#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqt s ALA 7 N 0.00 2.85 0.00 3.52 0.00 -0.37 -4.98 121.76 122.78 2nqt s ALA 7 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2nqt s ALA 7 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.84 2nqt s ALA 7 CO 0.00 -0.41 0.00 0.27 0.00 0.00 0.00 175.76 175.62 2nqt n ASN 8 N -0.97 1.37 -3.45 0.00 6.94 -1.26 -4.99 115.26 112.90 2nqt n ASN 8 Ca 0.09 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.53 2nqt n ASN 8 Cb 0.52 0.19 -0.10 0.00 -2.36 0.00 0.00 39.78 38.03 2nqt n ASN 8 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2nqt s ALA 9 N -0.99 -0.74 -0.23 -2.53 0.00 -1.25 -4.54 121.76 111.47 2nqt s ALA 9 Ca 0.00 0.71 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 2nqt s ALA 9 Cb 0.00 -1.46 0.06 0.00 0.00 0.00 0.00 23.12 21.73 2nqt s ALA 9 CO 0.00 -1.15 -0.02 0.99 0.00 0.00 0.00 175.76 175.59 2nqt s THR 10 N 2.46 1.20 -0.20 0.00 2.01 0.11 -5.00 115.64 116.21 2nqt s THR 10 Ca 0.09 -1.04 -0.17 0.00 0.31 0.00 0.00 61.69 60.88 2nqt s THR 10 Cb -0.15 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2nqt s THR 10 CO -0.13 -0.17 0.44 -0.75 -0.69 0.00 0.00 174.62 173.31 2nqt s LYS 11 N 1.54 4.17 -0.09 4.92 2.20 -1.26 -0.84 119.74 130.39 2nqt s LYS 11 Ca -0.03 0.27 0.02 0.00 -0.36 0.00 0.00 55.97 55.86 2nqt s LYS 11 Cb -0.18 -3.55 -0.02 0.00 -1.51 0.00 0.00 37.83 32.57 2nqt s LYS 11 CO -0.08 -0.08 -0.14 0.14 -0.36 0.00 0.00 175.35 174.83 2nqt s VAL 12 N 1.44 2.99 0.12 4.02 -7.23 0.71 -0.16 120.40 122.29 2nqt s VAL 12 Ca 0.21 -0.71 0.04 0.00 -1.81 0.00 0.00 61.98 59.70 2nqt s VAL 12 Cb -0.15 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 2nqt s VAL 12 CO 0.09 0.56 0.09 0.00 -0.31 0.00 0.00 175.10 175.52 2nqt s ALA 13 N -0.18 3.52 -0.23 1.32 0.00 -0.18 0.27 121.76 126.28 2nqt s ALA 13 Ca -0.00 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.85 2nqt s ALA 13 Cb -0.13 -1.36 0.06 0.00 0.00 0.00 0.00 23.12 21.68 2nqt s ALA 13 CO 0.03 0.64 -0.07 0.08 0.00 0.00 0.00 175.76 176.44 2nqt s VAL 14 N -1.53 1.61 -0.11 0.00 1.01 -0.47 -1.08 120.40 119.83 2nqt s VAL 14 Ca 0.29 -1.22 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 2nqt s VAL 14 Cb -0.11 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2nqt s VAL 14 CO 0.22 -0.05 0.50 0.00 0.00 0.00 0.00 175.10 175.77 2nqt s ALA 15 N 1.37 3.47 0.00 5.51 0.00 0.19 -1.43 121.76 130.87 2nqt s ALA 15 Ca -0.05 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2nqt s ALA 15 Cb -0.19 -2.67 0.00 0.00 0.00 0.00 0.00 23.12 20.27 2nqt s ALA 15 CO -0.06 0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2nqt n GLY 16 N 3.19 0.92 0.27 0.00 0.00 0.30 0.08 105.19 109.96 2nqt n GLY 16 Ca -0.07 -0.60 0.16 0.00 0.00 0.00 0.00 46.02 45.51 2nqt n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqt h ALA 17 N 0.00 1.06 0.00 4.61 0.00 -0.75 -2.98 119.26 121.21 2nqt h ALA 17 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2nqt h ALA 17 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2nqt h ALA 17 CO 0.00 0.09 -0.28 -1.13 0.00 0.00 0.00 179.25 177.93 2nqt n SER 18 N -3.27 0.38 -4.33 0.00 3.41 -1.26 -3.39 113.62 105.17 2nqt n SER 18 Ca -0.01 0.18 -0.29 0.00 -0.26 0.00 0.00 58.87 58.50 2nqt n SER 18 Cb 0.28 -0.16 0.16 0.00 -0.26 0.00 0.00 64.21 64.23 2nqt n SER 18 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2nqt s GLY 19 N -3.17 1.75 0.13 5.00 0.00 -1.12 -4.87 107.32 105.03 2nqt s GLY 19 Ca 0.11 -1.19 -0.16 0.00 0.00 0.00 0.00 44.72 43.49 2nqt s GLY 19 CO 0.63 -0.50 1.63 -0.97 0.00 0.00 0.00 173.10 173.89 2nqt h TYR 20 N -1.38 0.65 -0.57 1.90 0.05 -1.89 -1.60 116.97 114.13 2nqt h TYR 20 Ca -0.44 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.27 2nqt h TYR 20 Cb 1.25 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 38.78 2nqt h TYR 20 CO -0.79 0.63 0.35 0.00 -1.05 0.00 0.00 178.16 177.30 2nqt h ALA 21 N 0.95 0.72 -0.48 3.88 0.00 -1.90 -1.37 119.26 121.05 2nqt h ALA 21 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2nqt h ALA 21 Cb 0.30 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2nqt h ALA 21 CO 0.00 0.19 0.29 0.78 0.00 0.00 0.00 179.25 180.51 2nqt h GLY 22 N 0.76 0.70 1.19 0.00 0.00 -1.66 -0.29 103.07 103.77 2nqt h GLY 22 Ca 0.20 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 2nqt h GLY 22 CO -0.04 0.29 0.30 -1.33 0.00 0.00 0.00 176.54 175.76 2nqt h GLY 23 N 0.64 1.11 1.14 4.60 0.00 -1.05 -1.90 103.07 107.62 2nqt h GLY 23 Ca 0.17 -0.57 -0.22 0.00 0.00 0.00 0.00 47.33 46.71 2nqt h GLY 23 CO -0.03 0.54 -0.77 -2.09 0.00 0.00 0.00 176.54 174.19 2nqt h GLU 24 N 1.02 0.76 -0.49 4.80 4.57 -0.84 -0.61 114.58 123.80 2nqt h GLU 24 Ca 0.24 -0.64 0.09 0.00 -1.18 0.00 0.00 59.36 57.87 2nqt h GLU 24 Cb 0.17 0.14 -0.07 0.00 -0.16 0.00 0.00 28.75 28.82 2nqt h GLU 24 CO -0.02 1.24 0.08 0.82 -1.18 0.00 0.00 179.01 179.95 2nqt h ILE 25 N 0.49 0.70 -0.73 2.32 2.04 -0.95 -1.15 117.51 120.23 2nqt h ILE 25 Ca -0.06 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2nqt h ILE 25 Cb 1.41 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 2nqt h ILE 25 CO 0.16 0.04 0.41 -0.07 0.00 0.00 0.00 178.15 178.68 2nqt h LEU 26 N 0.21 0.91 -0.50 1.44 3.38 -1.19 0.79 115.31 120.34 2nqt h LEU 26 Ca 0.25 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.18 2nqt h LEU 26 Cb 0.34 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2nqt h LEU 26 CO -0.34 0.74 0.24 -0.09 0.09 0.00 0.00 178.44 179.07 2nqt h ARG 27 N 1.00 0.45 -0.43 1.13 2.43 -0.61 -1.02 114.38 117.34 2nqt h ARG 27 Ca 0.26 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.28 2nqt h ARG 27 Cb 0.03 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2nqt h ARG 27 CO -0.04 0.30 -0.23 -0.07 -1.51 0.00 0.00 179.97 178.41 2nqt h LEU 28 N 0.46 0.89 -0.67 3.80 3.38 -0.65 -2.84 115.31 119.69 2nqt h LEU 28 Ca 0.23 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2nqt h LEU 28 Cb 0.17 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2nqt h LEU 28 CO -0.18 1.08 0.16 -0.07 0.09 0.00 0.00 178.44 179.53 2nqt h LEU 29 N 0.75 1.01 -1.76 1.67 3.38 -0.54 -1.90 115.31 117.93 2nqt h LEU 29 Ca 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2nqt h LEU 29 Cb 0.77 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2nqt h LEU 29 CO 0.06 0.98 -0.11 -0.07 0.09 0.00 0.00 178.44 179.39 2nqt h LEU 30 N 0.99 0.01 -1.04 1.67 3.38 -1.04 -2.14 115.31 117.14 2nqt h LEU 30 Ca 0.21 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2nqt h LEU 30 Cb 0.36 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2nqt h LEU 30 CO 0.00 0.12 -0.06 0.61 0.09 0.00 0.00 178.44 179.20 2nqt n GLY 31 N -1.20 0.06 3.74 0.83 0.00 -0.96 -4.80 105.19 102.86 2nqt n GLY 