.16 -0.08 -1.57 0.00 0.00 179.24 177.08 1nqt h GLU 103 N 0.85 -0.43 -0.09 3.56 4.81 -0.62 -0.15 114.58 122.51 1nqt h GLU 103 Ca 0.54 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.84 1nqt h GLU 103 Cb 0.74 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 1nqt h GLU 103 CO -0.33 -0.14 -0.18 -0.39 -0.73 0.00 0.00 179.01 177.24 1nqt h VAL 104 N -0.71 0.54 -0.85 0.32 -1.51 -0.68 0.43 116.25 113.79 1nqt h VAL 104 Ca -0.05 0.00 0.18 0.00 -1.23 0.00 0.00 66.70 65.61 1nqt h VAL 104 Cb 0.49 0.54 -0.16 0.00 -2.13 0.00 0.00 31.29 30.03 1nqt h VAL 104 CO 0.08 0.00 -0.15 0.11 -1.23 0.00 0.00 177.57 176.38 1nqt h LYS 105 N -0.25 0.02 0.55 5.19 1.79 -1.00 1.43 116.57 124.30 1nqt h LYS 105 Ca 0.08 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.53 1nqt h LYS 105 Cb 0.37 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1nqt h LYS 105 CO -0.24 0.01 -0.26 0.00 -1.08 0.00 0.00 179.45 177.88 1nqt h ALA 106 N 1.84 -0.74 -0.82 3.86 0.00 0.67 -2.02 119.26 122.04 1nqt h ALA 106 Ca 0.43 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.24 1nqt h ALA 106 Cb 0.70 0.29 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1nqt h ALA 106 CO -0.84 -0.91 0.50 -0.07 0.00 0.00 0.00 179.25 177.93 1nqt h LEU 107 N -0.76 0.77 0.16 0.00 3.38 0.92 -0.84 115.31 118.94 1nqt h LEU 107 Ca -0.08 0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1nqt h LEU 107 Cb 0.58 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1nqt h LEU 107 CO 0.12 0.48 -0.32 0.00 0.09 0.00 0.00 178.44 178.82 1nqt h ALA 108 N 1.40 -0.56 -0.92 1.53 0.00 0.20 -1.42 119.26 119.49 1nqt h ALA 108 Ca 0.37 -0.06 0.26 0.00 0.00 0.00 0.00 54.91 55.48 1nqt h ALA 108 Cb 0.21 0.50 -0.16 0.00 0.00 0.00 0.00 17.79 18.34 1nqt h ALA 108 CO -0.19 -0.87 0.17 1.03 0.00 0.00 0.00 179.25 179.39 1nqt h SER 109 N -0.56 -0.18 -0.13 0.00 0.87 -0.52 0.14 113.55 113.17 1nqt h SER 109 Ca 0.02 0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1nqt h SER 109 Cb 0.57 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 1nqt h SER 109 CO -0.16 -0.26 0.03 0.25 -0.53 0.00 0.00 176.83 176.16 1nqt h LEU 110 N 0.10 0.20 -0.68 2.23 5.85 -0.17 -3.21 115.31 119.63 1nqt h LEU 110 Ca 0.59 -0.23 0.11 0.00 0.84 0.00 0.00 57.88 59.19 1nqt h LEU 110 Cb 1.24 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 1nqt h LEU 110 CO -0.77 0.38 0.28 -0.03 -0.34 0.00 0.00 178.44 177.96 1nqt h MET 111 N 0.01 0.45 0.00 1.25 4.05 0.07 0.27 114.93 121.04 1nqt h MET 111 Ca 0.04 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1nqt h MET 111 Cb 0.26 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 1nqt h MET 111 CO 0.00 0.30 0.00 0.00 0.23 0.00 0.00 176.91 177.44 1nqt h THR 112 N 0.47 0.00 0.01 -0.77 1.03 -1.37 0.11 112.91 112.39 1nqt h THR 112 Ca 0.35 -0.04 -0.39 0.00 -0.01 0.00 0.00 66.41 66.33 1nqt h THR 112 Cb 0.46 0.93 -0.07 0.00 -1.07 0.00 0.00 68.15 68.40 1nqt h THR 112 CO -0.33 0.00 -2.44 -1.22 -0.01 0.00 0.00 175.52 171.52 1nqt n TYR 113 N -2.90 0.11 -0.18 0.00 4.01 0.62 -3.77 117.16 115.05 1nqt n TYR 113 Ca -0.02 0.02 -0.02 0.00 -0.16 0.00 0.00 57.90 57.72 1nqt n TYR 113 Cb 0.08 -1.01 0.08 0.00 -0.31 0.00 0.00 39.34 38.18 1nqt n TYR 113 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1nqt h LYS 114 N -0.02 0.35 0.47 -0.72 3.64 0.04 0.00 116.57 120.33 1nqt h LYS 114 Ca -0.57 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.78 1nqt h LYS 114 Cb 1.90 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.63 1nqt h LYS 114 CO -0.08 0.23 -0.36 0.00 -2.27 0.00 0.00 179.45 176.97 1nqt h ALA 116 N -0.42 0.14 -0.81 0.00 0.00 -1.43 0.24 119.26 116.99 1nqt h ALA 116 Ca -0.05 0.24 0.19 0.00 0.00 0.00 0.00 54.91 55.29 1nqt h ALA 116 Cb 0.70 0.85 -0.14 0.00 0.00 0.00 0.00 17.79 19.20 1nqt h ALA 116 CO 0.00 -0.61 0.07 0.28 0.00 0.00 0.00 179.25 178.99 1nqt h VAL 117 N -0.07 0.31 -0.42 0.00 2.07 -0.29 0.26 116.25 118.11 1nqt h VAL 117 Ca 0.31 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1nqt h VAL 117 Cb 0.58 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1nqt h VAL 117 CO -0.84 0.02 0.00 0.52 0.02 0.00 0.00 177.57 177.30 1nqt n VAL 118 N -5.32 0.56 -3.03 2.57 0.31 0.63 -4.75 118.33 109.29 1nqt n VAL 118 Ca 0.16 -0.61 -0.18 0.00 -0.01 0.00 0.00 64.34 63.70 1nqt n VAL 118 Cb 0.54 0.42 0.04 0.00 -0.91 0.00 0.00 33.84 33.93 1nqt n VAL 118 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1nqt n ASP 119 N 0.90 -5.30 -4.46 4.52 8.00 0.91 -4.94 116.55 116.18 1nqt n ASP 119 Ca 0.17 -0.29 -0.43 0.00 0.71 0.00 0.00 54.79 54.94 1nqt n ASP 119 Cb 0.42 -4.06 -0.09 0.00 -0.02 0.00 0.00 41.12 37.37 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 -3.11 5.20 0.00 2.53 1.01 -0.68 -4.97 120.40 120.39 1nqt s VAL 120 Ca 0.31 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1nqt s VAL 120 Cb -0.14 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1nqt s VAL 120 CO 0.39 -0.37 0.00 -0.81 0.00 0.00 0.00 175.10 174.30 1nqt n PRO 121 N 5.30 0.00 -4.52 2.72 -0.04 -1.26 -4.32 135.00 132.87 1nqt n PRO 121 Ca -0.10 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.06 1nqt n PRO 121 Cb 0.47 -1.24 -0.13 0.00 -0.04 0.00 0.00 33.50 32.56 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 0.89 2.43 0.66 0.54 2.99 -1.26 -4.51 117.98 119.72 1nqt s PHE 122 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 56.93 56.50 1nqt s PHE 122 Cb 0.00 -1.35 -0.01 0.00 0.00 0.00 0.00 43.02 41.66 1nqt s PHE 122 CO 0.00 0.29 1.05 0.20 -0.00 0.00 0.00 175.22 176.76 1nqt s GLY 123 N -1.79 1.63 -0.09 4.36 0.00 -1.09 -4.75 107.32 105.59 1nqt s GLY 123 Ca 0.15 -0.30 -0.22 0.00 0.00 0.00 0.00 44.72 44.35 1nqt s GLY 123 CO 0.06 0.02 0.65 -0.32 0.00 0.00 0.00 173.10 173.51 1nqt s GLY 124 N -4.29 2.52 0.12 0.20 0.00 -1.26 -0.83 107.32 103.78 1nqt s GLY 124 Ca 0.56 0.03 -0.03 0.00 0.00 0.00 0.00 44.72 45.29 1nqt s GLY 124 CO 0.52 1.11 0.09 0.00 0.00 0.00 0.00 173.10 174.81 1nqt s ALA 125 N 0.86 0.60 -0.06 3.20 0.00 0.78 0.22 121.76 127.36 1nqt s ALA 125 Ca 0.34 -1.28 -0.30 0.00 0.00 0.00 0.00 51.96 50.72 1nqt s ALA 125 Cb -0.17 0.75 0.09 0.00 0.00 0.00 0.00 23.12 23.79 1nqt s ALA 125 CO 0.16 -0.50 0.79 0.21 0.00 0.00 0.00 175.76 176.42 1nqt s LYS 126 N -4.00 0.92 0.04 0.00 2.47 -0.39 -3.92 119.74 114.86 1nqt s LYS 126 Ca 0.19 0.13 0.02 0.00 -1.56 0.00 0.00 55.97 54.74 1nqt s LYS 126 Cb 0.07 0.43 -0.03 0.00 -1.46 0.00 0.00 37.83 36.84 1nqt s LYS 126 CO -0.01 -0.30 -0.07 0.00 0.16 0.00 0.00 175.35 175.13 1nqt s ALA 127 N -1.50 0.53 0.02 3.13 0.00 -0.47 -0.05 121.76 123.43 1nqt s ALA 127 Ca -0.06 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.08 1nqt s ALA 127 Cb -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1nqt s ALA 127 CO 0.04 -0.07 -0.00 0.20 0.00 0.00 0.00 175.76 175.93 1nqt s GLY 128 N -1.74 0.24 -0.15 0.00 0.00 -0.54 -0.73 107.32 104.40 1nqt s GLY 128 Ca -0.08 -0.61 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 1nqt s GLY 128 CO -0.01 -0.70 -0.06 0.14 0.00 0.00 0.00 173.10 172.47 1nqt s VAL 129 N -1.86 1.08 -1.11 1.40 1.01 0.54 0.83 120.40 122.28 1nqt s VAL 129 Ca -0.12 -0.51 -0.23 0.00 0.00 0.00 0.00 61.98 61.12 1nqt s VAL 129 Cb -0.07 -1.20 -0.07 0.00 0.00 0.00 0.00 36.38 35.04 1nqt s VAL 129 CO -0.02 0.21 1.92 -0.54 0.00 0.00 0.00 175.10 176.67 1nqt s LYS 130 N 1.66 2.59 -0.11 2.72 1.02 -0.44 -1.72 119.74 125.45 1nqt s LYS 130 Ca 0.02 -0.97 -0.23 0.00 0.02 0.00 0.00 55.97 54.81 1nqt s LYS 130 Cb -0.14 -5.21 0.05 0.00 -0.52 0.00 0.00 37.83 32.01 1nqt s LYS 130 CO -0.08 -3.73 0.56 -1.50 -0.92 0.00 0.00 175.35 169.68 1nqt s ILE 131 N 10.42 0.01 -0.39 2.17 1.10 -1.21 -4.52 121.20 128.77 1nqt s ILE 131 Ca 0.68 -0.10 -0.06 0.00 -0.51 0.00 0.00 60.65 60.66 1nqt s ILE 131 Cb -0.02 -0.84 0.08 0.00 0.15 0.00 0.00 42.46 41.83 1nqt s ILE 131 CO 0.09 -0.06 0.19 0.21 -2.11 0.00 0.00 174.94 173.27 1nqt s ASN 132 N -0.60 5.38 0.23 4.50 3.84 -1.26 -0.28 114.94 126.74 1nqt s ASN 132 Ca -0.07 -1.63 -0.13 0.00 0.21 0.00 0.00 52.86 51.23 1nqt s ASN 132 Cb -0.03 -1.89 0.29 0.00 -0.55 0.00 0.00 41.25 39.08 1nqt s ASN 132 CO 0.05 -0.49 1.44 -2.65 -2.79 0.00 0.00 177.10 172.66 1nqt n PRO 133 N 4.76 -0.17 0.00 0.43 -0.02 -1.26 -0.10 135.00 138.64 1nqt n PRO 133 Ca -0.08 1.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.83 1nqt n PRO 133 Cb 0.42 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1nqt n PRO 133 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1nqt n LYS 134 N -5.41 0.00 0.00 -0.52 5.02 -1.26 0.17 118.16 116.15 1nqt n LYS 134 Ca 0.11 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.42 1nqt n LYS 134 Cb 0.40 -1.45 0.01 0.00 -0.02 0.00 0.00 35.03 33.97 1nqt n LYS 134 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1nqt n ASN 135 N -0.68 1.21 -4.44 4.39 3.02 0.86 -5.02 115.26 114.60 1nqt n ASN 135 Ca 0.00 -1.10 -0.26 0.00 -0.03 0.00 0.00 54.58 53.19 1nqt n ASN 135 Cb 0.00 0.06 -0.11 0.00 -0.61 0.00 0.00 39.78 39.12 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 -0.34 2.31 0.60 3.10 2.02 0.45 -5.09 117.35 120.39 1nqt s TYR 136 Ca 0.04 -0.35 -0.06 0.00 -0.37 0.00 0.00 57.07 56.33 1nqt s TYR 136 Cb 0.03 -1.10 0.01 0.00 -0.40 0.00 0.00 41.96 40.50 1nqt s TYR 136 CO 0.05 0.56 0.91 0.95 -1.57 0.00 0.00 175.55 176.45 1nqt s THR 137 N -1.91 3.56 0.15 -0.71 -4.23 -1.26 -4.81 115.64 106.42 1nqt s THR 137 Ca 0.23 -0.01 -0.26 0.00 -1.18 0.00 0.00 61.69 60.47 1nqt s THR 137 Cb -0.07 -3.42 -0.01 0.00 1.34 0.00 0.00 72.50 70.34 1nqt s THR 137 CO 0.11 -0.44 1.59 0.44 -0.54 0.00 0.00 174.62 175.79 1nqt h ASP 138 N -0.21 -1.21 -0.17 3.99 5.19 -1.99 0.22 116.42 122.24 1nqt h ASP 138 Ca -0.45 0.18 0.03 0.00 -0.62 0.00 0.00 57.03 56.17 1nqt h ASP 138 Cb 1.26 0.52 -0.05 0.00 0.18 0.00 0.00 39.33 41.24 1nqt h ASP 138 CO 0.61 -0.37 -0.41 -1.13 -3.12 0.00 0.00 179.24 174.82 1nqt h ASN 139 N -0.37 -1.32 -0.91 6.45 -0.00 -2.00 -1.42 115.58 116.01 1nqt h ASN 139 Ca 0.12 0.16 0.18 0.00 -0.00 0.00 0.00 56.30 56.76 1nqt h ASN 139 Cb 0.58 0.52 -0.11 0.00 -0.00 0.00 0.00 38.32 39.31 1nqt h ASN 139 CO -0.46 -0.34 0.48 -0.33 -0.00 0.00 0.00 177.43 176.78 1nqt h GLU 140 N -0.38 0.59 -0.16 6.67 5.08 -1.71 -0.27 114.58 124.40 1nqt h GLU 140 Ca 0.03 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1nqt h GLU 140 Cb 0.48 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 1nqt h GLU 140 CO -0.37 0.39 -0.26 -0.07 -1.00 0.00 0.00 179.01 177.70 1nqt h LEU 141 N 0.60 -0.82 -0.50 1.33 3.38 0.46 -1.51 115.31 118.25 1nqt h LEU 141 Ca 0.53 0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.72 1nqt h LEU 141 Cb 0.85 0.36 -0.08 0.00 0.09 0.00 0.00 40.66 41.88 1nqt h LEU 141 CO -0.41 -0.31 0.04 -0.08 0.09 0.00 0.00 178.44 177.77 1nqt h GLU 142 N -0.32 0.16 0.33 1.13 4.81 -0.38 0.19 114.58 120.49 1nqt h GLU 142 Ca 0.11 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1nqt h GLU 142 Cb 0.48 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1nqt h GLU 142 CO -0.34 0.10 -0.50 0.87 -0.73 0.00 0.00 179.01 178.41 1nqt h LYS 143 N 0.16 -0.85 -0.43 1.92 1.57 -1.00 0.58 116.57 118.52 1nqt h LYS 143 Ca 0.26 0.06 0.09 0.00 -1.87 0.00 0.00 60.65 59.18 1nqt h LYS 143 Cb 0.38 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.79 1nqt h LYS 143 CO -0.39 -0.56 -0.19 0.82 -0.57 0.00 0.00 179.45 178.56 1nqt h ILE 144 N -0.88 0.42 0.00 1.86 2.04 -0.50 -0.50 117.51 119.96 1nqt h ILE 144 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1nqt h ILE 144 Cb 0.81 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1nqt h ILE 144 CO -0.16 0.00 0.00 0.00 0.00 0.00 0.00 178.15 177.99 1nqt h THR 145 N -0.10 0.00 0.00 -0.27 1.03 -0.33 -2.00 112.91 111.23 1nqt h THR 145 Ca 0.21 -0.29 -0.10 0.00 -0.01 0.00 0.00 66.41 66.22 1nqt h THR 145 Cb 0.42 1.17 -0.02 0.00 -1.07 0.00 0.00 68.15 68.66 1nqt h THR 145 CO -0.49 0.00 -0.67 0.03 -0.01 0.00 0.00 175.52 174.38 1nqt h ARG 146 N 0.00 0.00 -0.54 0.00 3.08 0.57 -2.99 114.38 114.50 1nqt h ARG 146 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.16 1nqt h ARG 146 Cb 0.32 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.26 1nqt h ARG 146 CO 0.00 0.65 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.30 1nqt h ARG 147 N -1.00 -0.02 -0.70 0.04 9.65 -1.14 0.45 114.38 121.66 1nqt h ARG 147 Ca -0.15 0.00 0.14 0.00 -1.10 0.00 0.00 59.98 58.87 1nqt h ARG 147 Cb 0.90 0.00 -0.13 0.00 -1.39 0.00 0.00 29.97 29.35 1nqt h ARG 147 CO -0.09 -0.01 -0.18 0.35 2.80 0.00 0.00 179.97 182.83 1nqt h PHE 148 N -0.02 -0.39 -0.42 2.20 3.57 -1.49 0.42 116.94 120.80 1nqt h PHE 148 Ca 0.26 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.87 1nqt h PHE 148 Cb 0.41 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.41 1nqt h PHE 148 CO -0.47 -0.30 0.29 1.15 -2.23 0.00 0.00 178.31 176.74 1nqt h THR 149 N -0.01 0.98 0.23 4.41 2.02 0.01 0.56 112.91 121.12 1nqt h THR 149 Ca 0.33 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 1nqt h THR 149 Cb 0.51 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1nqt h THR 149 CO -0.72 0.07 -0.11 0.24 0.37 0.00 0.00 175.52 175.36 1nqt h MET 150 N 0.36 -0.30 -0.83 6.66 2.86 0.85 -2.18 114.93 122.36 1nqt h MET 150 Ca 0.18 0.02 0.24 0.00 -2.06 0.00 0.00 59.70 58.08 1nqt h MET 150 Cb 0.27 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 1nqt h MET 150 CO -0.04 -0.20 0.59 0.93 1.06 0.00 0.00 176.91 179.25 1nqt h GLU 151 N -0.46 0.03 0.00 1.72 4.39 -1.23 0.39 114.58 119.41 1nqt h GLU 151 Ca -0.03 -0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 1nqt h GLU 151 Cb 0.24 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 1nqt h GLU 151 CO 0.05 0.02 -0.54 1.25 -1.16 0.00 0.00 179.01 178.63 1nqt h LEU 152 N 0.03 0.00 0.01 1.33 5.85 -0.87 -3.24 115.31 118.42 1nqt h LEU 152 Ca 0.40 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.83 1nqt h LEU 152 Cb 1.54 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.53 1nqt h LEU 152 CO -0.02 0.54 -1.63 0.00 -0.34 0.00 0.00 178.44 176.99 1nqt h ALA 153 N 1.46 0.70 0.00 1.25 0.00 0.33 0.57 119.26 123.57 1nqt h ALA 153 Ca -0.01 -1.39 -0.02 0.00 0.00 0.00 0.00 54.91 53.50 1nqt h ALA 153 Cb 1.15 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1nqt h ALA 153 CO 0.07 1.52 -0.07 0.87 0.00 0.00 0.00 179.25 181.64 1nqt h LYS 154 N 0.01 0.00 -0.04 0.00 1.57 -0.94 -3.14 116.57 114.03 1nqt h LYS 154 Ca -0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1nqt h LYS 154 Cb 1.