31 Ca -0.03 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 2nqt n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2nqt s HIS 32 N -2.10 3.76 0.52 1.61 5.04 -0.76 -4.67 115.29 118.68 2nqt s HIS 32 Ca 0.33 1.75 0.24 0.00 -1.54 0.00 0.00 55.06 55.85 2nqt s HIS 32 Cb 0.20 -3.14 1.51 0.00 0.04 0.00 0.00 32.58 31.20 2nqt s HIS 32 CO 0.37 -0.09 2.16 -1.00 -2.34 0.00 0.00 174.74 173.83 2nqt h PRO 33 N 4.80 0.00 0.00 2.88 0.13 -1.89 -1.43 132.00 136.49 2nqt h PRO 33 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 2nqt h PRO 33 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2nqt h PRO 33 CO 0.70 0.05 -0.30 0.00 -0.23 0.00 0.00 178.00 178.23 2nqt h ALA 34 N 1.95 0.97 -0.10 -0.56 0.00 -1.92 -1.39 119.26 118.20 2nqt h ALA 34 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2nqt h ALA 34 Cb 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2nqt h ALA 34 CO 0.01 0.38 -0.08 -0.92 0.00 0.00 0.00 179.25 178.63 2nqt h TYR 35 N 0.00 0.28 -0.35 0.00 3.20 -1.43 0.14 116.97 118.80 2nqt h TYR 35 Ca -0.00 -0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.74 2nqt h TYR 35 Cb 0.88 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 39.07 2nqt h TYR 35 CO 0.00 0.64 0.03 0.00 -1.64 0.00 0.00 178.16 177.18 2nqt h ALA 36 N 0.60 1.39 -0.07 1.82 0.00 -1.22 -2.82 119.26 118.97 2nqt h ALA 36 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2nqt h ALA 36 Cb 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2nqt h ALA 36 CO 0.02 0.43 0.00 -0.40 0.00 0.00 0.00 179.25 179.30 2nqt n ASP 37 N -4.29 2.24 0.00 0.00 5.68 -0.55 -4.95 116.55 114.67 2nqt n ASP 37 Ca 0.02 -1.75 0.00 0.00 -0.50 0.00 0.00 54.79 52.56 2nqt n ASP 37 Cb 0.23 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 2nqt n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2nqt n GLY 38 N 1.26 0.59 0.07 6.12 0.00 -0.95 -4.95 105.19 107.34 2nqt n GLY 38 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 2nqt n GLY 38 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2nqt h ARG 39 N 4.67 0.03 -5.06 1.61 3.08 -1.09 -3.44 114.38 114.19 2nqt h ARG 39 Ca 0.00 -0.06 -0.65 0.00 0.07 0.00 0.00 59.98 59.34 2nqt h ARG 39 Cb 0.00 0.02 -0.25 0.00 0.08 0.00 0.00 29.97 29.82 2nqt h ARG 39 CO 0.00 0.90 -0.69 -1.17 -1.07 0.00 0.00 179.97 177.94 2nqt s LEU 40 N -6.61 3.08 -0.06 3.04 0.20 0.15 0.07 118.68 118.55 2nqt s LEU 40 Ca -0.01 -0.30 0.06 0.00 0.69 0.00 0.00 54.13 54.57 2nqt s LEU 40 Cb 0.09 -1.78 -0.01 0.00 -0.43 0.00 0.00 46.19 44.06 2nqt s LEU 40 CO 0.83 0.02 -0.23 -0.13 -0.29 0.00 0.00 176.35 176.55 2nqt s ARG 41 N 1.24 2.39 -0.35 1.98 0.52 -0.02 -4.18 118.95 120.53 2nqt s ARG 41 Ca 0.03 -0.83 -0.18 0.00 -0.52 0.00 0.00 55.73 54.23 2nqt s ARG 41 Cb -0.14 -2.02 -0.00 0.00 0.52 0.00 0.00 34.95 33.30 2nqt s ARG 41 CO -0.00 0.34 0.52 0.42 0.02 0.00 0.00 175.30 176.59 2nqt s ILE 42 N -0.08 5.01 0.00 1.52 1.01 -1.26 -0.21 121.20 127.19 2nqt s ILE 42 Ca -0.05 0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.94 2nqt s ILE 42 Cb -0.13 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.37 2nqt s ILE 42 CO 0.04 -0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.36 2nqt n GLY 43 N 4.79 0.54 3.76 6.18 0.00 0.14 -4.92 105.19 115.69 2nqt n GLY 43 Ca -0.05 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2nqt n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqt s ALA 44 N -3.02 3.54 -0.20 4.61 0.00 -1.26 -4.85 121.76 120.58 2nqt s ALA 44 Ca 0.00 1.29 0.02 0.00 0.00 0.00 0.00 51.96 53.26 2nqt s ALA 44 Cb 0.00 -3.51 0.03 0.00 0.00 0.00 0.00 23.12 19.65 2nqt s ALA 44 CO 0.00 -0.69 -0.16 -0.51 0.00 0.00 0.00 175.76 174.41 2nqt s LEU 45 N -1.33 2.50 0.19 0.00 1.43 -1.26 -1.36 118.68 118.85 2nqt s LEU 45 Ca 0.52 -0.89 0.09 0.00 -1.03 0.00 0.00 54.13 52.83 2nqt s LEU 45 Cb -0.40 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2nqt s LEU 45 CO 0.50 -0.08 -0.19 0.42 0.23 0.00 0.00 176.35 177.23 2nqt s THR 46 N 1.26 2.01 0.10 5.49 -4.23 -0.52 -0.95 115.64 118.80 2nqt s THR 46 Ca 0.00 -2.06 -0.12 0.00 -1.18 0.00 0.00 61.69 58.34 2nqt s THR 46 Cb -0.15 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.71 2nqt s THR 46 CO -0.10 -0.33 0.28 0.00 -0.54 0.00 0.00 174.62 173.93 2nqt s ALA 47 N -2.18 -0.52 0.20 3.99 0.00 -0.37 -0.29 121.76 122.58 2nqt s ALA 47 Ca 0.20 -0.36 -0.02 0.00 0.00 0.00 0.00 51.96 51.78 2nqt s ALA 47 Cb -0.05 0.55 0.14 0.00 0.00 0.00 0.00 23.12 23.76 2nqt s ALA 47 CO 0.08 -0.55 1.52 0.00 0.00 0.00 0.00 175.76 176.81 2nqt h ALA 48 N 2.63 0.74 -1.75 0.00 0.00 -1.93 -2.63 119.26 116.32 2nqt h ALA 48 Ca -0.34 -0.50 -0.52 0.00 0.00 0.00 0.00 54.91 53.55 2nqt h ALA 48 Cb 1.22 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 2nqt h ALA 48 CO 0.52 0.68 -0.56 0.95 0.00 0.00 0.00 179.25 180.85 2nqt s THR 49 N -4.01 0.89 0.00 0.00 -4.23 -1.26 -4.83 115.64 102.20 2nqt s THR 49 Ca -0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 2nqt s THR 49 Cb 0.11 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.42 2nqt s THR 49 CO 0.83 0.00 0.00 -1.54 -0.54 0.00 0.00 174.62 173.37 2nqt n SER 50 N -1.01 -2.10 -4.66 3.99 3.41 -1.26 -5.02 113.62 106.97 2nqt n SER 50 Ca -0.05 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.11 2nqt n SER 50 Cb 0.66 -0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 64.23 2nqt n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nqt n ALA 51 N 0.89 0.93 0.00 7.33 0.00 -1.26 -1.36 120.51 127.03 2nqt n ALA 51 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2nqt n ALA 51 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.21 2nqt n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqt n GLY 52 N 1.87 3.24 3.78 0.00 0.00 0.18 -5.00 105.19 109.26 2nqt n GLY 52 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2nqt n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nqt s SER 53 N -0.41 4.43 0.23 1.61 1.04 -0.46 -4.76 113.70 115.37 2nqt s SER 53 Ca 0.00 1.52 -0.01 0.00 0.48 0.00 0.00 55.95 57.94 2nqt s SER 53 Cb 0.00 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 2nqt s SER 53 CO 0.00 -2.04 0.42 0.42 0.98 0.00 0.00 173.24 173.02 2nqt s THR 54 N -3.03 5.18 0.42 2.02 -4.23 -1.26 -0.47 115.64 114.28 2nqt s THR 54 Ca 0.61 -0.37 0.09 0.00 -1.18 0.00 0.00 61.69 60.84 2nqt s THR 54 Cb -0.16 -3.75 0.28 0.00 1.34 0.00 0.00 72.50 70.21 2nqt s THR 54 CO 0.55 -0.24 2.05 0.25 -0.54 0.00 0.00 174.62 176.70 2nqt h LEU 55 N 1.78 0.41 -2.19 4.79 5.85 -0.42 -2.13 115.31 123.41 2nqt h LEU 55 Ca -0.48 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 2nqt h LEU 55 Cb 1.20 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 2nqt h LEU 55 CO 0.67 0.29 -0.06 1.23 -0.34 0.00 0.00 178.44 180.23 2nqt h GLY 56 N 0.48 0.00 2.00 3.75 0.00 -1.37 0.27 103.07 108.19 2nqt h GLY 56 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2nqt h GLY 56 CO -0.04 0.00 -0.03 0.83 0.00 0.00 0.00 176.54 177.30 2nqt h GLU 57 N 0.00 0.00 0.00 4.80 5.08 -1.65 -3.08 114.58 119.73 2nqt h GLU 57 Ca -0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 2nqt h GLU 57 Cb 0.14 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 2nqt h GLU 57 CO 0.01 0.03 -2.22 0.72 -1.00 0.00 0.00 179.01 176.54 2nqt n HIS 58 N -3.12 0.00 -3.46 4.33 8.25 -0.21 -4.86 115.22 116.14 2nqt n HIS 58 Ca 0.01 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.21 2nqt n HIS 58 Cb 0.36 -0.83 -0.09 0.00 1.12 0.00 0.00 29.99 30.55 2nqt n HIS 58 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2nqt n HIS 59 N -3.11 0.91 0.21 4.41 8.25 0.77 -4.96 115.22 121.70 2nqt n HIS 59 Ca -0.38 -3.74 0.08 0.00 -0.26 0.00 0.00 57.72 53.43 2nqt n HIS 59 Cb 0.91 -0.22 0.39 0.00 1.12 0.00 0.00 29.99 32.19 2nqt n HIS 59 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2nqt n PRO 60 N 1.96 0.10 0.21 -0.41 -0.04 -1.17 -1.33 135.00 134.33 2nqt n PRO 60 Ca 0.25 0.51 0.14 0.00 -0.04 0.00 0.00 63.50 64.37 2nqt n PRO 60 Cb 0.45 -1.77 0.46 0.00 -0.04 0.00 0.00 33.50 32.60 2nqt n PRO 60 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 2nqt h HIS 61 N 0.00 0.00 -1.70 0.54 2.07 -1.93 -3.36 115.15 110.78 2nqt h HIS 61 Ca 0.00 0.00 -0.73 0.00 -2.85 0.00 0.00 60.37 56.79 2nqt h HIS 61 Cb 0.11 0.00 -0.21 0.00 2.57 0.00 0.00 27.41 29.88 2nqt h HIS 61 CO 0.00 0.00 1.34 1.28 -3.07 0.00 0.00 177.93 177.48 2nqt n LEU 62 N -2.83 7.46 0.08 6.12 4.77 -0.44 -4.81 117.00 127.35 2nqt n LEU 62 Ca 0.03 -4.93 0.05 0.00 -0.03 0.00 0.00 56.01 51.13 2nqt n LEU 62 Cb 0.38 -1.22 0.49 0.00 -2.33 0.00 0.00 43.42 40.74 2nqt n LEU 62 CO 0.28 1.95 1.14 0.71 -1.33 0.00 0.00 177.39 180.14 2nqt h THR 63 N 2.25 1.07 -0.01 -5.08 1.35 -1.81 -0.92 112.91 109.76 2nqt h THR 63 Ca 0.57 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 66.30 2nqt h THR 63 Cb 0.32 0.65 -0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2nqt h THR 63 CO 1.27 0.07 0.03 -0.65 -0.25 0.00 0.00 175.52 175.99 2nqt h PRO 64 N 0.39 0.00 -0.15 4.72 0.11 -1.96 -2.18 132.00 132.92 2nqt h PRO 64 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2nqt h PRO 64 Cb -0.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.07 2nqt h PRO 64 CO -0.02 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.05 2nqt n LEU 65 N -3.23 2.32 -0.13 2.35 4.77 -0.39 -4.80 117.00 117.90 2nqt n LEU 65 Ca -0.03 -1.83 0.16 0.00 -0.03 0.00 0.00 56.01 54.29 2nqt n LEU 65 Cb 0.10 -0.10 0.54 0.00 -2.33 0.00 0.00 43.42 41.63 2nqt n LEU 65 CO 0.21 0.57 1.20 0.00 -1.33 0.00 0.00 177.39 178.04 2nqt h ALA 66 N 1.10 2.18 0.00 -1.18 0.00 -0.93 -0.57 119.26 119.86 2nqt h ALA 66 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2nqt h ALA 66 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2nqt h ALA 66 CO 0.00 -0.36 -0.03 -2.39 0.00 0.00 0.00 179.25 176.46 2nqt n HIS 67 N -4.46 0.46 -1.74 0.00 1.44 -1.26 -1.17 115.22 108.49 2nqt n HIS 67 Ca 0.13 0.13 -0.42 0.00 -2.01 0.00 0.00 57.72 55.55 2nqt n HIS 67 Cb 0.53 -0.71 -0.01 0.00 0.12 0.00 0.00 29.99 29.92 2nqt n HIS 67 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2nqt n ARG 68 N -1.88 2.59 -3.21 -1.40 5.12 -0.22 -4.76 116.66 112.91 2nqt n ARG 68 Ca 0.06 0.92 -0.39 0.00 -1.93 0.00 0.00 57.85 56.51 2nqt n ARG 68 Cb 0.39 -2.67 -0.06 0.00 -1.16 0.00 0.00 32.46 28.96 2nqt n ARG 68 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2nqt s VAL 69 N -0.32 5.08 0.19 1.55 1.01 -1.26 -0.26 120.40 126.40 2nqt s VAL 69 Ca 0.62 1.04 -0.31 0.00 0.00 0.00 0.00 61.98 63.32 2nqt s VAL 69 Cb -0.51 -3.88 -0.10 0.00 0.00 0.00 0.00 36.38 31.89 2nqt s VAL 69 CO 0.53 0.17 1.51 -0.69 0.00 0.00 0.00 175.10 176.62 2nqt s VAL 70 N 1.65 2.67 0.30 2.92 1.01 0.38 -4.74 120.40 124.59 2nqt s VAL 70 Ca 0.26 0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.82 2nqt s VAL 70 Cb -0.16 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2nqt s VAL 70 CO 0.10 0.05 0.16 -1.61 0.00 0.00 0.00 175.10 173.81 2nqt s GLU 71 N 0.58 2.60 0.45 2.72 2.02 -0.13 -0.65 118.70 126.30 2nqt s GLU 71 Ca 0.66 -1.32 -0.24 0.00 0.02 0.00 0.00 54.97 54.09 2nqt s GLU 71 Cb -0.43 -2.36 -0.07 0.00 0.10 0.00 0.00 34.13 31.37 2nqt s GLU 71 CO 0.36 0.25 1.23 -2.14 0.02 0.00 0.00 175.26 174.97 2nqt s PRO 72 N -3.84 3.74 -0.80 0.39 0.02 -1.26 -1.23 135.00 132.01 2nqt s PRO 72 Ca 0.36 1.94 -0.25 0.00 0.02 0.00 0.00 61.00 63.06 2nqt s PRO 72 Cb -0.06 -2.49 -0.00 0.00 0.02 0.00 0.00 34.50 31.97 2nqt s PRO 72 CO 0.24 -0.61 1.67 0.99 -0.33 0.00 0.00 177.00 178.95 2nqt s THR 73 N -1.43 3.58 -0.02 0.99 2.01 -0.99 -4.68 115.64 115.10 2nqt s THR 73 Ca 0.63 -0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.48 2nqt s THR 73 Cb -0.33 -4.41 0.01 0.00 0.01 0.00 0.00 72.50 67.78 2nqt s THR 73 CO 0.40 -1.35 0.13 -1.61 -0.69 0.00 0.00 174.62 171.51 2nqt s GLU 74 N 6.32 0.34 0.28 4.92 2.02 -1.26 -4.96 118.70 126.36 2nqt s GLU 74 Ca 0.56 -0.15 0.01 0.00 0.02 0.00 0.00 54.97 55.41 2nqt s GLU 74 Cb -0.07 0.15 0.54 0.00 0.10 0.00 0.00 34.13 34.84 2nqt s GLU 74 CO 0.08 -0.07 1.82 0.00 0.02 0.00 0.00 175.26 177.11 2nqt h ALA 75 N 5.00 1.47 -0.97 5.21 0.00 -1.92 -2.13 119.26 125.92 2nqt h ALA 75 Ca -0.28 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2nqt h ALA 75 Cb 1.20 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2nqt h ALA 75 CO 0.41 0.18 0.64 0.00 0.00 0.00 0.00 179.25 180.48 2nqt h ALA 76 N 1.54 1.32 -0.29 0.00 0.00 -1.96 -0.18 119.26 119.69 2nqt h ALA 76 Ca 0.49 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.20 2nqt h ALA 76 Cb 0.51 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2nqt h ALA 76 CO -0.28 0.62 -0.39 0.28 0.00 0.00 0.00 179.25 179.49 2nqt h VAL 77 N 1.29 1.29 0.00 0.00 2.07 -1.72 -3.10 116.25 116.09 2nqt h VAL 77 Ca 0.36 -1.55 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2nqt h VAL 77 Cb -0.12 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2nqt h VAL 77 CO -0.09 0.50 0.00 0.18 0.02 0.00 0.00 177.57 178.18 2nqt n LEU 78 N -4.04 0.43 -4.71 2.57 4.77 -0.74 -4.84 117.00 110.44 2nqt n LEU 78 Ca -0.02 0.55 -0.34 0.00 -0.03 0.00 0.00 56.01 56.17 2nqt n LEU 78 Cb 0.52 -0.42 0.11 0.00 -2.33 0.00 0.00 43.42 41.30 2nqt n LEU 78 CO 0.46 -0.13 0.78 -0.83 -1.33 0.00 0.00 177.39 176.34 2nqt s GLY 79 N -3.31 2.23 -0.69 -0.72 0.00 -0.16 -3.54 107.32 101.14 2nqt s GLY 79 Ca 0.12 0.85 0.00 0.00 0.00 0.00 0.00 44.72 45.68 2nqt s GLY 79 CO 0.54 1.26 0.00 0.61 0.00 0.00 0.00 173.10 175.51 2nqt n GLY 80 N 0.40 0.75 3.30 0.20 0.00 -1.26 -5.03 105.19 103.55 2nqt n GLY 