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.30 1nqt h LYS 154 CO 0.09 0.07 0.00 1.63 -0.57 0.00 0.00 179.45 180.67 1nqt n LYS 155 N -3.25 1.77 -2.98 3.15 4.76 -1.22 -5.01 118.16 115.38 1nqt n LYS 155 Ca -0.00 -2.43 -0.11 0.00 -2.87 0.00 0.00 58.31 52.90 1nqt n LYS 155 Cb 0.29 -1.46 0.03 0.00 -1.84 0.00 0.00 35.03 32.06 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 -1.14 0.29 0.00 0.72 0.00 -1.19 -4.94 105.19 98.93 1nqt n GLY 156 Ca 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.62 0.00 -3.74 1.61 3.72 0.20 -4.81 117.46 110.82 1nqt n PHE 157 Ca 0.00 -0.25 -0.13 0.00 -0.05 0.00 0.00 57.45 57.02 1nqt n PHE 157 Cb 0.53 -0.03 -0.14 0.00 -0.94 0.00 0.00 39.48 38.91 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 -0.50 -0.04 0.00 4.37 2.07 -0.97 -4.66 121.20 121.46 1nqt s ILE 158 Ca 0.00 0.16 0.00 0.00 -1.41 0.00 0.00 60.65 59.40 1nqt s ILE 158 Cb 0.00 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.27 1nqt s ILE 158 CO 0.00 0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.70 1nqt n GLY 159 N 4.20 2.52 0.24 1.50 0.00 -0.51 -4.54 105.19 108.61 1nqt n GLY 159 Ca -0.26 0.10 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt h PRO 160 N 0.00 0.00 0.00 1.61 0.13 -1.80 0.54 132.00 132.47 1nqt h PRO 160 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1nqt h PRO 160 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1nqt h PRO 160 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1nqt n GLY 161 N -1.25 -0.02 0.31 1.56 0.00 -1.26 -4.86 105.19 99.67 1nqt n GLY 161 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.48 0.20 -3.57 -0.61 5.41 0.55 -3.70 119.36 117.15 1nqt n ILE 162 Ca 0.00 0.33 -0.17 0.00 1.00 0.00 0.00 62.75 63.92 1nqt n ILE 162 Cb 0.01 -1.46 -0.14 0.00 -0.71 0.00 0.00 39.64 37.35 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 -4.53 0.97 -0.51 4.38 -1.08 0.16 0.11 116.67 116.17 1nqt s ASP 163 Ca -0.03 0.11 -0.13 0.00 -0.52 0.00 0.00 52.55 51.98 1nqt s ASP 163 Cb 0.00 0.44 0.12 0.00 -1.46 0.00 0.00 42.92 42.03 1nqt s ASP 163 CO 0.04 -0.29 0.44 -0.69 0.52 0.00 0.00 175.17 175.19 1nqt s VAL 164 N 2.34 4.82 1.41 1.11 1.01 0.11 -1.42 120.40 129.79 1nqt s VAL 164 Ca 0.05 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.20 1nqt s VAL 164 Cb -0.14 -4.11 0.36 0.00 0.00 0.00 0.00 36.38 32.49 1nqt s VAL 164 CO -0.10 -0.82 0.96 -2.84 0.00 0.00 0.00 175.10 172.30 1nqt s PRO 165 N 1.51 -2.85 0.30 2.72 0.02 -1.18 -3.37 135.00 132.15 1nqt s PRO 165 Ca 0.04 0.02 -0.19 0.00 0.02 0.00 0.00 61.00 60.89 1nqt s PRO 165 Cb -0.28 -1.40 0.05 0.00 0.02 0.00 0.00 34.50 32.89 1nqt s PRO 165 CO 0.02 -4.80 0.82 0.00 -0.33 0.00 0.00 177.00 172.71 1nqt s ALA 166 N -2.40 -1.11 0.37 -1.55 0.00 -1.09 -2.41 121.76 113.58 1nqt s ALA 166 Ca 0.69 -0.46 -0.10 0.00 0.00 0.00 0.00 51.96 52.10 1nqt s ALA 166 Cb -0.11 0.74 -0.06 0.00 0.00 0.00 0.00 23.12 23.68 1nqt s ALA 166 CO 0.57 -1.02 0.72 -2.14 0.00 0.00 0.00 175.76 173.89 1nqt s PRO 167 N -2.91 3.77 -0.06 0.00 0.02 -1.26 0.15 135.00 134.71 1nqt s PRO 167 Ca 0.14 0.40 -0.02 0.00 0.02 0.00 0.00 61.00 61.54 1nqt s PRO 167 Cb -0.05 -2.44 0.04 0.00 0.02 0.00 0.00 34.50 32.07 1nqt s PRO 167 CO 0.08 0.03 0.13 0.34 -0.33 0.00 0.00 177.00 177.25 1nqt s ASP 168 N -3.08 0.17 0.00 2.53 2.15 -1.20 -4.62 116.67 112.62 1nqt s ASP 168 Ca 0.50 0.26 0.00 0.00 0.43 0.00 0.00 52.55 53.74 1nqt s ASP 168 Cb -0.10 0.15 0.00 0.00 -0.30 0.00 0.00 42.92 42.66 1nqt s ASP 168 CO 0.30 -0.17 0.00 0.23 -0.17 0.00 0.00 175.17 175.36 1nqt n MET 169 N 4.51 0.00 0.00 4.34 2.81 -1.26 0.13 117.12 127.64 1nqt n MET 169 Ca -0.21 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.79 1nqt n MET 169 Cb 0.51 0.00 0.65 0.00 -0.71 0.00 0.00 33.22 33.67 1nqt n MET 169 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1nqt n SER 170 N 0.00 0.00 -4.23 7.83 3.41 -1.26 -4.83 113.62 114.54 1nqt n SER 170 Ca 0.00 -0.70 -0.13 0.00 -0.26 0.00 0.00 58.87 57.78 1nqt n SER 170 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 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 -2.00 0.19 0.00 6.66 -4.23 0.34 -4.46 115.64 112.14 1nqt s THR 171 Ca 0.33 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 1nqt s THR 171 Cb 0.15 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.52 1nqt s THR 171 CO 0.25 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.87 1nqt n GLY 172 N -0.30 5.20 0.18 3.99 0.00 -1.26 -4.16 105.19 108.83 1nqt n GLY 172 Ca 0.00 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.67 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 0.00 -0.10 1.61 4.11 -1.98 -2.80 114.58 115.43 1nqt h GLU 173 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1nqt h GLU 173 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nqt h GLU 173 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.08 1nqt h ARG 174 N 0.00 0.17 -0.28 1.06 3.08 -1.96 -1.20 114.38 115.25 1nqt h ARG 174 Ca 0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1nqt h ARG 174 Cb 0.98 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 1nqt h ARG 174 CO 0.00 0.41 0.05 0.93 -1.07 0.00 0.00 179.97 180.30 1nqt h GLU 175 N -0.10 0.46 -0.08 0.04 3.07 -1.98 -2.39 114.58 113.61 1nqt h GLU 175 Ca 0.03 -0.12 0.02 0.00 -0.50 0.00 0.00 59.36 58.79 1nqt h GLU 175 Cb 0.33 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1nqt h GLU 175 CO 0.00 0.56 0.08 0.52 -1.40 0.00 0.00 179.01 178.78 1nqt h MET 176 N 0.28 0.00 -0.04 2.33 2.86 -1.43 0.24 114.93 119.16 1nqt h MET 176 Ca 0.09 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.58 1nqt h MET 176 Cb 0.32 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1nqt h MET 176 CO 0.00 0.00 -0.65 1.03 1.06 0.00 0.00 176.91 178.36 1nqt h SER 177 N 0.00 0.19 0.09 1.22 0.87 -0.73 -1.98 113.55 113.21 1nqt h SER 177 Ca 0.04 -0.12 -0.21 0.00 -1.23 0.00 0.00 61.79 60.28 1nqt h SER 177 Cb 0.20 -0.06 0.02 0.00 -0.44 0.00 0.00 62.40 62.13 1nqt h SER 177 CO -0.00 0.78 -0.86 -0.50 -0.53 0.00 0.00 176.83 175.72 1nqt h TRP 178 N 0.12 0.69 -0.59 2.24 6.55 -0.22 -2.25 115.95 122.50 1nqt h TRP 178 Ca -0.01 -0.44 0.07 0.00 0.95 0.00 0.00 58.89 59.46 1nqt h TRP 178 Cb 1.16 -0.05 -0.06 0.00 -0.86 0.00 0.00 29.16 29.35 1nqt h TRP 178 CO 0.02 1.30 0.26 0.82 -1.05 0.00 0.00 178.44 179.79 1nqt h ILE 179 N -0.11 0.85 0.28 1.49 2.04 -0.79 0.53 117.51 121.81 1nqt h ILE 179 Ca -0.13 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1nqt h ILE 179 Cb 1.61 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1nqt h ILE 179 CO 0.17 0.09 -0.14 0.00 0.00 0.00 0.00 178.15 178.27 1nqt h ALA 180 N 1.37 -1.05 -0.94 1.87 0.00 -1.43 -2.57 119.26 116.51 1nqt h ALA 180 Ca 0.28 -0.08 0.25 0.00 0.00 0.00 0.00 54.91 55.36 1nqt h ALA 180 Cb 0.28 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.09 1nqt h ALA 180 CO -0.24 -1.02 0.47 0.22 0.00 0.00 0.00 179.25 178.67 1nqt h ASP 181 N -0.40 0.43 -0.39 0.00 1.82 -0.80 0.19 116.42 117.28 1nqt h ASP 181 Ca -0.04 0.16 -0.08 0.00 -0.39 0.00 0.00 57.03 56.68 1nqt h ASP 181 Cb 0.29 0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.40 1nqt h ASP 181 CO 0.06 -0.01 -0.02 0.74 -1.61 0.00 0.00 179.24 178.40 1nqt h THR 182 N 0.42 1.25 0.67 2.25 2.02 0.05 -1.34 112.91 118.23 1nqt h THR 182 Ca 0.62 -1.04 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 1nqt h THR 182 Cb 1.22 0.91 0.01 0.00 -1.74 0.00 0.00 68.15 68.55 1nqt h THR 182 CO -0.54 0.36 -0.32 0.22 0.37 0.00 0.00 175.52 175.61 1nqt h TYR 183 N 0.73 -0.84 -0.35 3.16 3.20 -0.27 -2.73 116.97 119.88 1nqt h TYR 183 Ca 0.14 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.09 1nqt h TYR 183 Cb 0.48 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 1nqt h TYR 183 CO 0.03 -0.52 0.55 0.00 -1.64 0.00 0.00 178.16 176.57 1nqt h ALA 184 N -1.26 2.01 -0.03 1.82 0.00 -1.07 0.37 119.26 121.10 1nqt h ALA 184 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nqt h ALA 184 Cb 0.69 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1nqt h ALA 184 CO 0.15 -0.73 -0.01 0.43 0.00 0.00 0.00 179.25 179.09 1nqt n SER 185 N -3.35 2.85 0.00 0.00 7.64 -0.51 -3.66 113.62 116.58 1nqt n SER 185 Ca 0.06 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 58.02 1nqt n SER 185 Cb 0.69 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.90 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 1.23 0.00 -0.35 0.44 -1.04 0.08 -4.82 114.28 109.82 1nqt n THR 186 Ca 0.13 0.00 0.25 0.00 -2.04 0.00 0.00 64.05 62.39 1nqt n THR 186 Cb 0.56 0.00 0.50 0.00 -1.82 0.00 0.00 70.33 69.57 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 0.32 -0.75 12.58 1.08 -1.81 -0.85 117.51 128.09 1nqt h ILE 187 Ca 0.00 -0.11 -0.23 0.00 -0.39 0.00 0.00 64.86 64.14 1nqt h ILE 187 Cb 0.00 -0.03 -0.13 0.00 -3.07 0.00 0.00 36.82 33.59 1nqt h ILE 187 CO 0.00 0.06 0.28 0.61 -0.69 0.00 0.00 178.15 178.41 1nqt n GLY 188 N -1.34 3.71 0.29 5.37 0.00 -0.95 -4.60 105.19 107.66 1nqt n GLY 188 Ca 0.31 -1.01 0.07 0.00 0.00 0.00 0.00 46.02 45.40 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 2.61 0.55 -0.00 1.61 6.17 -1.22 -2.14 115.15 122.73 1nqt h HIS 189 Ca 0.28 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.40 1nqt h HIS 189 Cb 2.35 -0.12 0.00 0.00 2.52 0.00 0.00 27.41 32.16 1nqt h HIS 189 CO 1.30 0.05 -0.37 0.66 0.71 0.00 0.00 177.93 180.28 1nqt n TYR 190 N -5.01 0.00 -2.18 5.26 4.02 -1.26 -4.85 117.16 113.14 1nqt n TYR 190 Ca 0.16 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.62 1nqt n TYR 190 Cb 0.46 -0.28 -0.02 0.00 -0.02 0.00 0.00 39.34 39.48 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 -2.92 6.24 0.00 7.72 3.68 -0.81 -4.86 116.67 125.72 1nqt s ASP 191 Ca 0.14 1.23 0.00 0.00 2.13 0.00 0.00 52.55 56.05 1nqt s ASP 191 Cb 0.18 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 39.12 1nqt s ASP 191 CO 0.64 -1.44 0.44 0.00 0.13 0.00 0.00 175.17 174.94 1nqt n ILE 192 N 6.93 0.15 -2.69 4.11 3.06 -1.26 -1.76 119.36 127.89 1nqt n ILE 192 Ca 0.19 0.00 -0.01 0.00 -2.50 0.00 0.00 62.75 60.43 1nqt n ILE 192 Cb 0.47 -0.47 0.06 0.00 0.54 0.00 0.00 39.64 40.24 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 0.24 0.35 0.23 9.51 3.02 -1.26 -4.91 115.26 122.44 1nqt n ASN 193 Ca 0.00 -2.08 0.14 0.00 -0.03 0.00 0.00 54.58 52.61 1nqt n ASN 193 Cb 0.22 -0.03 0.35 0.00 -0.61 0.00 0.00 39.78 39.72 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 1.75 1.00 -0.25 5.41 0.00 -1.63 -2.65 119.26 122.88 1nqt h ALA 194 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1nqt h ALA 194 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1nqt h ALA 194 CO 0.02 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.99 1nqt n HIS 195 N -3.04 0.70 0.35 0.00 8.25 -1.26 -2.56 115.22 117.66 1nqt n HIS 195 Ca 0.03 -0.26 0.08 0.00 -0.26 0.00 0.00 57.72 57.30 1nqt n HIS 195 Cb 0.45 -0.18 0.11 0.00 1.12 0.00 0.00 29.99 31.49 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 0.29 2.40 -0.07 -1.41 0.00 -1.00 -4.45 120.51 116.26 1nqt n ALA 196 Ca 0.11 -0.81 0.02 0.00 0.00 0.00 0.00 53.44 52.75 1nqt n ALA 196 Cb 0.51 -0.55 0.33 0.00 0.00 0.00 0.00 19.45 19.75 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 -5.49 0.05 0.58 0.00 0.11 -1.26 -3.12 120.40 111.26 1nqt s VAL 198 Ca -0.09 -0.43 0.07 0.00 -2.93 0.00 0.00 61.98 58.60 1nqt s VAL 198 Cb 0.17 -0.41 0.07 0.00 -1.53 0.00 0.00 36.38 34.68 1nqt s VAL 198 CO 0.76 -0.24 0.59 0.42 -3.33 0.00 0.00 175.10 173.30 1nqt s THR 199 N -0.89 1.75 0.00 5.04 -4.23 -1.01 -4.64 115.64 111.66 1nqt s THR 199 Ca -0.10 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1nqt s THR 199 Cb -0.05 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.76 1nqt s THR 199 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1nqt n GLY 200 N -2.02 2.20 3.80 3.99 0.00 -1.26 -4.38 105.19 107.51 1nqt n GLY 200 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.10 2.83 0.55 1.61 -2.85 -1.26 -4.46 119.74 116.05 1nqt s LYS 201 Ca 0.00 1.10 -0.19 0.00 -1.00 0.00 0.00 55.97 55.88 1nqt s LYS 201 Cb 0.00 -1.97 -0.08 0.00 -2.06 0.00 0.00 37.83 33.72 1nqt s LYS 201 CO 0.00 -1.19 0.74 -2.30 0.10 0.00 0.00 175.35 172.70 1nqt n PRO 202 N -2.93 0.76 -0.35 1.78 -0.02 -1.26 -3.23 135.00 129.75 1nqt n PRO 202 Ca 0.08 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 61.86 1nqt n PRO 202 Cb 0.53 -1.88 0.15 0.00 -0.02 0.00 0.00 33.50 32.27 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 0.56 1.11 0.00 4.25 1.08 -1.91 0.45 117.51 123.05 1nqt h ILE 203 Ca -0.46 -0.40 0.00 0.00 -0.39 0.00 0.00 64.86 63.62 1nqt h ILE 203 Cb 1.38 -0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.99 1nqt h ILE 203 CO 0.50 0.21 0.00 -1.54 -0.69 0.00 0.00 178.15 176.63 1nqt n SER 204 N -4.51 0.38 -0.41 1.72 3.41 -1.26 -1.49 113.62 111.45 1nqt n SER 204 Ca 0.14 0.61 0.04 0.00 -0.26 0.00 0.00 58.87 59.40 1nqt n SER 204 Cb 0.14 -0.69 0.08 0.00 -0.26 0.00 0.00 64.21 63.49 1nqt n SER 204 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nqt n GLN 205 N -1.94 1.97 0.00 4.33 1.13 0.61 -4.95 117.38 118.52 1nqt n GLN 205 Ca 0.02 -1.59 0.00 0.00 -1.94 0.00 0.00 57.00 53.49 1nqt n GLN 205 Cb 0.16 -1.18 0.00 0.00 0.11 0.00 0.00 30.24 29.33 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 0.30 1.39 3.80 1.08 0.00 -0.39 -4.85 105.19 106.52 1nqt n GLY 206 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 1.58 0.09 -0.02 0.00 0.13 -4.61 107.32 102.48 1nqt s GLY 207 Ca 0.00 -0.52 0.04 0.00 0.00 0.00 0.00 44.72 44.25 1nqt s GLY 207 CO 0.00 0.03 0.01 -1.50 0.00 0.00 0.00 173.10 171.64 1nqt s ILE 208 N -3.29 4.10 -0.02 0.90 2.07 -1.26 -4.56 121.20 119.13 1nqt s ILE 208 Ca 0.63 -0.95 -0.30 0.00 -1.41 0.00 0.00 60.65 58.63 1nqt s ILE 208 Cb -0.14 -2.96 -0.03 0.00 0.13 0.00 0.00 42.46 39.46 1nqt s ILE 208 CO 0.53 0.13 1.07 -1.00 -1.91 0.00 0.00 174.94 173.76 1nqt s HIS 209 N -1.32 3.50 0.00 3.50 3.76 -1.26 -3.87 115.29 119.60 1nqt s HIS 209 Ca 0.26 1.51 0.00 0.00 -0.15 0.00 0.00 55.06 56.68 1nqt s HIS 209 Cb -0.12 -3.25 0.00 0.00 1.11 0.00 0.00 32.58 30.32 1nqt s HIS 209 CO 0.19 -0.55 0.00 0.41 -0.85 0.00 0.00 174.74 173.94 1nqt n GLY 210 N 3.09 1.05 0.05 -2.22 0.00 -1.26 -4.01 105.19 101.89 1nqt n GLY 210 Ca 0.08 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.10 1nqt n GLY 210 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nqt n ARG 211 N -0.10 0.66 0.01 1.61 0.63 -1.25 -3.82 116.66 114.40 1nqt n ARG 211 Ca 0.00 -0.09 0.12 0.00 -0.92 0.00 0.00 57.85 56.96 1nqt n ARG 211 Cb 0.04 -1.57 0.23 0.00 0.45 0.00 0.00 32.46 31.60 1nqt n ARG 211 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 1nqt n ILE 212 N -2.47 0.05 0.83 5.15 -5.35 -1.26 -3.50 119.36 112.80 1nqt n ILE 212 Ca -0.12 -0.04 0.09 0.00 -0.27 0.00 0.00 62.75 62.41 1nqt n ILE 212 Cb 0.74 0.21 -0.11 0.00 -1.74 0.00 0.00 39.64 38.74 1nqt n ILE 212 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1nqt n SER 213 N -1.59 0.86 0.00 7.28 7.64 -1.26 -4.69 113.62 121.86 1nqt n SER 213 Ca 0.05 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 59.05 1nqt n SER 213 Cb 0.35 1.05 0.00 0.00 -1.01 0.00 0.00 64.21 64.60 1nqt n SER 213 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nqt n ALA 214 N -1.48 -0.10 -0.31 -0.43 0.00 -1.23 0.45 120.51 117.42 1nqt n ALA 214 Ca 0.03 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.69 1nqt n ALA 214 Cb 0.30 0.19 0.52 0.00 0.00 0.00 0.00 19.45 20.45 1nqt n ALA 214 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1nqt h THR 215 N 0.00 0.56 0.68 0.00 1.35 -1.80 0.18 112.91 113.88 1nqt h THR 215 Ca 0.00 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.69 1nqt h THR 215 Cb 0.00 0.14 0.01 0.00 -1.73 0.00 0.00 68.15 66.56 1nqt h THR 215 CO 0.00 0.07 -0.33 1.23 -0.25 0.00 0.00 175.52 176.25 1nqt h GLY 216 N 0.39 -0.95 1.06 5.82 0.00 -1.75 -2.47 103.07 105.18 1nqt h GLY 216 Ca 0.56 0.35 0.12 0.00 0.00 0.00 0.00 47.33 48.37 1nqt h GLY 216 CO -0.26 -0.35 0.35 3.21 0.00 0.00 0.00 176.54 179.50 1nqt h ARG 217 N -1.24 0.00 0.00 4.80 3.08 0.97 -1.99 114.38 120.00 1nqt h ARG 217 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1nqt h ARG 217 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1nqt h ARG 217 CO 0.15 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.46 1nqt n GLY 218 N -1.55 -2.92 0.05 0.04 0.00 0.53 -1.60 105.19 99.73 1nqt n GLY 218 Ca 0.07 0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 1nqt n GLY 218 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nqt n VAL 219 N -0.89 -0.08 0.00 1.61 0.31 -0.78 -0.26 118.33 118.24 1nqt n VAL 219 Ca 0.00 0.37 0.00 0.00 -0.01 0.00 0.00 64.34 64.70 1nqt n VAL 219 Cb 0.00 -0.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.47 1nqt n VAL 219 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1nqt n PHE 220 N -3.68 0.00 -0.35 3.52 -0.00 -1.00 -1.46 117.46 114.50 1nqt n PHE 220 Ca 0.00 0.00 0.31 0.00 -0.00 0.00 0.00 57.45 57.76 1nqt n PHE 220 Cb 0.03 0.00 0.52 0.00 -0.00 0.00 0.00 39.48 40.03 1nqt n PHE 220 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1nqt n HIS 221 N -0.77 0.63 0.40 -5.13 8.25 0.65 0.21 115.22 119.46 1nqt n HIS 221 Ca 0.00 0.64 -0.19 0.00 -0.26 0.00 0.00 57.72 57.91 1nqt n HIS 221 Cb 0.00 -1.05 -0.09 0.00 1.12 0.00 0.00 29.99 29.97 1nqt n HIS 221 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1nqt h GLY 222 N 0.00 -1.18 0.99 -1.41 0.00 -0.43 0.15 103.07 101.19 1nqt h GLY 222 Ca 0.69 0.48 0.01 0.00 0.00 0.00 0.00 47.33 48.51 1nqt h GLY 222 CO -0.42 -0.41 0.27 -2.22 0.00 0.00 0.00 176.54 173.76 1nqt h ILE 223 N -1.08 1.10 -0.43 2.60 2.04 0.50 -2.96 117.51 119.28 1nqt h ILE 223 Ca -0.09 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.63 1nqt h ILE 223 Cb 0.86 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 1nqt h ILE 223 CO 0.10 0.10 0.15 -0.08 0.00 0.00 0.00 178.15 178.43 1nqt h GLU 224 N 0.55 0.31 -0.51 2.37 4.81 -1.01 0.10 114.58 121.20 1nqt h GLU 224 Ca 0.15 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.44 1nqt h GLU 224 Cb -0.05 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.19 1nqt h GLU 224 CO -0.04 0.21 0.16 -0.91 -0.73 0.00 0.00 179.01 177.70 1nqt h ASN 225 N 0.32 0.14 -0.05 1.04 2.35 -0.55 -2.25 115.58 116.59 1nqt h ASN 225 Ca 0.20 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 1nqt h ASN 225 Cb 0.19 0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1nqt h ASN 225 CO -0.20 0.10 -0.10 -0.26 -1.65 0.00 0.00 177.43 175.32 1nqt h PHE 226 N 0.33 0.19 -0.95 1.19 0.05 -1.34 -3.23 116.94 113.18 1nqt h PHE 226 Ca 0.25 -0.07 0.27 0.00 3.82 0.00 0.00 57.97 62.25 1nqt h PHE 226 Cb 0.29 -0.03 -0.04 0.00 2.00 0.00 0.00 35.95 38.17 1nqt h PHE 226 CO -0.18 0.70 0.68 0.82 -0.18 0.00 0.00 178.31 180.15 1nqt h ILE 227 N -0.38 0.53 -0.39 -0.55 5.03 -0.74 0.15 117.51 121.16 1nqt h ILE 227 Ca 0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.73 1nqt h ILE 227 Cb 0.69 0.51 0.00 0.00 -3.03 0.00 0.00 36.82 34.99 1nqt h ILE 227 CO 0.02 0.00 0.00 0.59 -0.68 0.00 0.00 178.15 178.09 1nqt n ASN 228 N -4.26 3.12 -4.14 1.72 5.03 -0.87 -4.72 115.26 111.13 1nqt n ASN 228 Ca 0.20 -2.28 -0.38 0.00 0.87 0.00 0.00 54.58 52.99 1nqt n ASN 228 Cb 1.01 -0.46 -0.09 0.00 -1.02 0.00 0.00 39.78 39.22 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1nqt s GLU 229 N -1.74 2.54 0.01 3.52 2.56 0.53 -5.00 118.70 121.13 1nqt s GLU 229 Ca 0.31 -2.25 -0.02 0.00 0.00 0.00 0.00 54.97 53.01 1nqt s GLU 229 Cb 0.20 -3.81 -0.00 0.00 2.00 0.00 0.00 34.13 32.52 1nqt s GLU 229 CO 0.15 -1.17 0.60 0.00 -0.56 0.00 0.00 175.26 174.28 1nqt n ALA 230 N 4.00 -0.05 -0.30 6.30 0.00 -1.26 -1.83 120.51 127.36 1nqt n ALA 230 Ca 0.04 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1nqt n ALA 230 Cb 0.40 0.24 0.00 0.00 0.00 0.00 0.00 19.45 20.09 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 -2.83 0.00 -0.13 0.00 7.64 -1.26 0.03 113.62 117.07 1nqt n SER 231 Ca 0.00 0.16 -0.10 0.00 1.01 0.00 0.00 58.87 59.95 1nqt n SER 231 Cb 0.02 -0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.17 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 -1.22 0.00 1.43 -1.99 -1.76 0.11 116.97 113.54 1nqt h TYR 232 Ca 0.00 0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1nqt h TYR 232 Cb 0.00 0.59 0.00 0.00 2.00 0.00 0.00 36.73 39.32 1nqt h TYR 232 CO -0.01 -0.44 0.04 -1.33 -0.00 0.00 0.00 178.16 176.42 1nqt n MET 233 N -5.41 0.00 -0.11 4.88 2.81 0.10 -0.63 117.12 118.76 1nqt n MET 233 Ca -0.00 0.11 -0.22 0.00 -1.81 0.00 0.00 57.70 55.77 1nqt n MET 233 Cb 0.35 -1.54 -0.07 0.00 -0.71 0.00 0.00 33.22 31.25 1nqt n MET 233 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1nqt n SER 234 N -1.01 1.71 0.21 7.83 7.64 0.51 0.94 113.62 131.45 1nqt n SER 234 Ca 0.00 0.29 0.06 0.00 1.01 0.00 0.00 58.87 60.24 1nqt n SER 234 Cb 0.04 -0.70 0.34 0.00 -1.01 0.00 0.00 64.21 62.88 1nqt n SER 234 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1nqt h ILE 235 N -0.86 0.00 0.00 0.44 1.08 -0.56 1.80 117.51 119.41 1nqt h ILE 235 Ca -0.49 0.00 -0.35 0.00 -0.39 0.00 0.00 64.86 63.63 1nqt h ILE 235 Cb 1.40 0.28 -0.05 0.00 -3.07 0.00 0.00 36.82 35.37 1nqt h ILE 235 CO -0.29 0.00 -2.03 0.18 -0.69 0.00 0.00 178.15 175.31 1nqt n LEU 236 N -2.17 1.93 0.00 1.44 4.77 -0.89 -5.00 117.00 117.07 1nqt n LEU 236 Ca -0.01 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1nqt n LEU 236 Cb 0.46 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1nqt n LEU 236 CO 0.06 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1nqt n GLY 237 N 1.33 1.47 0.00 -0.72 0.00 0.61 -5.10 105.19 102.78 1nqt n GLY 237 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.00 3.70 -2.51 1.61 2.81 0.27 -4.78 117.12 117.22 1nqt n MET 238 Ca 0.00 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.80 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 -0.73 -1.00 2.03 5.66 -1.26 -4.71 114.28 114.27 1nqt n THR 239 Ca 0.00 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.63 1nqt n THR 239 Cb 0.00 -1.91 0.04 0.00 -1.55 0.00 0.00 70.33 66.90 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 -1.98 -0.01 -0.00 1.09 -0.02 -1.26 -5.03 135.00 127.79 1nqt n PRO 240 Ca -0.05 -0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.45 1nqt n PRO 240 Cb 0.55 -1.01 -0.03 0.00 -0.02 0.00 0.00 33.50 32.99 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 3.48 0.07 0.17 -1.23 0.00 -1.26 -4.45 105.19 101.97 1nqt n GLY 241 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1nqt n GLY 241 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqt n PHE 242 N -1.47 0.00 0.78 1.61 7.35 -1.26 -4.72 117.46 119.75 1nqt n PHE 242 Ca -0.00 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.70 1nqt n PHE 242 Cb 0.10 0.00 0.07 0.00 0.35 0.00 0.00 39.48 39.99 1nqt n PHE 242 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nqt n GLY 243 N 2.06 1.50 3.30 7.13 0.00 -1.26 -4.92 105.19 113.01 1nqt n GLY 243 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.08 0.00 -3.69 1.61 4.64 -1.26 -4.24 116.55 113.69 1nqt n ASP 244 Ca 0.05 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.34 1nqt n ASP 244 Cb 0.38 0.00 -0.09 0.00 -1.04 0.00 0.00 41.12 40.37 1nqt n ASP 244 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1nqt s LYS 245 N 0.00 0.58 0.17 -0.67 -0.14 -1.26 -4.09 119.74 114.32 1nqt s LYS 245 Ca 0.00 0.80 0.07 0.00 -1.36 0.00 0.00 55.97 55.48 1nqt s LYS 245 Cb 0.00 0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 36.32 1nqt s LYS 245 CO 0.00 -0.10 -0.15 0.95 -0.76 0.00 0.00 175.35 175.30 1nqt s THR 246 N 0.67 1.56 0.18 2.17 -4.23 -1.26 -1.04 115.64 113.70 1nqt s THR 246 Ca -0.03 -1.99 -0.20 0.00 -1.18 0.00 0.00 61.69 58.29 1nqt s THR 246 Cb -0.05 -1.83 0.05 0.00 1.34 0.00 0.00 72.50 72.01 1nqt s THR 246 CO -0.05 -0.51 0.57 0.72 -0.54 0.00 0.00 174.62 174.81 1nqt s PHE 247 N -2.59 -0.32 0.17 3.99 -0.71 -1.02 -1.64 117.98 115.86 1nqt s PHE 247 Ca 0.16 0.02 0.03 0.00 -1.04 0.00 0.00 56.93 56.10 1nqt s PHE 247 Cb -0.02 0.49 -0.05 0.00 -1.21 0.00 0.00 43.02 42.23 1nqt s PHE 247 CO 0.05 -0.91 -0.04 0.08 -1.34 0.00 0.00 175.22 173.06 1nqt s VAL 248 N -3.82 0.94 -0.32 -2.49 1.01 0.92 -0.61 120.40 116.04 1nqt s VAL 248 Ca 0.05 -2.02 0.03 0.00 0.00 0.00 0.00 61.98 60.04 1nqt s VAL 248 Cb -0.01 -2.06 0.16 0.00 0.00 0.00 0.00 36.38 34.47 1nqt s VAL 248 CO -0.07 -0.55 0.43 0.54 0.00 0.00 0.00 175.10 175.45 1nqt s VAL 249 N -3.48 -0.63 0.83 2.92 0.11 -0.90 -1.17 120.40 118.08 1nqt s VAL 249 Ca 0.22 -0.38 -0.13 0.00 -2.93 0.00 0.00 61.98 58.76 1nqt s VAL 249 Cb 0.05 -0.83 0.09 0.00 -1.53 0.00 0.00 36.38 34.16 1nqt s VAL 249 CO 0.03 -0.30 1.14 1.67 -3.33 0.00 0.00 175.10 174.32 1nqt n GLN 250 N 5.05 0.06 -1.17 1.54 0.00 0.11 -3.35 117.38 119.61 1nqt n GLN 250 Ca 0.04 0.10 0.00 0.00 -0.00 0.00 0.00 57.00 57.14 1nqt n GLN 250 Cb 0.50 -2.39 0.00 0.00 0.00 0.00 0.00 30.24 28.35 1nqt n GLN 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nqt n GLY 251 N 0.57 -4.33 0.03 1.69 0.00 -1.15 -3.50 105.19 98.49 1nqt n GLY 251 Ca 0.13 -0.71 0.03 0.00 0.00 0.00 0.00 46.02 45.47 1nqt n GLY 251 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqt n PHE 252 N -0.27 0.00 -0.15 1.61 -0.00 -1.26 -4.58 117.46 112.81 1nqt n PHE 252 Ca 0.00 -0.61 -0.09 0.00 -0.00 0.00 0.00 57.45 56.75 1nqt n PHE 252 Cb 0.00 -0.08 0.09 0.00 -0.00 0.00 0.00 39.48 39.49 1nqt n PHE 252 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 253 N -0.73 -3.62 0.00 7.13 0.00 -1.26 -4.13 105.19 102.57 1nqt n GLY 253 Ca 0.04 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1nqt n GLY 253 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nqt n ASN 254 N -3.82 0.00 -0.32 1.61 5.15 -1.26 -1.58 115.26 115.04 1nqt n ASN 254 Ca 0.04 0.29 0.15 0.00 -0.60 0.00 0.00 54.58 54.46 1nqt n ASN 254 Cb 0.18 0.00 0.34 0.00 -0.53 0.00 0.00 39.78 39.77 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 0.47 0.37 3.44 3.04 -1.92 -2.22 116.25 119.43 1nqt h VAL 255 Ca 0.00 -0.15 -0.02 0.00 -1.01 0.00 0.00 66.70 65.52 1nqt h VAL 255 Cb 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.29 