80 Ca 0.13 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2nqt n GLY 80 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2nqt s HIS 81 N -2.27 2.41 0.11 1.61 4.02 -1.23 -4.95 115.29 114.99 2nqt s HIS 81 Ca 0.00 -0.58 0.15 0.00 1.02 0.00 0.00 55.06 55.66 2nqt s HIS 81 Cb 0.00 -1.56 0.40 0.00 -1.02 0.00 0.00 32.58 30.40 2nqt s HIS 81 CO 0.00 -0.12 1.60 -0.44 1.02 0.00 0.00 174.74 176.80 2nqt h ASP 82 N 5.79 0.00 -3.92 1.40 3.32 -0.91 -3.44 116.42 118.65 2nqt h ASP 82 Ca -0.37 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.42 2nqt h ASP 82 Cb 1.15 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.43 2nqt h ASP 82 CO 0.47 0.51 -0.73 0.00 -1.72 0.00 0.00 179.24 177.77 2nqt s ALA 83 N -3.37 0.19 -0.09 3.45 0.00 -1.01 -1.13 121.76 119.80 2nqt s ALA 83 Ca 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 51.96 51.81 2nqt s ALA 83 Cb 0.10 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.22 2nqt s ALA 83 CO 0.73 0.03 -0.06 0.08 0.00 0.00 0.00 175.76 176.53 2nqt s VAL 84 N -0.20 0.85 -0.16 0.00 1.01 0.22 -1.01 120.40 121.10 2nqt s VAL 84 Ca -0.01 -0.20 -0.20 0.00 0.00 0.00 0.00 61.98 61.57 2nqt s VAL 84 Cb -0.02 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2nqt s VAL 84 CO -0.00 0.33 0.58 -0.36 0.00 0.00 0.00 175.10 175.65 2nqt s PHE 85 N 1.60 3.43 -0.81 5.22 0.08 -0.24 -1.08 117.98 126.18 2nqt s PHE 85 Ca 0.02 0.92 -0.14 0.00 0.12 0.00 0.00 56.93 57.84 2nqt s PHE 85 Cb -0.13 -2.71 0.21 0.00 -0.57 0.00 0.00 43.02 39.82 2nqt s PHE 85 CO -0.06 -0.05 0.76 -0.51 -0.10 0.00 0.00 175.22 175.27 2nqt s LEU 86 N 1.41 6.65 -0.47 -0.37 1.43 0.46 -0.63 118.68 127.17 2nqt s LEU 86 Ca 0.28 -2.59 -0.03 0.00 -1.03 0.00 0.00 54.13 50.76 2nqt s LEU 86 Cb -0.16 -2.22 0.18 0.00 0.03 0.00 0.00 46.19 44.03 2nqt s LEU 86 CO 0.11 -0.62 2.37 0.00 0.23 0.00 0.00 176.35 178.44 2nqt n ALA 87 N 4.17 6.01 -3.93 4.21 0.00 0.11 -0.97 120.51 130.11 2nqt n ALA 87 Ca 0.12 -2.73 -0.30 0.00 0.00 0.00 0.00 53.44 50.53 2nqt n ALA 87 Cb 0.46 -1.83 -0.13 0.00 0.00 0.00 0.00 19.45 17.95 2nqt n ALA 87 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2nqt s LEU 88 N -2.43 4.47 0.61 0.00 1.02 -1.26 -4.07 118.68 117.01 2nqt s LEU 88 Ca 0.50 -3.22 0.33 0.00 0.02 0.00 0.00 54.13 51.76 2nqt s LEU 88 Cb 0.36 -1.65 1.93 0.00 0.02 0.00 0.00 46.19 46.85 2nqt s LEU 88 CO -0.14 -0.20 2.26 -0.65 0.02 0.00 0.00 176.35 177.64 2nqt h PRO 89 N 6.25 0.00 -0.36 1.29 0.11 -1.85 -1.75 132.00 135.69 2nqt h PRO 89 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2nqt h PRO 89 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2nqt h PRO 89 CO 0.70 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.21 2nqt n HIS 90 N -3.68 0.48 -3.53 0.65 8.25 -1.26 -4.30 115.22 111.82 2nqt n HIS 90 Ca -0.03 -0.50 -0.22 0.00 -0.26 0.00 0.00 57.72 56.72 2nqt n HIS 90 Cb 0.11 -0.03 -0.00 0.00 1.12 0.00 0.00 29.99 31.19 2nqt n HIS 90 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2nqt s GLY 91 N -1.00 2.13 -0.26 -1.41 0.00 -0.66 -5.03 107.32 101.08 2nqt s GLY 91 Ca 0.24 -1.73 0.03 0.00 0.00 0.00 0.00 44.72 43.26 2nqt s GLY 91 CO 0.16 -1.76 -0.11 0.30 0.00 0.00 0.00 173.10 171.70 2nqt s HIS 92 N -2.59 3.26 -0.87 1.90 3.76 -1.26 -4.02 115.29 115.45 2nqt s HIS 92 Ca 0.47 -2.33 0.11 0.00 -0.15 0.00 0.00 55.06 53.16 2nqt s HIS 92 Cb -0.04 -1.94 0.33 0.00 1.11 0.00 0.00 32.58 32.04 2nqt s HIS 92 CO 0.28 -0.88 1.27 0.43 -0.85 0.00 0.00 174.74 175.00 2nqt n SER 93 N 4.43 3.03 -0.17 1.40 7.64 -1.26 -4.58 113.62 124.11 2nqt n SER 93 Ca -0.14 -2.09 -0.01 0.00 1.01 0.00 0.00 58.87 57.64 2nqt n SER 93 Cb 0.42 -0.26 0.07 0.00 -1.01 0.00 0.00 64.21 63.42 2nqt n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nqt h ALA 94 N 2.04 0.48 -0.28 -0.43 0.00 -1.96 0.12 119.26 119.23 2nqt h ALA 94 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2nqt h ALA 94 Cb 0.80 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2nqt h ALA 94 CO 0.02 -0.40 0.18 0.28 0.00 0.00 0.00 179.25 179.34 2nqt h VAL 95 N 0.09 1.07 -0.27 0.00 2.07 -2.01 -2.12 116.25 115.09 2nqt h VAL 95 Ca 0.27 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 2nqt h VAL 95 Cb 0.42 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2nqt h VAL 95 CO -0.47 0.07 -0.03 0.25 0.02 0.00 0.00 177.57 177.41 2nqt h LEU 96 N 0.38 0.49 -1.33 2.57 5.85 -1.78 -3.08 115.31 118.41 2nqt h LEU 96 Ca 0.10 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.57 2nqt h LEU 96 Cb -0.04 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 2nqt h LEU 96 CO -0.03 0.71 0.51 0.00 -0.34 0.00 0.00 178.44 179.30 2nqt h ALA 97 N 0.80 1.71 0.00 1.25 0.00 -0.63 -0.02 119.26 122.37 2nqt h ALA 97 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2nqt h ALA 97 Cb 0.48 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2nqt h ALA 97 CO 0.02 0.15 -0.10 0.37 0.00 0.00 0.00 179.25 179.69 2nqt h GLN 98 N 0.77 0.00 0.00 0.00 5.75 -1.29 -2.78 115.11 117.56 2nqt h GLN 98 Ca 0.35 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.85 2nqt h GLN 98 Cb 0.35 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.90 2nqt h GLN 98 CO -0.13 0.10 -0.53 1.96 -2.65 0.00 0.00 178.83 177.58 2nqt h GLN 99 N 0.00 0.00 -7.20 1.69 4.20 -1.00 -3.47 115.11 109.32 2nqt h GLN 99 Ca -0.00 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 58.23 2nqt h GLN 99 Cb 0.30 0.00 0.04 0.00 0.30 0.00 0.00 27.48 28.12 2nqt h GLN 99 CO 0.01 0.00 0.38 -0.51 -0.67 0.00 0.00 178.83 178.04 2nqt s LEU 100 N -4.60 3.54 0.18 1.46 1.43 -1.05 -4.95 118.68 114.69 2nqt s LEU 100 Ca 0.06 1.67 -0.32 0.00 -1.03 0.00 0.00 54.13 54.52 2nqt s LEU 100 Cb 0.12 -4.52 -0.11 0.00 0.03 0.00 0.00 46.19 41.71 2nqt s LEU 100 CO 0.71 -0.87 1.72 -0.55 0.23 0.00 0.00 176.35 177.59 2nqt s SER 101 N -3.01 6.43 0.30 2.29 0.15 -1.26 -4.86 113.70 113.74 2nqt s SER 101 Ca 0.61 2.79 0.24 0.00 0.70 0.00 0.00 55.95 60.28 2nqt s SER 101 Cb -0.13 -2.59 1.10 0.00 -1.71 0.00 0.00 66.02 62.69 2nqt s SER 101 CO 0.35 -0.95 1.72 -0.65 1.20 0.00 0.00 173.24 174.91 2nqt h PRO 102 N 7.24 0.00 -0.00 5.44 0.11 -1.94 -1.77 132.00 141.08 2nqt h PRO 102 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2nqt h PRO 102 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2nqt h PRO 102 CO 0.95 0.00 -0.00 -0.85 -0.21 0.00 0.00 178.00 177.89 2nqt n GLU 103 N -2.30 0.03 -1.95 1.05 0.00 -1.26 -4.85 120.64 111.35 2nqt n GLU 103 Ca 0.01 -0.00 -0.40 0.00 0.00 0.00 0.00 57.16 56.76 2nqt n GLU 103 Cb 0.16 -1.50 -0.00 0.00 0.00 0.00 0.00 31.44 30.10 2nqt n GLU 103 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2nqt s THR 104 N -2.97 2.39 -0.40 3.84 2.01 -0.67 -4.96 115.64 114.88 2nqt s THR 104 Ca 0.15 0.37 -0.29 0.00 0.31 0.00 0.00 61.69 62.23 2nqt s THR 104 Cb 0.19 -3.23 0.01 0.00 0.01 0.00 0.00 72.50 69.49 2nqt s THR 104 CO 0.53 0.07 1.26 -0.22 -0.69 0.00 0.00 174.62 175.57 2nqt s LEU 105 N -2.26 3.71 -0.21 4.42 2.96 -0.28 -4.80 118.68 122.22 2nqt s LEU 105 Ca 0.55 0.83 -0.05 0.00 -0.22 0.00 0.00 54.13 55.24 2nqt s LEU 105 Cb -0.42 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.71 2nqt s LEU 105 CO 0.55 -1.23 0.00 -0.63 -1.32 0.00 0.00 176.35 173.72 2nqt s ILE 106 N 4.66 3.93 -0.30 6.68 1.01 -0.20 -0.61 121.20 136.37 2nqt s ILE 106 Ca 0.54 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.91 2nqt s ILE 106 Cb -0.12 -2.79 0.08 0.00 0.01 0.00 0.00 42.46 39.64 2nqt s ILE 106 CO 0.28 0.41 -0.03 -0.63 0.00 0.00 0.00 174.94 174.98 2nqt s ILE 107 N 1.15 2.24 -0.28 2.92 1.01 -0.24 -1.55 121.20 126.44 2nqt s ILE 107 Ca 0.03 -1.98 -0.13 0.00 0.00 0.00 0.00 60.65 58.57 2nqt s ILE 107 Cb -0.14 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2nqt s ILE 107 CO 0.01 -0.31 0.27 -0.62 0.00 0.00 0.00 174.94 174.30 2nqt s ASP 108 N 1.01 6.12 0.33 3.58 2.15 -0.01 -0.40 116.67 129.46 2nqt s ASP 108 Ca 0.01 0.06 0.25 0.00 0.43 0.00 0.00 52.55 53.30 2nqt s ASP 108 Cb -0.20 -2.16 0.66 0.00 -0.30 0.00 0.00 42.92 40.92 2nqt s ASP 108 CO -0.06 -0.13 1.72 0.00 -0.17 0.00 0.00 175.17 176.52 2nqt n GLY 110 N 1.05 -0.96 0.04 0.00 0.00 -1.18 -4.14 105.19 100.01 2nqt n GLY 110 Ca 0.04 -1.72 0.11 0.00 0.00 0.00 0.00 46.02 44.46 2nqt n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqt n ALA 111 N -3.17 3.34 0.06 4.61 0.00 -1.26 -4.55 120.51 119.54 2nqt n ALA 111 Ca -0.05 -0.39 0.18 0.00 0.00 0.00 0.00 53.44 53.19 2nqt n ALA 111 Cb 0.13 -0.99 0.70 0.00 0.00 0.00 0.00 19.45 19.29 2nqt n ALA 111 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2nqt h ASP 112 N 0.00 0.00 -0.21 0.00 5.19 -1.95 -0.92 116.42 118.53 2nqt h ASP 112 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2nqt h ASP 112 Cb 0.73 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.24 2nqt h ASP 112 CO 0.00 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 176.61 2nqt n PHE 113 N -4.33 0.61 0.06 4.55 3.72 -1.26 -4.42 117.46 116.38 2nqt n PHE 113 Ca 0.07 -0.80 -0.19 0.00 -0.05 0.00 0.00 57.45 56.48 2nqt n PHE 113 Cb 0.50 -0.21 -0.14 0.00 -0.94 0.00 0.00 39.48 38.69 2nqt n PHE 113 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2nqt h ARG 114 N 1.38 0.29 -6.44 -1.08 3.08 -1.38 -0.46 114.38 109.77 2nqt h ARG 114 Ca 0.00 -0.50 -0.53 0.00 0.07 0.00 0.00 59.98 59.02 2nqt h ARG 114 Cb 1.15 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.37 2nqt h ARG 114 CO 0.12 1.17 -0.14 -0.51 -1.07 0.00 0.00 179.97 179.54 2nqt s LEU 115 N -7.06 4.12 0.00 3.04 1.43 -1.26 -4.89 118.68 114.05 2nqt s LEU 115 Ca -0.12 0.80 0.06 0.00 -1.03 0.00 0.00 54.13 53.83 2nqt s LEU 115 Cb 0.06 -3.58 0.07 0.00 0.03 0.00 0.00 46.19 42.77 2nqt s LEU 115 CO 0.85 -0.13 0.77 0.35 0.23 0.00 0.00 176.35 178.42 2nqt n THR 116 N -0.52 0.20 -4.10 5.49 -2.24 -1.26 -4.28 114.28 107.58 2nqt n THR 116 Ca -0.01 -0.60 -0.32 0.00 -2.27 0.00 0.00 64.05 60.85 2nqt n THR 116 Cb 0.53 0.99 -0.16 0.00 -2.10 0.00 0.00 70.33 69.60 2nqt n THR 116 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2nqt s ASP 117 N -0.58 3.69 0.26 3.42 -1.08 -1.26 -5.02 116.67 116.10 2nqt s ASP 117 Ca 0.08 -0.97 -0.04 0.00 -0.52 0.00 0.00 52.55 51.09 2nqt s ASP 117 Cb 0.05 -1.50 0.31 0.00 -1.46 0.00 0.00 42.92 40.32 2nqt s ASP 117 CO 0.07 -0.08 1.89 0.00 0.52 0.00 0.00 175.17 177.56 2nqt h ALA 118 N 7.87 1.25 -0.39 3.66 0.00 -1.98 -0.84 119.26 128.83 2nqt h ALA 118 Ca -0.34 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 2nqt h ALA 118 Cb 1.10 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2nqt h ALA 118 CO 0.56 0.61 -0.14 0.00 0.00 0.00 0.00 179.25 180.28 2nqt h ALA 119 N 1.35 0.54 -0.14 0.00 0.00 -1.99 -1.34 119.26 117.68 2nqt h ALA 119 Ca 0.29 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2nqt h ALA 119 Cb 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2nqt h ALA 119 CO -0.05 0.45 0.08 0.28 0.00 0.00 0.00 179.25 180.02 2nqt h VAL 120 N 0.59 1.07 -0.19 0.00 2.07 -1.95 -1.44 116.25 116.40 2nqt h VAL 120 Ca 0.09 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.47 2nqt h VAL 120 Cb 0.68 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 2nqt h VAL 120 CO 0.05 0.07 -0.23 -0.25 0.02 0.00 0.00 177.57 177.22 2nqt h TRP 121 N 0.15 -0.62 -0.79 1.57 2.91 -1.01 -2.15 115.95 116.02 2nqt h TRP 121 Ca 0.05 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.09 2nqt h TRP 121 Cb 0.04 0.30 -0.04 0.00 -0.51 0.00 0.00 29.16 28.95 2nqt h TRP 121 CO -0.05 -0.31 0.43 1.49 -1.03 0.00 0.00 178.44 178.96 2nqt h GLU 122 N -0.26 1.10 -0.43 2.65 4.81 -1.10 0.75 114.58 122.10 2nqt h GLU 122 Ca 0.12 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2nqt h GLU 122 Cb 0.45 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2nqt h GLU 122 CO -0.34 0.81 0.24 -0.09 -0.73 0.00 0.00 179.01 178.90 2nqt h ARG 123 N 1.10 0.59 0.00 1.92 2.43 -0.85 -1.10 114.38 118.48 2nqt h ARG 123 Ca 0.28 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.23 2nqt h ARG 123 Cb 0.03 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 2nqt h ARG 123 CO -0.04 0.47 -1.29 0.74 -1.51 0.00 0.00 179.97 178.33 2nqt h PHE 124 N 0.56 0.00 0.00 2.20 0.04 -1.12 -3.40 116.94 115.23 2nqt h PHE 124 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2nqt h PHE 124 Cb 0.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.19 2nqt h PHE 124 CO -0.03 0.54 -0.52 0.66 -0.60 0.00 0.00 178.31 178.37 2nqt n TYR 125 N -2.92 0.00 -1.97 -0.55 4.02 0.23 -4.95 117.16 111.02 2nqt n TYR 125 Ca -0.08 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.70 2nqt n TYR 125 Cb 0.81 -0.03 -0.02 0.00 -0.02 0.00 0.00 39.34 40.08 2nqt n TYR 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2nqt n GLY 126 N 1.38 0.28 3.32 2.72 0.00 -0.42 -5.01 105.19 107.46 2nqt n GLY 126 Ca 0.01 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2nqt n GLY 126 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nqt s SER 127 N -2.59 0.09 0.27 1.61 1.04 -1.26 -5.07 113.70 107.79 2nqt s SER 127 Ca 0.00 -1.11 -0.29 0.00 0.48 0.00 0.00 55.95 55.03 2nqt s SER 127 Cb 0.00 0.43 -0.10 0.00 0.10 0.00 0.00 66.02 66.45 2nqt s SER 127 CO 0.00 -0.90 1.32 -0.44 0.98 0.00 0.00 173.24 174.19 2nqt s SER 128 N -3.05 6.83 0.25 7.02 0.01 -1.26 -3.95 113.70 119.55 2nqt s SER 128 Ca 0.26 2.56 -0.31 0.00 1.31 0.00 0.00 55.95 59.78 2nqt s SER 128 Cb 0.04 -2.63 -0.12 0.00 0.21 0.00 0.00 66.02 63.53 2nqt s SER 128 CO 0.06 -0.53 1.67 -2.28 0.41 0.00 0.00 173.24 172.57 2nqt s HIS 129 N -0.54 2.81 -0.69 2.43 2.46 -1.26 -4.91 115.29 115.58 