1nqt h VAL 255 CO 0.00 0.08 -0.18 1.23 -1.01 0.00 0.00 177.57 177.69 1nqt h GLY 256 N 0.43 -0.52 -0.07 3.17 0.00 -1.64 -0.97 103.07 103.47 1nqt h GLY 256 Ca 0.59 0.19 0.06 0.00 0.00 0.00 0.00 47.33 48.17 1nqt h GLY 256 CO -0.52 -0.19 -0.38 -2.00 0.00 0.00 0.00 176.54 173.44 1nqt h LEU 257 N -0.53 -1.24 -0.49 3.11 5.85 -0.71 0.42 115.31 121.73 1nqt h LEU 257 Ca -0.05 0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1nqt h LEU 257 Cb 0.40 0.53 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 1nqt h LEU 257 CO 0.08 -0.38 0.20 0.45 -0.34 0.00 0.00 178.44 178.45 1nqt h HIS 258 N -0.38 0.74 -0.01 1.25 3.86 -1.47 0.25 115.15 119.38 1nqt h HIS 258 Ca 0.11 -0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1nqt h HIS 258 Cb 0.58 -0.22 -0.06 0.00 1.06 0.00 0.00 27.41 28.78 1nqt h HIS 258 CO -0.52 0.62 -0.51 0.77 0.86 0.00 0.00 177.93 179.15 1nqt h SER 259 N 0.64 -1.57 -0.51 2.45 0.02 -0.20 0.57 113.55 114.95 1nqt h SER 259 Ca 0.16 0.18 0.10 0.00 -0.84 0.00 0.00 61.79 61.39 1nqt h SER 259 Cb 0.19 0.60 -0.09 0.00 0.14 0.00 0.00 62.40 63.24 1nqt h SER 259 CO -0.01 -0.51 -0.07 -0.03 -1.14 0.00 0.00 176.83 175.07 1nqt h MET 260 N -0.65 0.05 0.24 3.45 -1.53 0.05 0.26 114.93 116.81 1nqt h MET 260 Ca 0.02 -0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.28 1nqt h MET 260 Cb 0.71 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.73 1nqt h MET 260 CO -0.36 0.03 -0.32 0.00 0.14 0.00 0.00 176.91 176.40 1nqt h ARG 261 N 0.05 -0.56 -0.89 0.39 2.47 0.16 0.78 114.38 116.77 1nqt h ARG 261 Ca 0.25 0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 59.00 1nqt h ARG 261 Cb 0.39 0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.79 1nqt h ARG 261 CO -0.48 -0.37 0.53 1.88 0.56 0.00 0.00 179.97 182.08 1nqt h TYR 262 N -0.58 1.19 -0.37 3.04 0.05 0.39 -0.08 116.97 120.61 1nqt h TYR 262 Ca -0.03 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.67 1nqt h TYR 262 Cb 0.52 -0.39 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 1nqt h TYR 262 CO -0.25 0.80 -0.05 1.25 -1.05 0.00 0.00 178.16 178.86 1nqt h LEU 263 N 1.24 0.67 0.05 3.88 5.85 -0.40 -3.17 115.31 123.44 1nqt h LEU 263 Ca 0.32 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1nqt h LEU 263 Cb -0.03 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1nqt h LEU 263 CO -0.06 0.85 -0.10 -0.74 -0.34 0.00 0.00 178.44 178.05 1nqt h HIS 264 N 0.48 -0.29 -0.63 1.25 2.76 -0.10 -1.95 115.15 116.67 1nqt h HIS 264 Ca 0.10 0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.46 1nqt h HIS 264 Cb 0.53 0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.59 1nqt h HIS 264 CO 0.04 -0.12 0.71 -2.13 -1.30 0.00 0.00 177.93 175.13 1nqt n ARG 265 N -2.97 0.01 -0.35 5.26 0.63 -0.11 0.29 116.66 119.42 1nqt n ARG 265 Ca -0.02 0.58 0.07 0.00 -0.92 0.00 0.00 57.85 57.57 1nqt n ARG 265 Cb 0.08 -1.44 0.23 0.00 0.45 0.00 0.00 32.46 31.78 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 -2.45 0.81 0.00 -0.14 0.99 -0.74 -4.99 117.46 110.94 1nqt n PHE 266 Ca 0.14 -0.68 0.00 0.00 -0.00 0.00 0.00 57.45 56.91 1nqt n PHE 266 Cb 0.90 -0.19 0.00 0.00 -1.00 0.00 0.00 39.48 39.19 1nqt n PHE 266 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 267 N 0.13 0.89 3.56 1.37 0.00 0.15 -5.10 105.19 106.18 1nqt n GLY 267 Ca 0.18 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1nqt n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 268 N -1.05 0.26 -0.25 4.61 0.00 -1.20 -4.63 121.76 119.51 1nqt s ALA 268 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 1nqt s ALA 268 Cb 0.00 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.87 1nqt s ALA 268 CO 0.00 -3.43 0.03 0.15 0.00 0.00 0.00 175.76 172.51 1nqt s LYS 269 N -4.54 0.97 0.08 0.00 1.02 -0.21 -4.51 119.74 112.57 1nqt s LYS 269 Ca 0.68 -0.84 -0.31 0.00 0.02 0.00 0.00 55.97 55.52 1nqt s LYS 269 Cb -0.24 -2.25 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 1nqt s LYS 269 CO 0.62 -0.75 1.69 0.00 -0.92 0.00 0.00 175.35 175.99 1nqt n ILE 271 N 4.74 1.73 0.00 0.00 3.06 0.22 -1.71 119.36 127.41 1nqt n ILE 271 Ca 0.16 -3.11 0.00 0.00 -2.50 0.00 0.00 62.75 57.30 1nqt n ILE 271 Cb 0.40 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.58 1nqt n ILE 271 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1nqt n ALA 272 N -0.59 0.00 -2.78 1.51 0.00 -1.26 -4.23 120.51 113.16 1nqt n ALA 272 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.47 1nqt n ALA 272 Cb 0.89 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.19 1nqt n ALA 272 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nqt s VAL 273 N 0.00 0.75 0.00 0.00 1.01 -1.26 -2.12 120.40 118.78 1nqt s VAL 273 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1nqt s VAL 273 Cb 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.74 1nqt s VAL 273 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1nqt n GLY 274 N 2.99 2.04 0.00 4.51 0.00 -1.21 -1.19 105.19 112.32 1nqt n GLY 274 Ca -0.15 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1nqt n GLY 274 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nqt n GLU 275 N 0.00 0.00 0.00 1.61 0.00 -0.80 -4.56 120.64 116.89 1nqt n GLU 275 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1nqt n GLU 275 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1nqt n GLU 275 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1nqt n SER 276 N 0.00 0.14 0.01 4.31 3.41 -1.26 -3.13 113.62 117.11 1nqt n SER 276 Ca 0.00 -1.09 -0.02 0.00 -0.26 0.00 0.00 58.87 57.50 1nqt n SER 276 Cb 0.00 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 63.87 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 -0.31 1.02 0.00 4.04 8.00 -1.26 -5.14 116.55 122.89 1nqt n ASP 277 Ca 0.00 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1nqt n ASP 277 Cb 0.04 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 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 3.03 3.18 0.00 0.44 0.00 -1.18 -5.04 105.19 105.62 1nqt n GLY 278 Ca -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1nqt n GLY 278 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nqt n SER 279 N 0.00 0.00 0.00 1.61 2.88 -1.26 -1.90 113.62 114.95 1nqt n SER 279 Ca 0.00 -0.95 0.00 0.00 -1.33 0.00 0.00 58.87 56.59 1nqt n SER 279 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1nqt n SER 279 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1nqt n ILE 280 N 0.00 0.00 0.00 2.46 5.41 -0.33 -4.09 119.36 122.81 1nqt n ILE 280 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1nqt n ILE 280 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1nqt n ILE 280 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 176.55 178.42 1nqt n TRP 281 N 0.00 0.00 0.00 1.39 -0.00 -1.23 -2.60 117.44 115.00 1nqt n TRP 281 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1nqt n TRP 281 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 1nqt n TRP 281 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1nqt n ASN 282 N 0.00 0.00 -0.01 5.87 2.85 -1.26 -2.49 115.26 120.21 1nqt n ASN 282 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1nqt n ASN 282 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 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 -0.00 1.20 -0.02 -1.26 -1.39 135.00 133.53 1nqt n PRO 283 Ca 0.00 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.54 1nqt n PRO 283 Cb 0.00 -1.00 -0.07 0.00 -0.02 0.00 0.00 33.50 32.41 1nqt n PRO 283 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1nqt n ASP 284 N -0.47 0.68 0.00 2.55 3.85 -1.26 -5.09 116.55 116.82 1nqt n ASP 284 Ca 0.00 -0.73 0.00 0.00 -0.71 0.00 0.00 54.79 53.35 1nqt n ASP 284 Cb 0.00 1.04 0.00 0.00 -1.35 0.00 0.00 41.12 40.81 1nqt n ASP 284 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1nqt n GLY 285 N 1.32 2.75 3.23 6.12 0.00 -0.48 -5.07 105.19 113.07 1nqt n GLY 285 Ca 0.02 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.32 1.91 0.19 -0.61 1.09 -0.69 -4.98 121.20 116.79 1nqt s ILE 286 Ca 0.00 -0.98 -0.25 0.00 -1.10 0.00 0.00 60.65 58.32 1nqt s ILE 286 Cb 0.00 -1.62 -0.08 0.00 -1.06 0.00 0.00 42.46 39.69 1nqt s ILE 286 CO 0.00 0.53 0.79 -0.62 -0.10 0.00 0.00 174.94 175.54 1nqt s ASP 287 N -0.08 7.34 0.02 3.58 2.15 -1.26 -4.54 116.67 123.89 1nqt s ASP 287 Ca -0.05 1.64 -0.26 0.00 0.43 0.00 0.00 52.55 54.31 1nqt s ASP 287 Cb -0.14 -2.50 -0.17 0.00 -0.30 0.00 0.00 42.92 39.82 1nqt s ASP 287 CO 0.04 0.15 1.32 -0.65 -0.17 0.00 0.00 175.17 175.86 1nqt h PRO 288 N 4.04 -0.44 -0.31 4.34 0.11 -1.95 -2.84 132.00 134.95 1nqt h PRO 288 Ca -0.47 0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.71 1nqt h PRO 288 Cb 1.20 0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.35 1nqt h PRO 288 CO 0.66 -0.15 -0.44 -0.22 -0.21 0.00 0.00 178.00 177.64 1nqt h LYS 289 N -0.73 -0.32 -0.89 1.05 1.63 -1.97 0.24 116.57 115.57 1nqt h LYS 289 Ca -0.05 0.02 0.11 0.00 -0.85 0.00 0.00 60.65 59.89 1nqt h LYS 289 Cb 0.50 0.07 -0.08 0.00 -0.60 0.00 0.00 32.23 32.12 1nqt h LYS 289 CO 0.08 -0.21 0.52 1.49 -3.45 0.00 0.00 179.45 177.87 1nqt h GLU 290 N -0.33 0.80 -0.17 1.90 4.81 -1.99 0.42 114.58 120.02 1nqt h GLU 290 Ca 0.05 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 1nqt h GLU 290 Cb 0.48 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1nqt h GLU 290 CO -0.46 0.53 -0.28 1.25 -0.73 0.00 0.00 179.01 179.32 1nqt h LEU 291 N 0.82 0.54 -0.20 1.64 5.85 -1.22 -1.05 115.31 121.69 1nqt h LEU 291 Ca 0.44 -0.53 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1nqt h LEU 291 Cb 0.47 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 1nqt h LEU 291 CO -0.28 0.96 -0.53 -0.08 -0.34 0.00 0.00 178.44 178.17 1nqt h GLU 292 N 0.13 -0.51 -0.03 1.25 4.81 0.36 0.89 114.58 121.47 1nqt h GLU 292 Ca 0.01 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1nqt h GLU 292 Cb 0.86 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.32 1nqt h GLU 292 CO 0.06 -0.34 -0.11 -0.44 -0.73 0.00 0.00 179.01 177.46 1nqt h ASP 293 N -0.52 -0.31 -0.59 1.04 3.32 -0.98 0.07 116.42 118.45 1nqt h ASP 293 Ca 0.04 0.05 0.11 0.00 0.02 0.00 0.00 57.03 57.25 1nqt h ASP 293 Cb 0.64 0.14 -0.11 0.00 0.22 0.00 0.00 39.33 40.22 1nqt h ASP 293 CO -0.46 -0.15 -0.31 0.15 -1.72 0.00 0.00 179.24 176.74 1nqt h PHE 294 N -0.17 -0.85 -0.33 4.55 3.57 0.15 0.85 116.94 124.72 1nqt h PHE 294 Ca 0.05 0.07 0.07 0.00 3.53 0.00 0.00 57.97 61.69 1nqt h PHE 294 Cb 0.23 0.46 -0.08 0.00 2.79 0.00 0.00 35.95 39.36 1nqt h PHE 294 CO -0.18 -0.37 -0.20 -0.22 -2.23 0.00 0.00 178.31 175.10 1nqt h LYS 295 N -0.15 -0.16 0.13 1.11 1.63 0.15 -2.85 116.57 116.44 1nqt h LYS 295 Ca 0.24 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 60.04 1nqt h LYS 295 Cb 0.54 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1nqt h LYS 295 CO -0.67 -0.10 -0.06 1.25 -3.45 0.00 0.00 179.45 176.41 1nqt h LEU 296 N -0.16 -0.15 -0.39 5.20 7.12 0.20 -3.28 115.31 123.85 1nqt h LEU 296 Ca 0.17 0.01 0.04 0.00 0.13 0.00 0.00 57.88 58.22 1nqt h LEU 296 Cb 0.42 0.04 -0.05 0.00 -0.53 0.00 0.00 40.66 40.55 1nqt h LEU 296 CO -0.43 -0.11 -0.23 0.00 -0.13 0.00 0.00 178.44 177.54 1nqt n GLN 297 N -2.49 -0.17 -3.74 1.25 6.02 0.24 -4.42 117.38 114.07 1nqt n GLN 297 Ca -0.02 0.69 -0.14 0.00 -0.01 0.00 0.00 57.00 57.52 1nqt n GLN 297 Cb 0.07 -1.02 -0.15 0.00 1.02 0.00 0.00 30.24 30.16 1nqt n GLN 297 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.06 172.67 1nqt s HIS 298 N -4.78 -0.14 0.00 1.08 -3.43 -1.08 -5.11 115.29 101.83 1nqt s HIS 298 Ca -0.05 0.46 0.00 0.00 -0.80 0.00 0.00 55.06 54.68 1nqt s HIS 298 Cb 0.04 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 31.06 1nqt s HIS 298 CO 0.24 -0.18 0.00 0.41 -2.00 0.00 0.00 174.74 173.22 1nqt n GLY 299 N 4.41 1.71 3.31 -1.38 0.00 -1.26 -4.65 105.19 107.32 1nqt n GLY 299 Ca -0.23 0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1nqt n GLY 299 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nqt s SER 300 N -3.33 2.90 0.02 1.61 0.15 -1.26 -4.71 113.70 109.08 1nqt s SER 300 Ca 0.00 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.08 1nqt s SER 300 Cb 0.00 -0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.06 1nqt s SER 300 CO 0.00 0.22 0.05 2.30 1.20 0.00 0.00 173.24 177.01 1nqt n ILE 301 N 1.76 0.00 -1.71 6.45 -5.35 -1.26 -4.60 119.36 114.66 1nqt n ILE 301 Ca -0.17 0.05 -0.43 0.00 -0.27 0.00 0.00 62.75 61.93 1nqt n ILE 301 Cb 0.52 -0.12 -0.03 0.00 -1.74 0.00 0.00 39.64 38.28 1nqt n ILE 301 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1nqt n LEU 302 N -0.38 3.79 -1.06 7.28 4.32 -1.26 -3.21 117.00 126.47 1nqt n LEU 302 Ca 0.00 1.06 -0.02 0.00 -0.02 0.00 0.00 56.01 57.03 1nqt n LEU 302 Cb 0.05 -1.54 0.01 0.00 -1.62 0.00 0.00 43.42 40.32 1nqt n LEU 302 CO 0.00 0.08 0.02 0.61 -1.22 0.00 0.00 177.39 176.88 1nqt n GLY 303 N 3.86 0.58 3.62 -0.72 0.00 -1.26 -5.04 105.19 106.23 1nqt n GLY 303 Ca 0.16 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.04 3.28 1.15 1.61 5.36 -1.20 -5.08 117.98 120.07 1nqt s PHE 304 Ca 0.04 0.43 -0.17 0.00 -0.96 0.00 0.00 56.93 56.26 1nqt s PHE 304 Cb -0.02 -2.53 0.21 0.00 -0.34 0.00 0.00 43.02 40.34 1nqt s PHE 304 CO 0.09 -0.15 0.40 -2.30 -1.46 0.00 0.00 175.22 171.79 1nqt n PRO 305 N 5.04 -2.67 -0.97 10.12 -0.02 -1.26 -3.00 135.00 142.23 1nqt n PRO 305 Ca -0.09 -0.78 -0.06 0.00 -2.02 0.00 0.00 63.50 60.55 1nqt n PRO 305 Cb 0.51 -1.68 -0.02 0.00 -0.02 0.00 0.00 33.50 32.29 1nqt n PRO 305 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1nqt n LYS 306 N -2.95 -1.74 -3.64 -0.52 5.02 -1.26 -4.88 118.16 108.19 1nqt n LYS 306 Ca 0.06 0.54 -0.13 0.00 -2.02 0.00 0.00 58.31 56.76 1nqt n LYS 306 Cb 0.49 -4.58 -0.07 0.00 -0.02 0.00 0.00 35.03 30.85 1nqt n LYS 306 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt s ALA 307 N -1.28 -1.70 -0.21 7.82 0.00 -1.16 -4.90 121.76 120.32 1nqt s ALA 307 Ca 0.00 2.00 -0.10 0.00 0.00 0.00 0.00 51.96 53.87 1nqt s ALA 307 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.90 1nqt s ALA 307 CO 0.00 -0.33 0.12 0.15 0.00 0.00 0.00 175.76 175.70 1nqt s LYS 308 N 0.62 4.08 0.42 0.00 1.02 -1.04 -4.65 119.74 120.20 1nqt s LYS 308 Ca -0.02 -0.27 -0.22 0.00 0.02 0.00 0.00 55.97 55.47 1nqt s LYS 308 Cb -0.05 -3.42 -0.13 0.00 -0.52 0.00 0.00 37.83 33.72 1nqt s LYS 308 CO -0.03 0.19 0.54 -2.30 -0.92 0.00 0.00 175.35 172.82 1nqt n PRO 309 N 3.85 0.56 -3.62 -1.68 -0.02 -1.26 -3.54 135.00 129.29 1nqt n PRO 309 Ca -0.16 0.20 -0.29 0.00 -2.02 0.00 0.00 63.50 61.24 1nqt n PRO 309 Cb 0.52 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.35 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 -1.48 0.83 0.37 6.00 6.04 -1.07 -4.90 117.35 123.14 1nqt s TYR 310 Ca 0.63 -1.16 -0.22 0.00 0.04 0.00 0.00 57.07 56.36 1nqt s TYR 310 Cb -0.60 -1.18 -0.16 0.00 -1.04 0.00 0.00 41.96 38.98 1nqt s TYR 310 CO 0.58 -0.83 0.15 0.39 -1.54 0.00 0.00 175.55 174.30 1nqt n GLU 311 N 5.10 0.00 0.00 4.97 -0.58 -1.26 -4.30 120.64 124.57 1nqt n GLU 311 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 1nqt n GLU 311 Cb 0.42 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.30 1nqt n GLU 311 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nqt n GLY 312 N 2.28 1.63 3.11 0.62 0.00 -1.26 -4.84 105.19 106.73 1nqt n GLY 312 Ca 0.12 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1nqt n GLY 312 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nqt s SER 313 N -4.00 0.78 0.00 1.61 0.15 -1.26 -4.74 113.70 106.24 1nqt s SER 313 Ca 0.00 -0.93 0.25 0.00 0.70 0.00 0.00 55.95 55.97 1nqt s SER 313 Cb 0.00 0.14 0.54 0.00 -1.71 0.00 0.00 66.02 64.98 1nqt s SER 313 CO 0.00 -0.49 1.43 2.30 1.20 0.00 0.00 173.24 177.68 1nqt n ILE 314 N 0.26 0.00 0.21 6.45 -0.00 -1.26 -4.36 119.36 120.66 1nqt n ILE 314 Ca -0.15 -0.18 0.08 0.00 -0.00 0.00 0.00 62.75 62.50 1nqt n ILE 314 Cb 0.60 0.68 0.40 0.00 -0.00 0.00 0.00 39.64 41.33 1nqt n ILE 314 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1nqt h LEU 315 N 1.73 0.00 0.01 7.28 3.38 -1.98 0.48 115.31 126.21 1nqt h LEU 315 Ca 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 1nqt h LEU 315 Cb 0.59 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 1nqt h LEU 315 CO 0.00 0.00 -2.39 -0.62 0.09 0.00 0.00 178.44 175.52 1nqt n GLU 316 N -2.24 0.67 -1.36 1.13 4.71 -1.26 -4.63 120.64 117.66 1nqt n GLU 316 Ca -0.01 0.10 -0.49 0.00 -0.01 0.00 0.00 57.16 56.75 1nqt n GLU 316 Cb 0.42 -1.54 -0.13 0.00 -1.01 0.00 0.00 31.44 29.18 1nqt n GLU 316 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nqt n ALA 317 N -3.02 0.25 -1.66 0.62 0.00 0.17 -3.63 120.51 113.24 1nqt n ALA 317 Ca -0.39 -0.06 -0.63 0.00 0.00 0.00 0.00 53.44 52.36 1nqt n ALA 317 Cb 1.06 -2.15 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 1nqt n ALA 317 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1nqt n ASP 318 N 8.97 1.54 0.00 0.00 2.03 -1.26 -4.79 116.55 123.03 1nqt n ASP 318 Ca 0.60 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.96 1nqt n ASP 318 Cb -0.00 -0.98 0.00 0.00 -0.72 0.00 0.00 41.12 39.42 1nqt n ASP 318 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nqt n ASP 320 N 0.00 0.00 -3.77 0.00 4.64 -1.20 -4.81 116.55 111.42 1nqt n ASP 320 Ca 0.00 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 53.13 1nqt n ASP 320 Cb 0.00 0.12 -0.16 0.00 -1.04 0.00 0.00 41.12 40.04 1nqt n ASP 320 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1nqt s ILE 321 N -1.37 0.70 -0.02 5.18 1.01 -0.65 -2.48 121.20 123.57 1nqt s ILE 321 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 60.65 59.80 1nqt s ILE 321 Cb 0.00 -1.20 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1nqt s ILE 321 CO 0.00 -0.23 0.35 -0.22 0.00 0.00 0.00 174.94 174.85 1nqt s LEU 322 N 1.77 4.46 -0.16 2.97 1.98 -0.12 -0.05 118.68 129.53 1nqt s LEU 322 Ca -0.01 0.86 0.00 0.00 -2.89 0.00 0.00 54.13 52.09 1nqt s LEU 322 Cb -0.17 -2.49 0.03 0.00 0.66 0.00 0.00 46.19 44.22 1nqt s LEU 322 CO -0.09 0.34 -0.09 -0.63 -1.89 0.00 0.00 176.35 173.99 1nqt s ILE 323 N -1.07 1.35 -0.32 6.68 1.01 -0.32 -1.58 121.20 126.94 1nqt s ILE 323 Ca 0.22 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.24 1nqt s ILE 323 Cb -0.16 -1.39 0.30 0.00 0.01 0.00 0.00 42.46 41.22 1nqt s ILE 323 CO 0.12 0.27 1.29 -2.65 0.00 0.00 0.00 174.94 173.97 1nqt n PRO 324 N 4.81 1.82 -1.40 2.79 -0.02 -1.22 0.03 135.00 141.82 1nqt n PRO 324 Ca -0.14 -1.28 -0.52 0.00 -2.02 0.00 0.00 63.50 59.54 1nqt n PRO 324 Cb 0.48 -1.58 -0.08 0.00 -0.02 0.00 0.00 33.50 32.30 1nqt n PRO 324 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nqt n ALA 325 N -0.07 0.84 0.00 3.55 0.00 -1.23 -4.20 120.51 119.41 1nqt n ALA 325 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1nqt n ALA 325 Cb 0.90 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.91 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 9.45 0.00 -1.97 0.00 0.00 -1.26 -2.96 120.51 123.77 1nqt n ALA 326 Ca 0.45 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.66 1nqt n ALA 326 Cb 0.16 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.67 1nqt n ALA 326 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nqt s SER 327 N -4.00 5.09 0.49 0.00 1.04 -1.26 -4.85 113.70 110.20 1nqt s SER 327 Ca 0.00 0.25 -0.16 0.00 0.48 0.00 0.00 55.95 56.52 1nqt s SER 327 Cb 0.00 -1.04 -0.08 0.00 0.10 0.00 0.00 66.02 65.01 1nqt s SER 327 CO 0.00 -1.34 0.94 -1.83 0.98 0.00 0.00 173.24 171.99 1nqt s GLU 328 N -4.99 3.93 -0.10 4.02 -1.05 -1.26 -4.59 118.70 114.66 1nqt s GLU 328 Ca 0.58 0.87 -0.03 0.00 -0.15 0.00 0.00 54.97 56.24 1nqt s GLU 328 Cb -0.11 -2.19 0.00 0.00 -0.44 0.00 0.00 34.13 31.40 1nqt s GLU 328 CO 0.42 -0.21 0.06 0.36 0.95 0.00 0.00 175.26 176.84 1nqt n LYS 329 N -1.47 -1.08 0.00 -4.83 2.85 -0.63 -4.93 118.16 108.06 1nqt n LYS 329 Ca 0.06 1.25 0.00 0.00 -1.05 0.00 0.00 58.31 58.57 1nqt n LYS 329 Cb 0.54 -2.03 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 1nqt n LYS 329 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1nqt n GLN 330 N 1.03 2.51 -3.98 -1.58 -0.06 0.11 -4.92 117.38 110.48 1nqt n GLN 330 Ca -0.00 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.69 1nqt n GLN 330 Cb 0.41 -0.74 -0.15 0.00 -4.06 0.00 0.00 30.24 25.71 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 -1.87 4.49 0.38 1.69 1.43 -1.19 -5.01 118.68 118.60 1nqt s LEU 331 Ca 0.00 -2.25 0.08 0.00 -1.03 0.00 0.00 54.13 50.92 1nqt s LEU 331 Cb 0.00 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 1nqt s LEU 331 CO 0.00 -0.36 0.22 0.42 0.23 0.00 0.00 176.35 176.86 1nqt s THR 332 N 0.77 2.74 0.52 5.49 -4.23 -1.26 -1.66 115.64 118.01 1nqt s THR 332 Ca 0.12 -1.59 0.42 0.00 -1.18 0.00 0.00 61.69 59.46 1nqt s THR 332 Cb -0.20 -3.00 0.64 0.00 1.34 0.00 0.00 72.50 71.27 1nqt s THR 332 CO -0.08 -0.08 1.64 0.50 -0.54 0.00 0.00 174.62 176.06 1nqt h LYS 333 N 1.37 0.03 0.00 3.99 3.64 -1.93 -0.61 116.57 123.05 1nqt h LYS 333 Ca -0.43 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1nqt h LYS 333 Cb 1.26 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1nqt h LYS 333 CO 0.64 0.02 0.00 0.43 -2.27 0.00 0.00 179.45 178.26 1nqt n SER 334 N -4.18 0.00 -0.28 4.20 7.64 -1.26 -4.01 113.62 115.73 1nqt n SER 334 Ca 0.38 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.34 1nqt n SER 334 Cb 1.69 0.00 0.31 0.00 -1.01 0.00 0.00 64.21 65.20 1nqt n SER 334 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1nqt h ASN 335 N 0.00 0.78 -0.14 6.43 7.08 -1.85 -3.32 115.58 124.55 1nqt h ASN 335 Ca 0.00 0.02 0.06 0.00 -3.08 0.00 0.00 56.30 53.30 1nqt h ASN 335 Cb 0.00 -0.14 -0.02 0.00 -2.08 0.00 0.00 38.32 36.08 1nqt h ASN 335 CO 0.00 0.46 0.08 0.00 -2.08 0.00 0.00 177.43 175.89 1nqt n ALA 336 N -2.41 0.15 0.08 4.14 0.00 -0.25 0.18 120.51 122.40 1nqt n ALA 336 Ca 0.15 0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.56 1nqt n ALA 336 Cb 0.32 -0.14 -0.09 0.00 0.00 0.00 0.00 19.45 19.53 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 0.43 -6.24 0.00 0.11 -1.78 -3.39 132.00 121.13 1nqt h PRO 337 Ca 0.12 -0.55 -0.57 0.00 0.11 0.00 0.00 66.00 65.11 1nqt h PRO 337 Cb 0.32 0.18 -0.09 0.00 0.11 0.00 0.00 31.00 31.52 1nqt h PRO 337 CO -0.10 1.21 1.26 0.50 -0.21 0.00 0.00 178.00 180.67 1nqt s ARG 338 N -3.02 3.37 -0.30 1.05 3.52 0.49 -4.80 118.95 119.27 1nqt s ARG 338 Ca -0.06 -0.64 -0.09 0.00 -0.13 0.00 0.00 55.73 54.80 1nqt s ARG 338 Cb 0.07 -4.73 0.17 0.00 -1.56 0.00 0.00 34.95 28.91 1nqt s ARG 338 CO 0.89 -2.18 0.85 0.14 -0.81 0.00 0.00 175.30 174.19 1nqt s VAL 339 N 5.40 -0.65 0.26 7.11 -7.23 -1.26 -4.71 120.40 119.32 1nqt s VAL 339 Ca 0.40 0.00 0.13 0.00 -1.81 0.00 0.00 61.98 60.70 1nqt s VAL 339 Cb -0.04 -1.00 0.03 0.00 0.56 0.00 0.00 36.38 35.93 1nqt s VAL 339 CO 0.03 0.00 1.67 0.11 -0.31 0.00 0.00 175.10 176.61 1nqt h LYS 340 N 7.89 0.00 -6.65 4.82 1.79 -1.82 -3.46 116.57 119.14 1nqt h LYS 340 Ca -0.18 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.71 1nqt h LYS 340 Cb 1.15 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.92 1nqt h LYS 340 CO 0.08 0.52 0.26 0.00 -1.08 0.00 0.00 179.45 179.22 1nqt n ALA 341 N -2.39 0.43 0.01 3.86 0.00 -1.26 -4.72 120.51 116.44 1nqt n ALA 341 Ca -0.01 0.29 0.08 0.00 0.00 0.00 0.00 53.44 53.80 1nqt n ALA 341 Cb 0.56 -2.12 -0.13 0.00 0.00 0.00 0.00 19.45 17.76 1nqt n ALA 341 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nqt n LYS 342 N 0.33 0.65 -3.77 0.00 4.76 -1.14 -4.90 118.16 114.09 1nqt n LYS 342 Ca 0.08 -0.07 -0.22 0.00 -2.87 0.00 0.00 58.31 55.23 1nqt n LYS 342 Cb 0.37 -1.61 -0.18 0.00 -1.84 0.00 0.00 35.03 31.77 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 -3.31 0.25 -0.20 -0.18 1.01 -1.03 -1.75 121.20 115.98 1nqt s ILE 343 Ca -0.06 0.18 -0.05 0.00 0.00 0.00 0.00 60.65 60.72 1nqt s ILE 343 Cb 0.12 -0.43 -0.03 0.00 0.01 0.00 0.00 42.46 42.13 1nqt s ILE 343 CO 0.87 0.23 0.01 -0.63 0.00 0.00 0.00 174.94 175.42 1nqt s ILE 344 N 1.92 4.04 -0.44 2.92 1.01 -1.10 -0.94 121.20 128.61 1nqt s ILE 344 Ca 0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 1nqt s ILE 344 Cb -0.12 -2.83 0.12 0.00 0.01 0.00 0.00 42.46 39.63 1nqt s ILE 344 CO -0.04 0.42 0.25 0.00 0.00 0.00 0.00 174.94 175.57 1nqt s ALA 345 N 0.99 3.24 -0.76 9.38 0.00 -0.62 0.20 121.76 134.19 1nqt s ALA 345 Ca 0.02 -2.59 -0.26 0.00 0.00 0.00 0.00 51.96 49.14 1nqt s ALA 345 Cb -0.14 -2.52 -0.10 0.00 0.00 0.00 0.00 23.12 20.35 1nqt s ALA 345 CO 0.02 -1.85 2.28 -1.21 0.00 0.00 0.00 175.76 175.00 1nqt s GLU 346 N 1.11 1.93 0.48 0.00 2.02 -0.62 -3.37 118.70 120.25 1nqt s GLU 346 Ca 0.08 0.45 0.30 0.00 0.02 0.00 0.00 54.97 55.83 1nqt s GLU 346 Cb -0.23 -4.80 1.13 0.00 0.10 0.00 0.00 34.13 30.33 1nqt s GLU 346 CO -0.03 -3.97 1.88 0.78 0.02 0.00 0.00 175.26 173.94 1nqt h GLY 347 N 20.82 0.00 -1.42 -1.39 0.00 -1.89 -3.34 103.07 115.85 1nqt h GLY 347 Ca -0.03 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.77 1nqt h GLY 347 CO 1.08 0.00 -0.54 0.00 0.00 0.00 0.00 176.54 177.08 1nqt s ALA 348 N -3.52 2.80 0.26 3.60 0.00 -1.26 -4.71 121.76 118.93 1nqt s ALA 348 Ca 0.03 -1.41 -0.29 0.00 0.00 0.00 0.00 51.96 50.29 1nqt s ALA 348 Cb 0.08 0.71 -0.09 0.00 0.00 0.00 0.00 23.12 23.83 1nqt s ALA 348 CO 0.54 -0.32 1.21 -0.80 0.00 0.00 0.00 175.76 176.39 1nqt s ASN 349 N -3.58 7.03 -0.47 0.00 0.01 -1.26 -4.18 114.94 112.49 1nqt s ASN 349 Ca 0.26 2.39 -0.13 0.00 -0.71 0.00 0.00 52.86 54.67 1nqt s ASN 349 Cb 0.04 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.10 1nqt s ASN 349 CO 0.14 -0.36 0.46 0.61 -1.51 0.00 0.00 177.10 176.44 1nqt n GLY 350 N 1.52 -0.45 0.07 0.66 0.00 -1.26 -4.61 105.19 101.13 1nqt n GLY 350 Ca 0.02 0.63 -0.09 0.00 0.00 0.00 0.00 46.02 46.58 1nqt n GLY 350 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt h PRO 351 N 0.74 0.00 -7.35 1.61 0.13 -1.84 -1.68 132.00 123.60 1nqt h PRO 351 Ca -0.45 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.17 1nqt h PRO 351 Cb 1.03 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.22 1nqt h PRO 351 CO 0.22 0.37 0.41 -0.08 -0.23 0.00 0.00 178.00 178.69 1nqt s THR 352 N -2.10 4.53 0.00 1.56 -1.32 -1.26 0.05 115.64 117.10 1nqt s THR 352 Ca -0.15 0.84 0.00 0.00 -1.21 0.00 0.00 61.69 61.17 1nqt s THR 352 Cb 0.02 -3.74 0.00 0.00 -1.51 0.00 0.00 72.50 67.26 1nqt s THR 352 CO 0.32 -1.06 0.00 0.35 -2.21 0.00 0.00 174.62 172.02 1nqt n THR 353 N -2.79 0.00 -0.05 5.08 -2.24 -0.67 -4.76 114.28 108.86 1nqt n THR 353 Ca 0.06 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.63 1nqt n THR 353 Cb 0.54 -1.36 -0.13 0.00 -2.10 0.00 0.00 70.33 67.28 1nqt n THR 353 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1nqt n PRO 354 N -0.46 0.67 -0.10 -0.78 -0.02 -1.26 -3.77 135.00 129.27 1nqt n PRO 354 Ca 0.00 0.41 -0.12 0.00 -2.02 0.00 0.00 63.50 61.77 1nqt n PRO 354 Cb 0.00 -1.72 -0.07 0.00 -0.02 0.00 0.00 33.50 31.68 1nqt n PRO 354 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1nqt h GLU 355 N -0.43 -0.39 -1.01 -0.52 4.39 -1.95 0.73 114.58 115.39 1nqt h GLU 355 Ca -0.39 0.03 