2nqt s HIS 129 Ca 0.53 0.55 0.25 0.00 0.47 0.00 0.00 55.06 56.85 2nqt s HIS 129 Cb -0.38 -4.12 0.51 0.00 -0.13 0.00 0.00 32.58 28.46 2nqt s HIS 129 CO 0.46 -4.02 1.48 0.00 -2.47 0.00 0.00 174.74 170.19 2nqt n ALA 130 N 3.06 2.73 0.00 1.58 0.00 -1.26 -5.08 120.51 121.54 2nqt n ALA 130 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2nqt n ALA 130 Cb 0.36 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.54 2nqt n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqt n GLY 131 N 1.34 -0.84 3.05 0.00 0.00 -1.26 -5.06 105.19 102.42 2nqt n GLY 131 Ca 0.04 -2.15 -0.11 0.00 0.00 0.00 0.00 46.02 43.81 2nqt n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nqt s SER 132 N -4.00 0.09 0.29 1.61 1.04 -1.26 -4.34 113.70 107.12 2nqt s SER 132 Ca 0.00 -0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.27 2nqt s SER 132 Cb 0.00 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 66.24 2nqt s SER 132 CO 0.00 -0.31 -0.14 0.26 0.98 0.00 0.00 173.24 174.03 2nqt s TRP 133 N -1.27 2.41 -0.15 5.02 0.51 -0.18 -5.03 118.94 120.25 2nqt s TRP 133 Ca -0.14 -0.32 -0.40 0.00 -2.12 0.00 0.00 56.10 53.12 2nqt s TRP 133 Cb -0.08 -1.09 -0.17 0.00 -0.81 0.00 0.00 33.47 31.32 2nqt s TRP 133 CO 0.01 0.67 1.50 -2.30 -0.51 0.00 0.00 176.95 176.31 2nqt n PRO 134 N -0.72 0.82 -2.56 4.98 -0.02 -1.26 -4.33 135.00 131.92 2nqt n PRO 134 Ca -0.05 0.30 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 2nqt n PRO 134 Cb 0.60 -1.92 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 2nqt n PRO 134 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2nqt s TYR 135 N 1.96 3.41 -0.06 6.00 5.04 -1.26 -1.07 117.35 131.36 2nqt s TYR 135 Ca 0.94 1.42 -0.05 0.00 -2.44 0.00 0.00 57.07 56.93 2nqt s TYR 135 Cb -1.12 -3.31 -0.21 0.00 0.35 0.00 0.00 41.96 37.67 2nqt s TYR 135 CO 0.61 -0.79 3.41 0.41 -1.34 0.00 0.00 175.55 177.85 2nqt n GLY 136 N 3.18 3.16 2.79 8.97 0.00 0.64 -4.60 105.19 119.33 2nqt n GLY 136 Ca 0.09 -1.23 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 2nqt n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nqt s LEU 137 N -0.30 3.98 0.63 0.99 2.96 -1.26 -4.51 118.68 121.17 2nqt s LEU 137 Ca 0.62 -3.55 0.35 0.00 -0.22 0.00 0.00 54.13 51.33 2nqt s LEU 137 Cb 0.31 -1.36 2.01 0.00 0.50 0.00 0.00 46.19 47.65 2nqt s LEU 137 CO -0.03 -0.12 2.24 -0.65 -1.32 0.00 0.00 176.35 176.46 2nqt h PRO 138 N 5.62 0.00 0.00 0.98 0.11 -1.90 -2.09 132.00 134.73 2nqt h PRO 138 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2nqt h PRO 138 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2nqt h PRO 138 CO 0.63 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 179.33 2nqt h GLU 139 N 0.00 0.00 -6.94 1.05 3.07 -1.96 -3.17 114.58 106.63 2nqt h GLU 139 Ca 0.02 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.36 2nqt h GLU 139 Cb 0.17 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 28.15 2nqt h GLU 139 CO -0.00 0.00 0.57 -0.51 -1.40 0.00 0.00 179.01 177.67 2nqt s LEU 140 N -4.61 4.21 0.16 1.33 1.43 -0.79 -4.93 118.68 115.49 2nqt s LEU 140 Ca 0.10 2.52 -0.34 0.00 -1.03 0.00 0.00 54.13 55.39 2nqt s LEU 140 Cb 0.12 -3.94 -0.14 0.00 0.03 0.00 0.00 46.19 42.25 2nqt s LEU 140 CO 0.60 -0.77 1.48 -2.65 0.23 0.00 0.00 176.35 175.25 2nqt n PRO 141 N 0.13 1.88 0.00 1.29 -0.02 -1.26 -1.49 135.00 135.54 2nqt n PRO 141 Ca 0.04 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2nqt n PRO 141 Cb 0.45 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2nqt n PRO 141 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nqt n GLY 142 N 2.97 2.99 0.17 -1.23 0.00 -1.26 -4.89 105.19 103.95 2nqt n GLY 142 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 2nqt n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqt h ALA 143 N 0.00 0.18 -0.76 4.61 0.00 -1.50 -3.26 119.26 118.52 2nqt h ALA 143 Ca 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 54.91 54.43 2nqt h ALA 143 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 2nqt h ALA 143 CO 0.00 0.43 0.45 -0.09 0.00 0.00 0.00 179.25 180.04 2nqt h ARG 144 N 0.13 0.80 -0.44 0.00 2.43 -1.73 -1.91 114.38 113.66 2nqt h ARG 144 Ca -0.05 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2nqt h ARG 144 Cb 1.25 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 2nqt h ARG 144 CO 0.12 0.53 0.29 -0.44 -1.51 0.00 0.00 179.97 178.96 2nqt h ASP 145 N 0.83 0.48 1.49 -3.80 3.32 -1.91 -1.79 116.42 115.04 2nqt h ASP 145 Ca 0.34 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 2nqt h ASP 145 Cb 0.18 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 2nqt h ASP 145 CO -0.18 0.34 -0.01 1.56 -1.72 0.00 0.00 179.24 179.23 2nqt h GLN 146 N 0.56 0.00 0.00 3.56 4.20 -1.40 -3.26 115.11 118.78 2nqt h GLN 146 Ca 0.17 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.65 2nqt h GLN 146 Cb -0.02 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 2nqt h GLN 146 CO -0.04 0.01 -1.54 -0.07 -0.67 0.00 0.00 178.83 176.52 2nqt h LEU 147 N 0.00 0.00 -9.29 1.46 3.38 -1.10 -3.41 115.31 106.35 2nqt h LEU 147 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2nqt h LEU 147 Cb 0.76 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.53 2nqt h LEU 147 CO 0.00 0.79 1.26 0.54 0.09 0.00 0.00 178.44 181.12 2nqt n ARG 148 N -2.97 2.65 -0.97 1.13 1.74 -1.03 -1.48 116.66 115.72 2nqt n ARG 148 Ca -0.13 0.94 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 2nqt n ARG 148 Cb 0.94 -2.99 0.00 0.00 -1.02 0.00 0.00 32.46 29.39 2nqt n ARG 148 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nqt n GLY 149 N 4.73 0.32 3.73 -0.13 0.00 -0.96 -4.92 105.19 107.96 2nqt n GLY 149 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2nqt n GLY 149 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nqt s THR 150 N -1.72 2.51 -1.00 2.61 -1.32 -0.55 -4.94 115.64 111.23 2nqt s THR 150 Ca 0.00 0.24 0.11 0.00 -1.21 0.00 0.00 61.69 60.82 2nqt s THR 150 Cb 0.00 -2.73 0.28 0.00 -1.51 0.00 0.00 72.50 68.54 2nqt s THR 150 CO 0.00 -0.15 1.20 0.54 -2.21 0.00 0.00 174.62 174.00 2nqt n ARG 151 N -2.86 2.55 -3.76 7.08 5.12 -1.26 -4.74 116.66 118.80 2nqt n ARG 151 Ca 0.12 -1.94 -0.15 0.00 -1.93 0.00 0.00 57.85 53.96 2nqt n ARG 151 Cb 0.51 -1.26 -0.15 0.00 -1.16 0.00 0.00 32.46 30.39 2nqt n ARG 151 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2nqt s ARG 152 N -0.99 0.01 -0.04 5.56 1.81 -1.26 -1.03 118.95 123.00 2nqt s ARG 152 Ca 0.22 0.28 0.01 0.00 -1.72 0.00 0.00 55.73 54.51 2nqt s ARG 152 Cb 0.12 -0.23 0.02 0.00 -0.45 0.00 0.00 34.95 34.41 2nqt s ARG 152 CO 0.16 -0.18 -0.03 0.42 -0.68 0.00 0.00 175.30 174.99 2nqt s ILE 153 N 1.19 0.45 -0.36 1.52 1.01 -0.60 -4.00 121.20 120.42 2nqt s ILE 153 Ca -0.08 -0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.38 2nqt s ILE 153 Cb -0.12 -0.50 0.01 0.00 0.01 0.00 0.00 42.46 41.85 2nqt s ILE 153 CO -0.04 0.21 0.22 0.00 0.00 0.00 0.00 174.94 175.33 2nqt s ALA 154 N 0.99 3.38 0.19 9.38 0.00 -0.23 -0.83 121.76 134.63 2nqt s ALA 154 Ca -0.10 -1.55 -0.30 0.00 0.00 0.00 0.00 51.96 50.02 2nqt s ALA 154 Cb -0.14 -2.62 -0.08 0.00 0.00 0.00 0.00 23.12 20.29 2nqt s ALA 154 CO -0.01 -1.17 1.13 0.08 0.00 0.00 0.00 175.76 175.80 2nqt s VAL 155 N 1.64 3.75 0.71 0.00 1.01 0.05 -0.26 120.40 127.30 2nqt s VAL 155 Ca 0.04 1.51 -0.15 0.00 0.00 0.00 0.00 61.98 63.38 2nqt s VAL 155 Cb -0.18 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.26 2nqt s VAL 155 CO 0.08 0.26 1.19 -2.84 0.00 0.00 0.00 175.10 173.79 2nqt s PRO 156 N -0.40 2.29 0.00 2.72 0.02 -1.26 -4.73 135.00 133.63 2nqt s PRO 156 Ca 0.50 1.70 0.00 0.00 0.02 0.00 0.00 61.00 63.22 2nqt s PRO 156 Cb -0.31 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.36 2nqt s PRO 156 CO 0.36 -1.71 0.00 0.41 -0.33 0.00 0.00 177.00 175.73 2nqt n GLY 157 N 0.24 -3.09 0.00 0.52 0.00 -1.26 -4.72 105.19 96.87 2nqt n GLY 157 Ca 0.13 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2nqt n GLY 157 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2nqt n TYR 159 N 0.00 0.00 -0.19 1.61 4.01 -1.26 -2.33 117.16 119.00 2nqt n TYR 159 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 2nqt n TYR 159 Cb 0.00 0.00 0.37 0.00 -0.31 0.00 0.00 39.34 39.40 2nqt n TYR 159 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2nqt h PRO 160 N 0.00 0.69 0.04 -0.72 0.11 -1.95 -1.05 132.00 129.12 2nqt h PRO 160 Ca 0.00 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.09 2nqt h PRO 160 Cb 0.00 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 30.92 2nqt h PRO 160 CO 0.00 0.46 -0.22 1.15 -0.21 0.00 0.00 178.00 179.18 2nqt h THR 161 N 0.71 0.49 -0.27 -1.15 2.02 -1.82 0.17 112.91 113.07 2nqt h THR 161 Ca 0.33 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.50 2nqt h THR 161 Cb 0.36 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 2nqt h THR 161 CO -0.12 0.00 0.12 0.00 0.37 0.00 0.00 175.52 175.90 2nqt h ALA 162 N 0.47 0.34 -0.50 6.16 0.00 -1.75 -2.24 119.26 121.74 2nqt h ALA 162 Ca 0.05 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2nqt h ALA 162 Cb 0.43 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2nqt h ALA 162 CO -0.18 -0.09 -0.13 0.00 0.00 0.00 0.00 179.25 178.85 2nqt h ALA 163 N 0.98 0.69 -0.43 0.00 0.00 -1.02 -1.41 119.26 118.07 2nqt h ALA 163 Ca 0.09 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 2nqt h ALA 163 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2nqt h ALA 163 CO -0.01 0.62 -0.16 -0.07 0.00 0.00 0.00 179.25 179.63 2nqt h LEU 164 N 0.84 0.89 -1.10 0.00 3.38 -0.66 -0.92 115.31 117.74 2nqt h LEU 164 Ca 0.13 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2nqt h LEU 164 Cb 0.70 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2nqt h LEU 164 CO 0.05 1.08 0.11 -0.07 0.09 0.00 0.00 178.44 179.70 2nqt h LEU 165 N 0.70 0.70 -0.67 1.67 3.38 -1.27 -0.30 115.31 119.53 2nqt h LEU 165 Ca 0.10 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2nqt h LEU 165 Cb 0.72 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2nqt h LEU 165 CO 0.05 0.70 -0.38 0.00 0.09 0.00 0.00 178.44 178.90 2nqt h ALA 166 N 1.40 0.84 0.00 1.53 0.00 -0.91 -3.39 119.26 118.73 2nqt h ALA 166 Ca 0.16 -0.43 -0.19 0.00 0.00 0.00 0.00 54.91 54.45 2nqt h ALA 166 Cb 0.28 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2nqt h ALA 166 CO -0.00 0.64 -1.81 1.28 0.00 0.00 0.00 179.25 179.36 2nqt n LEU 167 N -4.04 0.00 -0.31 0.00 4.77 -0.38 -4.74 117.00 112.29 2nqt n LEU 167 Ca -0.02 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 2nqt n LEU 167 Cb 0.51 0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.94 2nqt n LEU 167 CO 0.45 0.26 1.11 2.19 -1.33 0.00 0.00 177.39 180.07 2nqt h PHE 168 N 0.00 1.23 -0.73 -1.77 -5.15 -1.25 -2.60 116.94 106.67 2nqt h PHE 168 Ca -0.29 -0.06 -0.03 0.00 -0.20 0.00 0.00 57.97 57.39 2nqt h PHE 168 Cb 1.60 -0.38 -0.03 0.00 0.22 0.00 0.00 35.95 37.35 2nqt h PHE 168 CO 0.00 0.89 0.35 -1.35 -2.00 0.00 0.00 178.31 176.20 2nqt h PRO 169 N 1.22 1.05 -0.57 6.09 0.11 -1.83 0.13 132.00 138.20 2nqt h PRO 169 Ca 0.29 -0.15 -0.09 0.00 0.11 0.00 0.00 66.00 66.16 2nqt h PRO 169 Cb 0.13 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.02 2nqt h PRO 169 CO -0.04 0.81 -0.01 0.00 -0.21 0.00 0.00 178.00 178.56 2nqt h ALA 170 N 1.34 0.76 -0.15 -0.75 0.00 -1.81 -2.41 119.26 116.25 2nqt h ALA 170 Ca 0.25 -0.31 -0.22 0.00 0.00 0.00 0.00 54.91 54.63 2nqt h ALA 170 Cb 0.11 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2nqt h ALA 170 CO -0.03 0.60 -0.79 1.25 0.00 0.00 0.00 179.25 180.28 2nqt h LEU 171 N 0.89 0.93 -1.40 0.00 5.85 -1.15 -1.55 115.31 118.88 2nqt h LEU 171 Ca 0.16 -0.61 0.03 0.00 0.84 0.00 0.00 57.88 58.29 2nqt h LEU 171 Cb 0.55 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2nqt h LEU 171 CO 0.03 1.41 0.43 0.00 -0.34 0.00 0.00 178.44 179.97 2nqt h ALA 172 N 0.57 1.62 -0.00 1.25 0.00 -0.70 -0.07 119.26 121.93 2nqt h ALA 172 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2nqt h ALA 172 Cb 1.42 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2nqt h ALA 172 CO 0.16 0.32 -0.01 0.00 0.00 0.00 0.00 179.25 179.72 2nqt n ALA 173 N -2.45 2.56 -3.34 0.00 0.00 -0.91 -4.92 120.51 111.45 2nqt n ALA 173 Ca 0.08 -0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.11 2nqt n ALA 173 Cb 0.11 -1.47 0.05 0.00 0.00 0.00 0.00 19.45 18.14 2nqt n ALA 173 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2nqt n ASP 174 N -1.19 -6.14 -0.45 0.00 2.03 -0.04 -4.91 116.55 105.85 2nqt n ASP 174 Ca 0.16 -0.43 0.10 0.00 0.52 0.00 0.00 54.79 55.14 2nqt n ASP 174 Cb 0.22 -4.90 -0.00 0.00 -0.72 0.00 0.00 41.12 35.73 2nqt n ASP 174 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2nqt n LEU 175 N -4.50 1.89 -4.22 -2.67 4.77 -0.61 -4.94 117.00 106.71 2nqt n LEU 175 Ca -0.05 -0.77 -0.14 0.00 -0.03 0.00 0.00 56.01 55.02 2nqt n LEU 175 Cb 0.59 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.57 2nqt n LEU 175 CO 0.57 0.35 -0.41 0.27 -1.33 0.00 0.00 177.39 176.84 2nqt s ILE 176 N -2.20 1.06 0.59 -0.08 -4.36 -1.24 -4.35 121.20 110.61 2nqt s ILE 176 Ca 0.16 -1.93 -0.18 0.00 -0.26 0.00 0.00 60.65 58.45 2nqt s ILE 176 Cb 0.16 -1.69 -0.04 0.00 1.25 0.00 0.00 42.46 42.14 2nqt s ILE 176 CO 0.49 -0.70 1.13 -1.61 0.24 0.00 0.00 174.94 174.48 2nqt s GLU 177 N -3.47 3.15 0.00 0.37 0.41 -0.15 -4.85 118.70 114.16 2nqt s GLU 177 Ca 0.13 1.54 0.26 0.00 -0.41 0.00 0.00 54.97 56.49 2nqt s GLU 177 Cb 0.01 -1.98 1.51 0.00 -1.78 0.00 0.00 34.13 31.89 2nqt s GLU 