0.26 0.00 0.34 0.00 0.00 59.36 59.59 1nqt h GLU 355 Cb 1.70 0.09 -0.12 0.00 -0.10 0.00 0.00 28.75 30.31 1nqt h GLU 355 CO -0.06 -0.26 0.60 0.00 -1.16 0.00 0.00 179.01 178.14 1nqt h ALA 356 N 0.15 1.88 -0.19 3.43 0.00 -1.82 -0.03 119.26 122.67 1nqt h ALA 356 Ca 0.10 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.15 1nqt h ALA 356 Cb 0.61 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1nqt h ALA 356 CO -0.55 -0.37 0.06 -0.44 0.00 0.00 0.00 179.25 177.94 1nqt h ASP 357 N 0.52 0.06 -0.12 0.00 3.32 -0.95 -0.31 116.42 118.92 1nqt h ASP 357 Ca 0.66 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.77 1nqt h ASP 357 Cb 1.35 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.86 1nqt h ASP 357 CO -0.47 0.06 -0.23 0.11 -1.72 0.00 0.00 179.24 176.99 1nqt h LYS 358 N 0.14 -0.28 0.04 3.56 1.57 -0.61 -1.02 116.57 119.97 1nqt h LYS 358 Ca 0.08 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1nqt h LYS 358 Cb 0.06 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1nqt h LYS 358 CO -0.09 -0.19 -0.13 0.82 -0.57 0.00 0.00 179.45 179.29 1nqt h ILE 359 N -0.29 0.70 -0.01 1.86 5.03 -1.18 -0.64 117.51 122.96 1nqt h ILE 359 Ca 0.10 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.84 1nqt h ILE 359 Cb 0.44 0.70 -0.00 0.00 -3.03 0.00 0.00 36.82 34.93 1nqt h ILE 359 CO -0.29 0.00 0.01 -0.26 -0.68 0.00 0.00 178.15 176.93 1nqt h PHE 360 N -0.23 0.00 -0.05 1.37 0.04 -0.82 -1.19 116.94 116.06 1nqt h PHE 360 Ca 0.03 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.70 1nqt h PHE 360 Cb 0.27 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.42 1nqt h PHE 360 CO -0.17 0.00 -0.37 -0.07 -0.60 0.00 0.00 178.31 177.11 1nqt h LEU 361 N 0.00 0.41 -1.11 1.54 3.38 0.16 0.70 115.31 120.39 1nqt h LEU 361 Ca 0.00 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 57.29 1nqt h LEU 361 Cb 0.03 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1nqt h LEU 361 CO -0.00 1.03 0.48 -0.33 0.09 0.00 0.00 178.44 179.71 1nqt h GLU 362 N -0.18 1.08 -1.41 1.13 5.08 -0.01 -3.04 114.58 117.24 1nqt h GLU 362 Ca -0.03 -0.10 -0.69 0.00 -1.00 0.00 0.00 59.36 57.54 1nqt h GLU 362 Cb 1.04 -0.23 -0.31 0.00 0.50 0.00 0.00 28.75 29.76 1nqt h GLU 362 CO 0.07 0.76 0.65 2.89 -1.00 0.00 0.00 179.01 182.39 1nqt n ARG 363 N -4.37 2.87 -3.88 2.33 1.85 -0.73 -4.96 116.66 109.76 1nqt n ARG 363 Ca 0.09 -3.57 -0.32 0.00 -1.00 0.00 0.00 57.85 53.05 1nqt n ARG 363 Cb 0.07 -2.28 0.01 0.00 -1.05 0.00 0.00 32.46 29.21 1nqt n ARG 363 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1nqt n ASN 364 N -0.71 -3.16 -4.65 2.89 2.85 -1.15 -4.94 115.26 106.38 1nqt n ASN 364 Ca 0.56 -0.92 -0.33 0.00 -0.11 0.00 0.00 54.58 53.77 1nqt n ASN 364 Cb 0.52 -1.17 -0.09 0.00 1.24 0.00 0.00 39.78 40.27 1nqt n ASN 364 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1nqt s ILE 365 N -3.64 4.02 -0.65 -1.44 -1.09 0.24 -4.87 121.20 113.78 1nqt s ILE 365 Ca 0.28 -0.58 -0.04 0.00 -2.23 0.00 0.00 60.65 58.08 1nqt s ILE 365 Cb -0.16 -2.76 0.17 0.00 -1.58 0.00 0.00 42.46 38.13 1nqt s ILE 365 CO 0.71 0.43 0.48 -0.32 -1.23 0.00 0.00 174.94 175.01 1nqt s MET 366 N -1.38 2.70 -0.10 2.79 -2.45 -0.72 -4.62 119.30 115.53 1nqt s MET 366 Ca 0.18 -2.51 -0.30 0.00 -1.25 0.00 0.00 55.69 51.81 1nqt s MET 366 Cb -0.11 -3.83 -0.02 0.00 1.25 0.00 0.00 34.83 32.12 1nqt s MET 366 CO 0.08 -1.19 1.07 0.08 1.05 0.00 0.00 175.02 176.10 1nqt s VAL 367 N -0.01 4.62 -0.41 10.11 1.01 -1.26 -2.71 120.40 131.76 1nqt s VAL 367 Ca 0.17 1.91 -0.15 0.00 0.00 0.00 0.00 61.98 63.90 1nqt s VAL 367 Cb -0.19 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 31.98 1nqt s VAL 367 CO -0.04 -0.01 0.32 -0.63 0.00 0.00 0.00 175.10 174.75 1nqt s ILE 368 N 2.13 5.23 0.23 2.22 1.01 0.13 -4.21 121.20 127.94 1nqt s ILE 368 Ca 0.50 -0.58 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 1nqt s ILE 368 Cb -0.20 -3.94 -0.14 0.00 0.01 0.00 0.00 42.46 38.19 1nqt s ILE 368 CO 0.19 -0.32 1.31 -2.65 0.00 0.00 0.00 174.94 173.47 1nqt n PRO 369 N 5.24 1.78 -0.08 2.79 -0.02 -1.26 -1.58 135.00 141.87 1nqt n PRO 369 Ca -0.10 0.63 -0.13 0.00 -2.02 0.00 0.00 63.50 61.88 1nqt n PRO 369 Cb 0.47 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.65 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 3.75 -1.59 -0.52 2.55 -0.00 -1.81 0.52 116.42 119.30 1nqt h ASP 370 Ca -0.44 0.21 0.15 0.00 -0.00 0.00 0.00 57.03 56.95 1nqt h ASP 370 Cb 1.30 0.66 -0.02 0.00 -0.00 0.00 0.00 39.33 41.26 1nqt h ASP 370 CO 0.72 -0.42 0.73 -0.11 -0.00 0.00 0.00 179.24 180.16 1nqt n LEU 371 N -5.42 0.00 0.02 0.15 7.94 -1.26 -1.00 117.00 117.43 1nqt n LEU 371 Ca -0.03 0.44 -0.01 0.00 -1.11 0.00 0.00 56.01 55.30 1nqt n LEU 371 Cb 0.36 -0.13 -0.00 0.00 0.53 0.00 0.00 43.42 44.18 1nqt n LEU 371 CO 0.06 -0.44 -0.33 0.00 -1.11 0.00 0.00 177.39 175.57 1nqt n TYR 372 N -2.35 0.00 0.05 1.96 4.19 0.20 -4.65 117.16 116.57 1nqt n TYR 372 Ca 0.12 0.00 -0.12 0.00 3.31 0.00 0.00 57.90 61.21 1nqt n TYR 372 Cb 0.89 -0.02 -0.05 0.00 0.49 0.00 0.00 39.34 40.64 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 -0.03 -0.99 -3.92 2.98 5.85 0.14 -2.51 115.31 116.84 1nqt h LEU 373 Ca -0.01 0.13 -0.40 0.00 0.84 0.00 0.00 57.88 58.44 1nqt h LEU 373 Cb 0.64 0.40 -0.15 0.00 0.37 0.00 0.00 40.66 41.92 1nqt h LEU 373 CO -0.01 -0.39 0.39 -0.46 -0.34 0.00 0.00 178.44 177.64 1nqt n ASN 374 N -5.42 6.46 -0.69 1.25 2.04 -0.17 -3.70 115.26 115.04 1nqt n ASN 374 Ca -0.05 -3.12 0.07 0.00 -0.44 0.00 0.00 54.58 51.04 1nqt n ASN 374 Cb 0.33 -1.14 0.14 0.00 -2.53 0.00 0.00 39.78 36.59 1nqt n ASN 374 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nqt n ALA 375 N 0.59 2.30 0.10 -2.53 0.00 -0.95 -4.42 120.51 115.61 1nqt n ALA 375 Ca 0.38 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1nqt n ALA 375 Cb 0.58 -0.50 0.31 0.00 0.00 0.00 0.00 19.45 19.83 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 2.51 0.27 0.73 0.00 0.00 -1.80 -0.88 103.07 103.89 1nqt h GLY 376 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1nqt h GLY 376 CO 0.00 0.19 -0.15 -1.33 0.00 0.00 0.00 176.54 175.25 1nqt h GLY 377 N 0.98 -0.42 -0.05 4.60 0.00 -1.79 -2.42 103.07 103.98 1nqt h GLY 377 Ca 0.03 0.16 0.07 0.00 0.00 0.00 0.00 47.33 47.59 1nqt h GLY 377 CO 0.04 -0.15 -0.31 -2.08 0.00 0.00 0.00 176.54 174.04 1nqt h VAL 378 N -0.68 0.27 -0.22 4.60 2.07 -1.79 -1.34 116.25 119.15 1nqt h VAL 378 Ca -0.04 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 378 Cb 0.47 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.45 1nqt h VAL 378 CO 0.07 0.00 -0.44 0.74 0.02 0.00 0.00 177.57 177.96 1nqt h THR 379 N -0.28 0.00 -0.44 2.57 2.02 -1.10 -1.29 112.91 114.39 1nqt h THR 379 Ca 0.15 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.38 1nqt h THR 379 Cb 0.53 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.86 1nqt h THR 379 CO -0.47 0.00 -0.49 0.58 0.37 0.00 0.00 175.52 175.51 1nqt h VAL 380 N -0.40 0.00 -0.49 3.16 2.07 -1.04 -0.58 116.25 118.97 1nqt h VAL 380 Ca 0.04 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.66 1nqt h VAL 380 Cb 0.51 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.19 1nqt h VAL 380 CO -0.41 0.00 -0.13 -0.24 0.02 0.00 0.00 177.57 176.81 1nqt n SER 381 N -5.00 -0.19 0.31 0.57 2.88 -0.54 0.51 113.62 112.16 1nqt n SER 381 Ca -0.02 0.85 0.19 0.00 -1.33 0.00 0.00 58.87 58.55 1nqt n SER 381 Cb 0.28 -0.25 0.97 0.00 -0.75 0.00 0.00 64.21 64.46 1nqt n SER 381 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1nqt h TYR 382 N 0.00 0.00 0.21 0.66 -0.00 -0.07 -1.28 116.97 116.49 1nqt h TYR 382 Ca 0.23 0.00 -0.33 0.00 -0.00 0.00 0.00 58.73 58.63 1nqt h TYR 382 Cb 0.36 0.00 0.02 0.00 -0.00 0.00 0.00 36.73 37.11 1nqt h TYR 382 CO -0.38 0.03 -1.57 0.74 -0.00 0.00 0.00 178.16 176.98 1nqt h PHE 383 N 0.00 0.80 -0.68 -3.82 0.05 1.23 -2.87 116.94 111.65 1nqt h PHE 383 Ca -0.00 -0.58 0.08 0.00 3.82 0.00 0.00 57.97 61.29 1nqt h PHE 383 Cb 0.18 -0.03 -0.07 0.00 2.00 0.00 0.00 35.95 38.03 1nqt h PHE 383 CO 0.00 1.61 0.35 1.49 -0.18 0.00 0.00 178.31 181.58 1nqt h GLU 384 N 0.06 0.60 0.36 1.51 4.81 -0.59 1.32 114.58 122.65 1nqt h GLU 384 Ca -0.30 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1nqt h GLU 384 Cb 2.08 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 31.30 1nqt h GLU 384 CO 0.21 0.39 -0.42 2.35 -0.73 0.00 0.00 179.01 180.81 1nqt h TRP 385 N 0.61 -1.15 -0.07 0.92 7.01 -1.33 -1.16 115.95 120.79 1nqt h TRP 385 Ca 0.33 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.37 1nqt h TRP 385 Cb 0.30 0.46 -0.03 0.00 -2.10 0.00 0.00 29.16 27.79 1nqt h TRP 385 CO -0.10 -0.56 -0.10 -0.07 -2.79 0.00 0.00 178.44 174.81 1nqt h LEU 386 N -0.81 -0.31 -0.73 0.65 3.38 -0.87 -1.39 115.31 115.23 1nqt h LEU 386 Ca -0.03 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.07 1nqt h LEU 386 Cb 0.74 0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.55 1nqt h LEU 386 CO -0.10 -0.14 -0.43 1.17 0.09 0.00 0.00 178.44 179.03 1nqt n LYS 387 N -5.24 -0.32 0.00 1.13 4.81 0.44 0.02 118.16 119.00 1nqt n LYS 387 Ca -0.04 1.14 0.00 0.00 -0.87 0.00 0.00 58.31 58.54 1nqt n LYS 387 Cb 0.16 -1.68 0.00 0.00 0.02 0.00 0.00 35.03 33.53 1nqt n LYS 387 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1nqt n ASN 388 N -4.85 0.00 0.18 3.14 3.02 -0.53 -0.72 115.26 115.49 1nqt n ASN 388 Ca 0.01 0.84 0.00 0.00 -0.03 0.00 0.00 54.58 55.40 1nqt n ASN 388 Cb 0.19 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1nqt n ASN 388 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1nqt n LEU 389 N -1.92 0.00 -0.08 3.41 4.77 0.70 -0.65 117.00 123.23 1nqt n LEU 389 Ca 0.00 0.27 -0.07 0.00 -0.03 0.00 0.00 56.01 56.18 1nqt n LEU 389 Cb 0.00 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 1nqt n LEU 389 CO 0.00 -0.27 -1.06 0.59 -1.33 0.00 0.00 177.39 175.32 1nqt n ASN 390 N -1.77 0.44 -0.98 -1.43 4.13 0.10 -5.02 115.26 110.72 1nqt n ASN 390 Ca 0.00 0.00 -0.10 0.00 1.68 0.00 0.00 54.58 56.16 1nqt n ASN 390 Cb 0.75 1.07 -0.02 0.00 -1.54 0.00 0.00 39.78 40.03 1nqt n ASN 390 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1nqt n HIS 391 N -2.63 -0.26 -3.66 3.10 8.25 0.17 -5.02 115.22 115.18 1nqt n HIS 391 Ca -0.27 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.06 1nqt n HIS 391 Cb 1.03 -2.22 -0.08 0.00 1.12 0.00 0.00 29.99 29.85 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 -2.45 -0.00 0.13 1.59 1.01 -1.26 -5.11 120.40 114.32 1nqt s VAL 392 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 61.98 61.67 1nqt s VAL 392 Cb 0.00 -0.89 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 1nqt s VAL 392 CO 0.00 0.00 1.52 -0.94 0.00 0.00 0.00 175.10 175.68 1nqt s SER 393 N 0.40 6.67 0.10 3.32 1.04 -1.26 -4.89 113.70 119.08 1nqt s SER 393 Ca -0.00 2.50 -0.36 0.00 0.48 0.00 0.00 55.95 58.56 1nqt s SER 393 Cb -0.05 -2.59 -0.16 0.00 0.10 0.00 0.00 66.02 63.32 1nqt s SER 393 CO -0.00 -0.77 1.34 -1.22 0.98 0.00 0.00 173.24 173.57 1nqt n TYR 394 N 4.17 1.55 0.00 5.02 4.02 -1.26 -1.54 117.16 129.12 1nqt n TYR 394 Ca 0.13 0.61 0.00 0.00 -0.01 0.00 0.00 57.90 58.64 1nqt n TYR 394 Cb 0.40 -2.34 0.00 0.00 -0.02 0.00 0.00 39.34 37.38 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 2.54 3.09 0.38 2.72 0.00 -1.26 -4.16 105.19 108.49 1nqt n GLY 395 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 1nqt n GLY 395 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nqt h ARG 396 N 2.19 0.00 -0.00 1.61 1.12 -1.66 0.19 114.38 117.84 1nqt h ARG 396 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1nqt h ARG 396 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1nqt h ARG 396 CO 0.00 0.00 -0.13 1.28 -3.11 0.00 0.00 179.97 178.01 1nqt n LEU 397 N -2.80 0.49 -0.03 3.80 4.77 -1.26 -4.81 117.00 117.16 1nqt n LEU 397 Ca 0.05 -0.63 -0.03 0.00 -0.03 0.00 0.00 56.01 55.37 1nqt n LEU 397 Cb 0.96 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.99 1nqt n LEU 397 CO 0.09 0.11 -0.73 0.35 -1.33 0.00 0.00 177.39 175.88 1nqt n THR 398 N -0.73 0.45 -0.33 -5.08 -2.24 0.62 -4.58 114.28 102.39 1nqt n THR 398 Ca 0.01 -0.31 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 1nqt n THR 398 Cb 0.07 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 67.62 1nqt n THR 398 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1nqt h PHE 399 N 0.00 -1.57 -0.27 4.78 0.05 -1.73 0.64 116.94 118.84 1nqt h PHE 399 Ca -0.18 0.11 -0.01 0.00 3.82 0.00 0.00 57.97 61.71 1nqt h PHE 399 Cb 1.31 0.80 -0.01 0.00 2.00 0.00 0.00 35.95 40.05 1nqt h PHE 399 CO 0.00 -0.40 0.12 -0.22 -0.18 0.00 0.00 178.31 177.62 1nqt h LYS 400 N -0.10 0.40 -0.55 1.51 1.63 -1.86 -0.35 116.57 117.25 1nqt h LYS 400 Ca 0.19 -0.07 0.07 0.00 -0.85 0.00 0.00 60.65 60.00 1nqt h LYS 400 Cb 0.51 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.01 1nqt h LYS 400 CO -0.86 0.41 0.22 -0.92 -3.45 0.00 0.00 179.45 174.86 1nqt h TYR 401 N 0.29 0.39 0.40 1.91 3.20 -1.38 -1.28 116.97 120.49 1nqt h TYR 401 Ca 0.09 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 1nqt h TYR 401 Cb 0.16 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.34 1nqt h TYR 401 CO -0.01 0.13 -0.19 0.93 -1.64 0.00 0.00 178.16 177.38 1nqt h GLU 402 N 0.42 -0.51 -0.85 1.82 5.08 0.45 -1.49 114.58 119.50 1nqt h GLU 402 Ca 0.27 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.75 1nqt h GLU 402 Cb 0.28 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.54 1nqt h GLU 402 CO -0.25 -0.25 -0.47 -2.13 -1.00 0.00 0.00 179.01 174.92 1nqt n ARG 403 N -5.25 -0.34 0.15 2.33 0.63 -0.16 -0.37 116.66 113.66 1nqt n ARG 403 Ca -0.11 1.29 -0.16 0.00 -0.92 0.00 0.00 57.85 57.95 1nqt n ARG 403 Cb 0.27 -1.90 -0.10 0.00 0.45 0.00 0.00 32.46 31.18 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 -1.51 -0.89 6.15 3.45 -1.15 -1.49 116.42 120.99 1nqt h ASP 404 Ca 0.17 0.15 0.20 0.00 0.43 0.00 0.00 57.03 57.98 1nqt h ASP 404 Cb 0.38 0.54 -0.12 0.00 -0.56 0.00 0.00 39.33 39.58 1nqt h ASP 404 CO -0.81 -0.57 0.41 0.28 -1.57 0.00 0.00 179.24 176.99 1nqt h SER 405 N -0.79 0.40 0.29 6.45 0.02 0.18 0.20 113.55 120.31 1nqt h SER 405 Ca -0.02 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1nqt h SER 405 Cb 0.76 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.39 1nqt h SER 405 CO -0.23 0.06 -0.21 0.78 -1.14 0.00 0.00 176.83 176.09 1nqt h ASN 406 N 0.47 -0.56 -0.93 3.07 -0.26 -0.03 -0.53 115.58 116.81 1nqt h ASN 406 Ca 0.54 0.04 0.27 0.00 -0.56 0.00 0.00 56.30 56.58 1nqt h ASN 406 Cb 0.96 0.17 -0.14 0.00 -1.06 0.00 0.00 38.32 38.25 1nqt h ASN 406 CO -0.48 -0.31 0.37 1.88 -1.06 0.00 0.00 177.43 177.83 1nqt h TYR 407 N -0.48 0.59 -0.86 1.19 0.99 -0.31 0.97 116.97 119.06 1nqt h TYR 407 Ca -0.04 0.05 0.01 0.00 2.00 0.00 0.00 58.73 60.74 1nqt h TYR 407 Cb 0.40 -0.11 -0.04 0.00 1.00 0.00 0.00 36.73 37.98 1nqt h TYR 407 CO -0.05 -0.19 0.56 0.45 -0.00 0.00 0.00 178.16 178.93 1nqt h HIS 408 N 0.26 1.09 0.49 4.88 3.86 -0.62 0.15 115.15 125.27 1nqt h HIS 408 Ca 0.63 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.83 1nqt h HIS 408 Cb 1.33 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 29.44 1nqt h HIS 408 CO -0.16 0.69 -0.25 1.25 0.86 0.00 0.00 177.93 180.32 1nqt h LEU 409 N 1.17 -0.61 -0.55 2.43 7.12 0.26 -1.07 115.31 124.05 1nqt h LEU 409 Ca 0.31 0.02 0.07 0.00 0.13 0.00 0.00 57.88 58.42 1nqt h LEU 409 Cb -0.12 0.16 -0.10 0.00 -0.53 0.00 0.00 40.66 40.08 1nqt h LEU 409 CO -0.07 -0.42 -0.51 -0.07 -0.13 0.00 0.00 178.44 177.25 1nqt h LEU 410 N -0.68 -1.74 -1.64 2.25 3.38 -1.11 -0.40 115.31 115.36 1nqt h LEU 410 Ca -0.07 0.26 0.34 0.00 0.09 0.00 0.00 57.88 58.50 1nqt h LEU 410 Cb 0.53 0.75 -0.08 0.00 0.09 0.00 0.00 40.66 41.95 1nqt h LEU 410 CO 0.10 -0.36 0.81 0.24 0.09 0.00 0.00 178.44 179.33 1nqt h MET 411 N -0.28 0.17 0.02 1.13 2.86 -0.55 0.22 114.93 118.49 1nqt h MET 411 Ca 0.13 -0.01 -0.22 0.00 -2.06 0.00 0.00 59.70 57.54 1nqt h MET 411 Cb 0.56 -0.04 0.02 0.00 0.06 0.00 0.00 31.60 32.20 1nqt h MET 411 CO -0.68 0.11 -0.86 0.77 1.06 0.00 0.00 176.91 177.32 1nqt h SER 412 N 0.17 0.72 -0.25 1.22 0.02 0.26 -1.47 113.55 114.23 1nqt h SER 412 Ca 0.64 -0.77 0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1nqt h SER 412 Cb 2.10 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 64.36 1nqt h SER 412 CO -0.19 1.40 -0.11 0.58 -1.14 0.00 0.00 176.83 177.37 1nqt h VAL 413 N 0.13 0.64 0.00 2.27 2.07 -0.14 0.70 116.25 121.92 1nqt h VAL 413 Ca -0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1nqt h VAL 413 Cb 1.54 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1nqt h VAL 413 CO 0.17 0.00 0.00 1.67 0.02 0.00 0.00 177.57 179.43 1nqt n GLN 414 N -5.28 0.00 -0.31 1.57 7.27 0.47 -1.00 117.38 120.10 1nqt n GLN 414 Ca -0.01 0.24 0.13 0.00 0.07 0.00 0.00 57.00 57.43 1nqt n GLN 414 Cb 0.19 -1.02 0.25 0.00 2.41 0.00 0.00 30.24 32.08 1nqt n GLN 414 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1nqt n GLU 415 N -0.78 -0.07 0.30 3.69 1.02 -0.56 0.07 120.64 124.30 1nqt n GLU 415 Ca 0.00 1.35 -0.16 0.00 -0.02 0.00 0.00 57.16 58.33 1nqt n GLU 415 Cb 0.00 -2.13 -0.08 0.00 -0.02 0.00 0.00 31.44 29.20 1nqt n GLU 415 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1nqt h SER 416 N 0.00 -1.10 -0.70 1.62 0.02 -0.64 -0.17 113.55 112.57 1nqt h SER 416 Ca 0.54 0.08 0.15 0.00 -0.84 0.00 0.00 61.79 61.71 1nqt h SER 416 Cb 1.09 0.34 -0.11 0.00 0.14 0.00 0.00 62.40 63.86 1nqt h SER 416 CO -0.85 -0.59 0.11 -0.07 -1.14 0.00 0.00 176.83 174.29 1nqt h LEU 417 N -0.92 -0.11 -0.99 5.07 4.07 0.14 0.48 115.31 123.06 1nqt h LEU 417 Ca -0.07 0.15 0.12 0.00 0.08 0.00 0.00 57.88 58.16 1nqt h LEU 417 Cb 0.76 0.23 -0.08 0.00 1.08 0.00 0.00 40.66 42.65 1nqt h LEU 417 CO 0.01 -0.07 0.62 -0.33 -1.08 0.00 0.00 178.44 177.59 1nqt h GLU 418 N 0.21 0.95 -2.41 1.13 5.08 -0.35 -2.39 114.58 116.80 1nqt h GLU 418 Ca 0.39 -0.06 -0.25 0.00 -1.00 0.00 0.00 59.36 58.43 1nqt h GLU 418 Cb 0.65 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1nqt h GLU 418 CO -0.53 0.63 0.64 0.54 -1.00 0.00 0.00 179.01 179.29 1nqt n ARG 419 N -4.63 2.01 -2.44 2.33 1.74 0.17 -1.40 116.66 114.44 1nqt n ARG 419 Ca 0.18 -1.09 -0.03 0.00 -0.77 0.00 0.00 57.85 56.14 1nqt n ARG 419 Cb 0.35 -2.10 0.08 0.00 -1.02 0.00 0.00 32.46 29.77 1nqt n ARG 419 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1nqt n LYS 420 N 2.88 0.88 0.00 5.56 4.81 -0.90 -5.01 118.16 126.38 1nqt n LYS 420 Ca 0.43 -1.04 0.00 0.00 -0.87 0.00 0.00 58.31 56.83 1nqt n LYS 420 Cb 0.63 0.17 0.00 0.00 0.02 0.00 0.00 35.03 35.84 1nqt n LYS 420 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1nqt n PHE 421 N -0.86 0.00 -0.02 5.64 -0.00 -0.50 -5.07 117.46 116.65 1nqt n PHE 421 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.33 1nqt n PHE 421 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.24 1nqt n PHE 421 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 422 N 0.00 0.87 3.37 7.13 0.00 -1.26 -4.76 105.19 110.54 1nqt n GLY 422 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 2.65 0.47 0.00 1.61 2.47 -1.26 -5.08 119.74 120.60 1nqt s LYS 423 Ca 0.00 0.93 0.00 0.00 -1.56 0.00 0.00 55.97 55.34 1nqt s LYS 423 Cb 0.00 0.06 0.00 0.00 -1.46 0.00 0.00 37.83 36.43 1nqt s LYS 423 CO 0.00 -0.16 0.48 -2.39 0.16 0.00 0.00 175.35 173.44 1nqt n HIS 424 N 4.37 0.00 -1.61 4.03 1.44 -1.26 -3.40 115.22 118.80 1nqt n HIS 424 Ca -0.21 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.49 1nqt n HIS 424 Cb 0.56 -0.01 -0.01 0.00 0.12 0.00 0.00 29.99 30.64 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 0.09 0.46 0.12 -1.39 0.00 -1.26 -4.98 105.19 98.23 1nqt n GLY 425 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 0.12 -4.88 -0.02 0.00 -1.95 -3.43 103.07 92.90 1nqt h GLY 426 Ca -0.07 -0.19 -0.67 0.00 0.00 0.00 0.00 47.33 46.40 1nqt h GLY 426 CO -0.03 0.17 -0.66 -1.59 0.00 0.00 0.00 176.54 174.43 1nqt s THR 427 N -3.27 4.04 -0.55 4.70 2.01 -1.26 -5.08 115.64 116.22 1nqt s THR 427 Ca -0.02 -0.63 0.05 0.00 0.31 0.00 0.00 61.69 61.40 1nqt s THR 427 Cb 0.11 -2.79 0.18 0.00 0.01 0.00 0.00 72.50 70.02 1nqt s THR 427 CO 0.80 0.39 0.46 -0.38 -0.69 0.00 0.00 174.62 175.20 1nqt n ILE 428 N 1.47 0.30 -0.05 1.82 2.08 -1.26 -4.88 119.36 118.83 1nqt n ILE 428 Ca -0.15 -4.22 -0.08 0.00 0.56 0.00 0.00 62.75 58.86 1nqt n ILE 428 Cb 0.53 -1.94 -0.07 0.00 -0.75 0.00 0.00 39.64 37.41 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 5.25 -0.01 0.00 0.38 0.11 -1.93 -3.38 132.00 132.41 1nqt h PRO 429 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1nqt h PRO 429 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1nqt h PRO 429 CO 0.56 0.53 0.00 0.44 -0.21 0.00 0.00 178.00 179.32 1nqt n ILE 430 N -4.70 0.00 -4.06 4.15 -5.35 -1.26 -4.32 119.36 103.82 1nqt n ILE 430 Ca -0.06 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.11 1nqt n ILE 430 Cb 0.27 -0.08 -0.16 0.00 -1.74 0.00 0.00 39.64 37.93 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 0.00 1.91 1.25 7.28 0.11 -1.26 -4.93 120.40 124.77 1nqt s VAL 431 Ca 0.00 -1.09 -0.17 0.00 -2.93 0.00 0.00 61.98 57.79 1nqt s VAL 431 Cb 0.00 -1.88 0.31 0.00 -1.53 0.00 0.00 36.38 33.28 1nqt s VAL 431 CO 0.00 0.29 1.00 -2.84 -3.33 0.00 0.00 175.10 170.22 1nqt s PRO 432 N 1.30 -1.61 0.70 1.54 0.02 -1.26 -4.98 135.00 130.70 1nqt s PRO 432 Ca -0.00 0.45 -0.11 0.00 0.02 0.00 0.00 61.00 61.36 1nqt s PRO 432 Cb -0.16 -1.50 0.01 0.00 0.02 0.00 0.00 34.50 32.87 1nqt s PRO 432 CO -0.09 -4.08 1.06 0.95 -0.33 0.00 0.00 177.00 174.51 1nqt s THR 433 N -2.49 3.92 0.19 0.99 -4.23 -1.26 -4.81 115.64 107.94 1nqt s THR 433 Ca 0.68 0.62 -0.12 0.00 -1.18 0.00 0.00 61.69 61.70 1nqt s THR 433 Cb -0.19 -3.43 0.10 0.00 1.34 0.00 0.00 72.50 70.32 1nqt s THR 433 CO 0.61 -0.81 1.82 0.00 -0.54 0.00 0.00 174.62 175.69 1nqt h ALA 434 N -0.72 0.77 -0.19 3.99 0.00 -1.99 -0.99 119.26 120.13 1nqt h ALA 434 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1nqt h ALA 434 Cb 1.22 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1nqt h ALA 434 CO 0.59 0.07 0.00 0.39 0.00 0.00 0.00 179.25 180.29 1nqt n GLU 435 N -4.77 0.00 -0.26 0.00 4.71 -1.26 -1.21 120.64 117.86 1nqt n GLU 435 Ca 0.06 0.65 0.04 0.00 -0.01 0.00 0.00 57.16 57.89 1nqt n GLU 435 Cb 0.10 -1.47 0.09 0.00 -1.01 0.00 0.00 31.44 29.15 1nqt n GLU 435 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1nqt n PHE 436 N -2.26 0.22 -0.21 -0.32 -0.00 -1.08 0.28 117.46 114.09 1nqt n PHE 436 Ca 0.00 0.86 -0.02 0.00 -0.00 0.00 0.00 57.45 58.29 1nqt n PHE 436 Cb 0.00 -0.89 0.19 0.00 -0.00 0.00 0.00 39.48 38.78 1nqt n PHE 436 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.76 177.13 1nqt h GLN 437 N 0.00 0.99 -0.09 -4.13 5.75 -0.72 -0.96 115.11 115.94 1nqt h GLN 437 Ca 0.32 -0.13 -0.08 0.00 -0.15 0.00 0.00 58.65 58.61 1nqt h GLN 437 Cb 0.50 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.85 1nqt h GLN 437 CO -0.72 0.76 -0.32 -0.44 -2.65 0.00 0.00 178.83 175.46 1nqt h ASP 438 N 0.99 0.18 0.78 -0.69 3.45 0.54 -0.87 116.42 120.80 1nqt h ASP 438 Ca 0.24 -0.06 -0.22 0.00 0.43 0.00 0.00 57.03 57.42 1nqt h ASP 438 Cb 0.09 -0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 38.79 1nqt h ASP 438 CO -0.03 0.50 -1.02 -0.09 -1.57 0.00 0.00 179.24 177.02 1nqt h ARG 439 N 0.16 0.12 -0.05 3.56 2.43 -0.53 -2.63 114.38 117.44 1nqt h ARG 439 Ca 0.02 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 58.90 1nqt h ARG 439 Cb 0.65 0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1nqt h ARG 439 CO 0.05 1.03 -0.38 0.82 -1.51 0.00 0.00 179.97 179.98 1nqt h ILE 440 N 0.05 1.44 0.52 1.20 2.04 -1.05 -2.57 117.51 119.14 1nqt h ILE 440 Ca -0.05 -1.83 -0.03 0.00 1.00 0.00 0.00 64.86 63.95 1nqt h ILE 440 Cb 1.73 2.43 0.01 0.00 -0.74 0.00 0.00 36.82 40.24 1nqt h ILE 440 CO 0.15 0.53 -0.25 0.28 0.00 0.00 0.00 178.15 178.86 1nqt h SER 441 N -0.17 -0.59 -0.58 1.72 0.02 -1.24 -3.18 113.55 109.53 1nqt h SER 441 Ca -0.03 0.02 -0.26 0.00 -0.84 0.00 0.00 61.79 60.68 1nqt h SER 441 Cb 1.06 0.15 -0.15 0.00 0.14 0.00 0.00 62.40 63.60 1nqt h SER 441 CO 0.08 -0.42 0.33 0.61 -1.14 0.00 0.00 176.83 176.28 1nqt n GLY 442 N -1.37 3.34 3.35 -3.77 0.00 -0.99 -4.99 105.19 100.77 1nqt n GLY 442 Ca -0.12 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.34 -2.57 -3.65 4.61 0.00 -0.97 -4.98 120.51 112.62 1nqt n ALA 443 Ca 0.34 -0.36 -0.00 0.00 0.00 0.00 0.00 53.44 53.42 1nqt n ALA 443 Cb 1.17 -1.67 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.44 -0.10 0.12 0.00 1.04 -1.26 -5.03 113.70 107.03 1nqt s SER 444 Ca 0.59 -0.19 -0.24 0.00 0.48 0.00 0.00 55.95 56.58 1nqt s SER 444 Cb -0.31 0.24 -0.05 0.00 0.10 0.00 0.00 66.02 66.01 1nqt s SER 444 CO 0.65 -0.45 1.65 -0.08 0.98 0.00 0.00 173.24 175.99 1nqt h GLU 445 N 2.00 -0.31 -1.17 4.02 4.81 -1.94 -2.17 114.58 119.83 1nqt h GLU 445 Ca -0.28 0.02 0.39 0.00 -0.13 0.00 0.00 59.36 59.36 1nqt h GLU 445 Cb 1.21 0.07 -0.14 0.00 0.63 0.00 0.00 28.75 30.52 1nqt h GLU 445 CO 0.27 -0.21 0.72 1.57 -0.73 0.00 0.00 179.01 180.64 1nqt h LYS 446 N -0.32 0.16 0.40 1.92 2.10 -1.92 0.20 116.57 119.11 1nqt h LYS 446 Ca 0.07 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.70 1nqt h LYS 446 Cb 0.41 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.69 1nqt h LYS 446 CO -0.22 0.11 -0.39 -0.44 -2.00 0.00 0.00 179.45 176.51 1nqt h ASP 447 N 0.17 -1.05 -0.80 7.07 5.19 -1.73 0.32 116.42 125.58 1nqt h ASP 447 Ca 0.78 0.09 0.12 0.00 -0.62 0.00 0.00 57.03 57.40 1nqt h ASP 447 Cb 2.19 0.35 -0.06 0.00 0.18 0.00 0.00 39.33 41.99 1nqt h ASP 447 CO -0.50 -0.54 0.53 0.40 -3.12 0.00 0.00 179.24 176.01 1nqt h ILE 448 N -0.80 0.88 -0.05 0.35 1.08 -0.70 0.38 117.51 118.64 1nqt h ILE 448 Ca -0.03 -0.22 -0.03 0.00 -0.39 0.00 0.00 64.86 64.18 1nqt h ILE 448 Cb 0.72 0.18 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 1nqt h ILE 448 CO -0.06 0.12 -0.10 0.58 -0.69 0.00 0.00 178.15 178.00 1nqt h VAL 449 N 0.64 1.42 0.06 1.67 2.07 -0.80 -1.15 116.25 120.16 1nqt h VAL 449 Ca 0.39 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 1nqt h VAL 449 Cb 0.61 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1nqt h VAL 449 CO -0.15 0.39 -0.03 0.45 0.02 0.00 0.00 177.57 178.24 1nqt h HIS 450 N -0.35 -0.08 -0.11 1.57 3.86 0.26 0.28 115.15 120.59 1nqt h HIS 450 Ca 0.00 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1nqt h HIS 450 Cb 0.67 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.14 1nqt h HIS 450 CO 0.12 -0.01 -0.25 1.03 0.86 0.00 0.00 177.93 179.67 1nqt h SER 451 N -0.12 -0.81 -1.12 2.45 0.87 -0.29 -1.13 113.55 113.40 1nqt h SER 451 Ca -0.01 0.10 0.34 0.00 -1.23 0.00 0.00 61.79 60.99 1nqt h SER 451 Cb 0.10 0.32 -0.12 0.00 -0.44 0.00 0.00 62.40 62.26 1nqt h SER 451 CO 0.01 -0.21 0.70 1.23 -0.53 0.00 0.00 176.83 178.04 1nqt h GLY 452 N -0.23 1.50 0.89 5.77 0.00 -0.97 0.14 103.07 110.17 1nqt h GLY 452 Ca 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 1nqt h GLY 452 CO -0.23 -0.33 0.09 -2.00 0.00 0.00 0.00 176.54 174.07 1nqt h LEU 453 N 0.27 0.34 -1.39 3.11 6.46 0.27 -2.28 115.31 122.10 1nqt h LEU 453 Ca 0.71 -0.18 -0.04 0.00 -0.12 0.00 0.00 57.88 58.25 1nqt h LEU 453 Cb 1.92 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 41.75 1nqt h LEU 453 CO -0.43 0.43 -0.20 0.00 -0.62 0.00 0.00 178.44 177.63 1nqt h ALA 454 N 0.92 1.10 0.00 1.25 0.00 0.03 0.67 119.26 123.23 1nqt h ALA 454 Ca 0.08 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1nqt h ALA 454 Cb 0.21 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1nqt h ALA 454 CO -0.00 0.25 -0.85 -0.92 0.00 0.00 0.00 179.25 177.72 1nqt h TYR 455 N 0.00 0.00 0.00 0.00 5.03 -1.21 -2.01 116.97 118.78 1nqt h TYR 455 Ca -0.00 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 1nqt h TYR 455 Cb 0.61 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.89 1nqt h TYR 455 CO 0.00 0.27 -0.02 1.15 -1.32 0.00 0.00 178.16 178.24 1nqt h THR 456 N 0.00 1.78 0.00 1.81 2.02 -0.80 -2.88 112.91 114.85 1nqt h THR 456 Ca -0.05 -2.32 0.01 0.00 0.77 0.00 0.00 66.41 64.82 1nqt h THR 456 Cb 1.25 3.36 -0.04 0.00 -1.74 0.00 0.00 68.15 70.98 1nqt h THR 456 CO 0.03 0.60 -0.38 0.24 0.37 0.00 0.00 175.52 176.38 1nqt h MET 457 N -0.97 -0.47 0.00 6.66 2.86 -0.99 -1.05 114.93 120.97 1nqt h MET 457 Ca -0.00 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1nqt h MET 457 Cb 1.00 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.77 1nqt h MET 457 CO 0.00 -0.31 0.00 -1.91 1.06 0.00 0.00 176.91 175.75 1nqt n GLU 458 N -4.60 0.00 -0.21 1.72 2.13 -0.75 -1.05 120.64 117.87 1nqt n GLU 458 Ca -0.05 0.43 0.20 0.00 0.66 0.00 0.00 57.16 58.40 1nqt n GLU 458 Cb 0.28 -1.02 0.36 0.00 0.27 0.00 0.00 31.44 31.34 1nqt n GLU 458 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1nqt n ARG 459 N -0.99 -0.03 0.15 5.31 0.63 -1.09 0.21 116.66 120.85 1nqt n ARG 459 Ca 0.00 0.80 0.07 0.00 -0.92 0.00 0.00 57.85 57.80 1nqt n ARG 459 Cb 0.00 -1.47 0.06 0.00 0.45 0.00 0.00 32.46 31.49 1nqt n ARG 459 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 1nqt h SER 460 N 0.00 0.00 0.17 6.15 0.02 -0.18 -2.42 113.55 117.29 1nqt h SER 460 Ca 0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.45 1nqt h SER 460 Cb 1.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1nqt h SER 460 CO -0.41 0.27 -0.08 0.00 -1.14 0.00 0.00 176.83 175.47 1nqt h ALA 461 N 1.73 -0.23 -0.77 3.77 0.00 0.42 -0.98 119.26 123.20 1nqt h ALA 461 Ca -0.02 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 54.84 1nqt h ALA 461 Cb 1.23 0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.98 1nqt h ALA 461 CO 0.03 -0.35 0.14 0.00 0.00 0.00 0.00 179.25 179.07 1nqt h ARG 462 N -0.78 0.20 0.06 0.00 2.47 -1.40 0.73 114.38 115.67 1nqt h ARG 462 Ca -0.02 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1nqt h ARG 462 Cb 0.52 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1nqt h ARG 462 CO 0.04 0.13 -0.04 1.96 0.56 0.00 0.00 179.97 182.62 1nqt h GLN 463 N 0.21 -0.10 -0.33 0.04 4.20 -1.30 -1.45 115.11 116.38 1nqt h GLN 463 Ca 0.45 0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.22 1nqt h GLN 463 Cb 0.80 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.56 1nqt h GLN 463 CO -0.58 -0.06 0.02 0.82 -0.67 0.00 0.00 178.83 178.35 1nqt h ILE 464 N -0.10 0.79 0.00 2.54 2.04 0.46 -0.72 117.51 122.52 1nqt h ILE 464 Ca -0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1nqt h ILE 464 Cb 0.09 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1nqt h ILE 464 CO 0.00 0.02 0.00 0.23 0.00 0.00 0.00 178.15 178.40 1nqt n MET 465 N -5.14 0.00 -0.28 2.37 2.81 -0.03 -1.16 117.12 115.69 1nqt n MET 465 Ca 0.01 0.51 -0.05 0.00 -1.81 0.00 0.00 57.70 56.36 1nqt n MET 465 Cb 0.16 -1.27 -0.03 0.00 -0.71 0.00 0.00 33.22 31.37 1nqt n MET 465 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 1nqt n ARG 466 N -1.68 -0.25 0.34 0.03 0.63 -0.58 0.34 116.66 115.50 1nqt n ARG 466 Ca 0.00 1.03 0.19 0.00 -0.92 0.00 0.00 57.85 58.16 1nqt n ARG 466 Cb 0.00 -1.53 1.04 0.00 0.45 0.00 0.00 32.46 32.42 1nqt n ARG 466 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1nqt h THR 467 N 0.00 0.01 0.00 5.15 2.02 -0.80 0.76 112.91 120.04 1nqt h THR 467 Ca 0.16 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.17 1nqt h THR 467 Cb 0.33 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1nqt h THR 467 CO -0.65 0.00 -1.54 0.00 0.37 0.00 0.00 175.52 173.70 1nqt n ALA 468 N -2.00 1.97 1.33 6.16 0.00 1.05 -3.33 120.51 125.70 1nqt n ALA 468 Ca -0.02 -0.60 0.13 0.00 0.00 0.00 0.00 53.44 52.94 1nqt n ALA 468 Cb 0.22 -0.88 0.44 0.00 0.00 0.00 0.00 19.45 19.23 1nqt n ALA 468 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nqt n MET 469 N -2.82 1.07 -0.09 0.00 2.00 0.10 0.94 117.12 118.31 1nqt n MET 469 Ca -0.11 -0.61 -0.23 0.00 0.00 0.00 0.00 57.70 56.75 1nqt n MET 469 Cb 0.84 -1.49 -0.12 0.00 0.00 0.00 0.00 33.22 32.45 1nqt n MET 469 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1nqt n LYS 470 N -0.44 0.62 -1.19 0.03 4.81 -0.27 -4.07 118.16 117.66 1nqt n LYS 470 Ca 0.14 0.40 -0.28 0.00 -0.87 0.00 0.00 58.31 57.70 1nqt n LYS 470 Cb 0.34 -1.67 0.10 0.00 0.02 0.00 0.00 35.03 33.83 1nqt n LYS 470 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1nqt n TYR 471 N -4.06 2.84 -2.45 5.64 4.01 -1.21 -4.93 117.16 117.00 1nqt n TYR 471 Ca -0.38 -2.45 0.00 0.00 -0.16 0.00 0.00 57.90 54.91 1nqt n TYR 471 Cb 0.84 -1.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.67 1nqt n TYR 471 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1nqt n ASN 472 N -0.76 0.00 -0.06 7.72 3.02 -1.04 -4.83 115.26 119.31 1nqt n ASN 472 Ca 0.55 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 55.06 1nqt n ASN 472 Cb 0.95 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.97 1nqt n ASN 472 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1nqt n LEU 473 N -0.50 0.22 0.00 3.41 4.77 0.27 -5.01 117.00 120.15 1nqt n LEU 473 Ca 0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1nqt n LEU 473 Cb 0.00 0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1nqt n LEU 473 CO 0.00 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1nqt n GLY 474 N 1.59 0.75 2.79 -0.72 0.00 -1.26 -4.03 105.19 104.31 1nqt n GLY 474 Ca -0.23 -1.24 -0.37 0.00 0.00 0.00 0.00 46.02 44.18 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 6.78 -1.08 0.99 4.32 -1.26 -4.41 117.00 122.34 1nqt n LEU 475 Ca 0.00 -5.04 -0.03 0.00 -0.02 0.00 0.00 56.01 50.92 1nqt n LEU 475 Cb 0.00 -0.93 0.20 0.00 -1.62 0.00 0.00 43.42 41.07 1nqt n LEU 475 CO 0.00 1.93 0.63 -0.67 -1.22 0.00 0.00 177.39 178.07 1nqt n ASP 476 N -0.44 2.31 -0.16 -1.43 -0.08 -1.26 -4.51 116.55 110.98 1nqt n ASP 476 Ca 0.49 -3.82 0.08 0.00 -1.51 0.00 0.00 54.79 50.03 1nqt n ASP 476 Cb 0.33 -0.62 0.15 0.00 2.34 0.00 0.00 41.12 43.32 1nqt n ASP 476 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1nqt n LEU 477 N -1.13 -0.03 0.00 -2.67 4.32 -1.26 -1.81 117.00 114.42 1nqt n LEU 477 Ca 0.31 0.80 0.00 0.00 -0.02 0.00 0.00 56.01 57.10 1nqt n LEU 477 Cb 0.98 -0.30 0.00 0.00 -1.62 0.00 0.00 43.42 42.48 1nqt n LEU 477 CO 0.15 -0.82 0.21 0.54 -1.22 0.00 0.00 177.39 176.25 1nqt n ARG 478 N -4.48 0.00 -0.37 3.23 1.74 -1.26 -1.54 116.66 113.98 1nqt n ARG 478 Ca 0.12 0.24 -0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1nqt n ARG 478 Cb 0.39 -0.93 0.05 0.00 -1.02 0.00 0.00 32.46 30.95 1nqt n ARG 478 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1nqt n THR 479 N -0.67 -0.50 -0.48 0.55 -2.24 -0.75 0.31 114.28 110.49 1nqt n THR 479 Ca 0.00 2.27 0.40 0.00 -2.27 0.00 0.00 64.05 64.45 1nqt n THR 479 Cb 0.00 -3.00 0.68 0.00 -2.10 0.00 0.00 70.33 65.91 1nqt n THR 479 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nqt h ALA 480 N 1.38 2.91 0.13 6.98 0.00 -1.26 0.38 119.26 129.77 1nqt h ALA 480 Ca 0.35 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1nqt h ALA 480 Cb 0.59 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1nqt h ALA 480 CO -0.96 -1.56 -0.06 0.00 0.00 0.00 0.00 179.25 176.67 1nqt h ALA 481 N 1.54 -0.20 -1.12 0.00 0.00 0.60 -1.77 119.26 118.31 1nqt h ALA 481 Ca 0.86 -0.04 0.40 0.00 0.00 0.00 0.00 54.91 56.13 1nqt h ALA 481 Cb 2.82 0.07 -0.15 0.00 0.00 0.00 0.00 17.79 20.52 1nqt h ALA 481 CO -0.39 -0.19 0.66 1.88 0.00 0.00 0.00 179.25 181.21 1nqt h TYR 482 N -0.85 0.75 0.26 0.00 0.05 0.24 0.60 116.97 118.02 1nqt h TYR 482 Ca -0.02 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1nqt h TYR 482 Cb 0.13 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.69 1nqt h TYR 482 CO 0.01 -0.29 -0.12 0.28 -1.05 0.00 0.00 178.16 176.98 1nqt h VAL 483 N 0.13 0.79 -1.02 -2.88 2.07 -0.45 -0.43 116.25 114.46 1nqt h VAL 483 Ca 0.80 -0.58 0.26 0.00 0.82 0.00 0.00 66.70 68.00 1nqt h VAL 483 Cb 2.19 1.11 -0.11 0.00 -1.52 0.00 0.00 31.29 32.96 1nqt h VAL 483 CO -0.59 0.12 0.63 -1.13 0.02 0.00 0.00 177.57 176.61 1nqt h ASN 484 N -0.66 0.59 -0.05 0.57 -1.24 0.10 -0.32 115.58 114.57 1nqt h ASN 484 Ca -0.04 0.12 -0.11 0.00 0.71 0.00 0.00 56.30 56.98 1nqt h ASN 484 Cb 0.46 0.03 0.01 0.00 0.73 0.00 0.00 38.32 39.55 1nqt h ASN 484 CO 0.06 0.09 -0.42 0.00 -1.29 0.00 0.00 177.43 175.87 1nqt h ALA 485 N 1.69 0.12 -0.53 1.57 0.00 -0.73 -2.70 119.26 118.68 1nqt h ALA 485 Ca 0.63 -0.49 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1nqt h ALA 485 Cb 1.36 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.10 1nqt h ALA 485 CO -0.42 0.25 0.23 0.82 0.00 0.00 0.00 179.25 180.13 1nqt h ILE 486 N -0.14 0.87 -0.02 0.00 1.08 0.00 0.52 117.51 119.82 1nqt h ILE 486 Ca -0.04 -0.15 0.03 0.00 -0.39 0.00 0.00 64.86 64.31 1nqt h ILE 486 Cb 1.10 0.40 -0.06 0.00 -3.07 0.00 0.00 36.82 35.19 1nqt h ILE 486 CO 0.08 0.08 -0.47 -0.33 -0.69 0.00 0.00 178.15 176.82 1nqt h GLU 487 N 0.43 -0.59 0.15 2.37 5.08 -1.13 0.98 114.58 121.88 1nqt h GLU 487 Ca 0.25 0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.66 1nqt h GLU 487 Cb 0.24 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 1nqt h GLU 487 CO -0.22 -0.39 -0.43 0.87 -1.00 0.00 0.00 179.01 177.83 1nqt h LYS 488 N -0.61 -0.63 -0.23 2.33 1.57 -0.95 0.68 116.57 118.73 1nqt h LYS 488 Ca 0.04 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.93 1nqt h LYS 488 Cb 0.68 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1nqt h LYS 488 CO -0.35 -0.42 0.23 0.28 -0.57 0.00 0.00 179.45 178.63 1nqt h VAL 489 N -0.65 0.52 0.05 0.50 2.07 -0.79 -2.02 116.25 115.92 1nqt h VAL 489 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 489 Cb 0.64 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1nqt h VAL 489 CO -0.21 0.00 -0.02 0.15 0.02 0.00 0.00 177.57 177.51 1nqt h PHE 490 N 0.00 -0.06 -0.99 1.57 3.57 0.41 -3.11 116.94 118.32 1nqt h PHE 490 Ca 0.11 -0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.82 1nqt h PHE 490 Cb 0.58 0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.22 1nqt h PHE 490 CO 0.00 0.56 0.59 -0.22 -2.23 0.00 0.00 178.31 177.00 1nqt h LYS 491 N -0.78 0.64 -0.02 1.11 3.64 -0.18 0.87 116.57 121.84 1nqt h LYS 491 Ca -0.01 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1nqt h LYS 491 Cb 0.64 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1nqt h LYS 491 CO 0.01 0.42 0.01 0.28 -2.27 0.00 0.00 179.45 177.90 1nqt h VAL 492 N 0.66 1.14 0.94 2.00 2.07 -1.54 -0.61 116.25 120.91 1nqt h VAL 492 Ca 0.60 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.66 1nqt h VAL 492 Cb 1.04 1.38 0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1nqt h VAL 492 CO -0.43 0.11 -0.45 1.88 0.02 0.00 0.00 177.57 178.70 1nqt h TYR 493 N -0.13 -1.17 -0.89 1.57 0.05 -0.98 -3.05 116.97 112.37 1nqt h TYR 493 Ca 0.01 -0.03 0.23 0.00 0.05 0.00 0.00 58.73 58.99 1nqt h TYR 493 Cb 0.17 0.39 -0.13 0.00 1.01 0.00 0.00 36.73 38.17 1nqt h TYR 493 CO -0.02 -0.73 0.33 -0.97 -1.05 0.00 0.00 178.16 175.72 1nqt h ASN 494 N -1.30 0.19 -0.49 3.88 -0.00 0.71 -1.58 115.58 116.98 1nqt h ASN 494 Ca -0.13 0.17 -0.37 0.00 -0.00 0.00 0.00 56.30 55.98 1nqt h ASN 494 Cb 0.97 0.19 -0.11 0.00 -0.00 0.00 0.00 38.32 39.37 1nqt h ASN 494 CO 0.21 -0.08 0.29 -0.62 -0.00 0.00 0.00 177.43 177.24 1nqt n GLU 495 N -5.13 2.38 0.00 6.67 1.02 -0.24 -4.20 120.64 121.14 1nqt n GLU 495 Ca 0.22 -1.73 0.00 0.00 -0.02 0.00 0.00 57.16 55.63 1nqt n GLU 495 Cb 0.68 -2.13 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 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 1.86 0.00 0.00 0.62 0.00 -0.82 -4.99 120.51 117.18 1nqt n ALA 496 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1nqt n ALA 496 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.15 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 -0.05 -0.99 0.54 0.00 0.00 -0.66 -4.33 105.19 99.71 1nqt n GLY 497 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.09 1.61 0.24 -1.26 -4.71 118.33 114.12 1nqt n VAL 498 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1nqt n VAL 498 Cb 0.00 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.22 1nqt n VAL 498 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1nqt n THR 499 N -1.39 1.29 -3.03 3.34 -2.24 -1.26 -4.14 114.28 106.86 1nqt n THR 499 Ca 0.00 -0.78 -0.31 0.00 -2.27 0.00 0.00 64.05 60.69 1nqt n THR 499 Cb 0.00 -0.54 -0.04 0.00 -2.10 0.00 0.00 70.33 67.65 1nqt n THR 499 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1nqt n PHE 500 N -2.72 3.54 1.08 4.78 3.01 -1.26 -5.28 117.46 120.60 1nqt n PHE 500 Ca -0.31 -3.65 0.12 0.00 1.01 0.00 0.00 57.45 54.63 1nqt n PHE 500 Cb 1.10 -0.71 0.17 0.00 -0.01 0.00 0.00 39.48 40.03 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40