177 CO -0.00 -1.00 1.98 -0.35 -0.49 0.00 0.00 175.26 175.40 2nqt n PRO 178 N -1.70 1.07 -3.04 0.39 -0.04 -1.26 -4.58 135.00 125.84 2nqt n PRO 178 Ca 0.11 -0.10 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 2nqt n PRO 178 Cb 0.51 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 2nqt n PRO 178 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nqt s ALA 179 N -1.99 3.30 0.15 0.55 0.00 -1.26 -1.71 121.76 120.80 2nqt s ALA 179 Ca 0.39 -1.60 0.07 0.00 0.00 0.00 0.00 51.96 50.82 2nqt s ALA 179 Cb 0.18 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2nqt s ALA 179 CO 0.30 -2.18 -0.00 0.14 0.00 0.00 0.00 175.76 174.02 2nqt s VAL 180 N 3.13 3.79 -0.06 0.00 -7.23 -0.15 -4.46 120.40 115.43 2nqt s VAL 180 Ca 0.20 -1.29 0.05 0.00 -1.81 0.00 0.00 61.98 59.14 2nqt s VAL 180 Cb -0.17 -2.87 -0.00 0.00 0.56 0.00 0.00 36.38 33.89 2nqt s VAL 180 CO 0.14 -0.03 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.79 2nqt s THR 181 N -1.58 1.79 -0.08 5.32 2.01 0.05 -1.14 115.64 122.01 2nqt s THR 181 Ca 0.27 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.37 2nqt s THR 181 Cb -0.10 -1.53 0.02 0.00 0.01 0.00 0.00 72.50 70.90 2nqt s THR 181 CO 0.18 0.50 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.84 2nqt s VAL 182 N 0.05 0.95 -0.21 3.82 1.01 0.95 -0.29 120.40 126.68 2nqt s VAL 182 Ca -0.07 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.62 2nqt s VAL 182 Cb -0.14 -0.94 0.04 0.00 0.00 0.00 0.00 36.38 35.34 2nqt s VAL 182 CO 0.04 0.34 -0.14 -0.69 0.00 0.00 0.00 175.10 174.65 2nqt s VAL 183 N 1.26 1.94 -0.12 2.92 1.01 -0.02 -0.82 120.40 126.56 2nqt s VAL 183 Ca -0.04 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.80 2nqt s VAL 183 Cb -0.14 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.32 2nqt s VAL 183 CO -0.03 0.24 -0.21 0.00 0.00 0.00 0.00 175.10 175.10 2nqt s ALA 184 N 1.27 2.11 0.05 5.51 0.00 -0.26 -0.92 121.76 129.53 2nqt s ALA 184 Ca -0.01 -0.98 -0.13 0.00 0.00 0.00 0.00 51.96 50.84 2nqt s ALA 184 Cb -0.16 -0.90 -0.06 0.00 0.00 0.00 0.00 23.12 22.00 2nqt s ALA 184 CO -0.09 0.07 0.43 0.14 0.00 0.00 0.00 175.76 176.32 2nqt s VAL 185 N 0.68 5.02 0.00 0.00 -7.23 -0.40 -0.56 120.40 117.91 2nqt s VAL 185 Ca -0.11 0.72 0.01 0.00 -1.81 0.00 0.00 61.98 60.79 2nqt s VAL 185 Cb -0.16 -3.70 -0.01 0.00 0.56 0.00 0.00 36.38 33.07 2nqt s VAL 185 CO 0.02 0.43 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.64 2nqt s SER 186 N -1.40 0.54 0.97 4.85 0.15 0.25 -1.59 113.70 117.47 2nqt s SER 186 Ca 0.29 -0.16 -0.12 0.00 0.70 0.00 0.00 55.95 56.67 2nqt s SER 186 Cb -0.16 -0.04 0.17 0.00 -1.71 0.00 0.00 66.02 64.29 2nqt s SER 186 CO 0.16 0.01 1.09 -0.83 1.20 0.00 0.00 173.24 174.86 2nqt s GLY 187 N -0.35 1.59 0.07 9.45 0.00 -0.04 -1.24 107.32 116.80 2nqt s GLY 187 Ca -0.01 -0.13 0.26 0.00 0.00 0.00 0.00 44.72 44.84 2nqt s GLY 187 CO -0.00 0.43 1.60 -1.30 0.00 0.00 0.00 173.10 173.83 2nqt n THR 188 N -4.16 0.20 0.29 0.90 -2.24 0.21 -3.35 114.28 106.13 2nqt n THR 188 Ca 0.06 -0.12 0.17 0.00 -2.27 0.00 0.00 64.05 61.89 2nqt n THR 188 Cb 0.56 -0.21 0.86 0.00 -2.10 0.00 0.00 70.33 69.44 2nqt n THR 188 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2nqt h SER 189 N 0.00 0.00 0.50 3.42 4.64 -1.57 -1.98 113.55 118.56 2nqt h SER 189 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2nqt h SER 189 Cb 0.60 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2nqt h SER 189 CO 0.00 0.05 -0.08 1.23 -0.87 0.00 0.00 176.83 177.17 2nqt h GLY 190 N 0.89 0.00 1.33 -0.77 0.00 -1.80 -2.36 103.07 100.35 2nqt h GLY 190 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2nqt h GLY 190 CO 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.53 2nqt n ALA 191 N -2.19 2.57 0.00 3.60 0.00 -0.74 -5.04 120.51 118.71 2nqt n ALA 191 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2nqt n ALA 191 Cb 0.24 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2nqt n ALA 191 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqt n GLY 192 N 1.23 -3.16 0.64 0.00 0.00 -0.89 -4.75 105.19 98.26 2nqt n GLY 192 Ca 0.16 -1.82 0.06 0.00 0.00 0.00 0.00 46.02 44.42 2nqt n GLY 192 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2nqt n ARG 193 N -0.44 2.61 -2.47 1.61 0.63 -1.26 -4.88 116.66 112.46 2nqt n ARG 193 Ca 0.00 -1.97 -0.42 0.00 -0.92 0.00 0.00 57.85 54.54 2nqt n ARG 193 Cb 0.00 -1.27 -0.03 0.00 0.45 0.00 0.00 32.46 31.61 2nqt n ARG 193 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2nqt s ALA 194 N -1.00 3.50 -0.13 5.13 0.00 -1.26 -4.96 121.76 123.05 2nqt s ALA 194 Ca 0.23 0.60 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 2nqt s ALA 194 Cb 0.12 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 2nqt s ALA 194 CO 0.16 -0.78 1.45 0.00 0.00 0.00 0.00 175.76 176.59 2nqt s ALA 195 N 2.28 3.60 0.10 0.00 0.00 -1.26 -5.00 121.76 121.48 2nqt s ALA 195 Ca 0.55 0.63 0.04 0.00 0.00 0.00 0.00 51.96 53.18 2nqt s ALA 195 Cb -0.24 -3.69 -0.04 0.00 0.00 0.00 0.00 23.12 19.15 2nqt s ALA 195 CO 0.21 -1.35 -0.10 0.95 0.00 0.00 0.00 175.76 175.48 2nqt s THR 196 N 3.88 0.94 0.24 0.00 -4.23 -1.26 -5.06 115.64 110.15 2nqt s THR 196 Ca 0.63 -1.67 -0.05 0.00 -1.18 0.00 0.00 61.69 59.43 2nqt s THR 196 Cb -0.26 -1.39 0.21 0.00 1.34 0.00 0.00 72.50 72.39 2nqt s THR 196 CO 0.22 -0.58 1.79 0.74 -0.54 0.00 0.00 174.62 176.24 2nqt h THR 197 N 3.50 0.84 0.00 3.99 2.02 -1.99 -2.19 112.91 119.08 2nqt h THR 197 Ca -0.37 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.58 2nqt h THR 197 Cb 1.19 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 2nqt h THR 197 CO 0.54 0.12 0.00 0.44 0.37 0.00 0.00 175.52 176.99 2nqt h ASP 198 N 0.68 0.00 -0.06 4.18 3.32 -2.00 -2.30 116.42 120.24 2nqt h ASP 198 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 2nqt h ASP 198 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2nqt h ASP 198 CO -0.28 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.42 2nqt n LEU 199 N -2.40 2.32 -4.76 1.55 4.77 -0.84 -4.66 117.00 112.98 2nqt n LEU 199 Ca 0.01 -1.09 -0.39 0.00 -0.03 0.00 0.00 56.01 54.51 2nqt n LEU 199 Cb 0.18 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2nqt n LEU 199 CO 0.18 0.44 1.01 -0.76 -1.33 0.00 0.00 177.39 176.93 2nqt s LEU 200 N -1.21 4.01 0.20 2.23 1.43 -0.87 -4.82 118.68 119.65 2nqt s LEU 200 Ca 0.18 2.79 -0.11 0.00 -1.03 0.00 0.00 54.13 55.97 2nqt s LEU 200 Cb 0.13 -4.08 0.25 0.00 0.03 0.00 0.00 46.19 42.51 2nqt s LEU 200 CO 0.19 -1.28 1.72 1.23 0.23 0.00 0.00 176.35 178.44 2nqt h GLY 201 N 2.00 0.74 1.57 -3.19 0.00 -1.94 -1.22 103.07 101.03 2nqt h GLY 201 Ca -0.51 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 46.76 2nqt h GLY 201 CO 0.60 -0.06 0.24 0.00 0.00 0.00 0.00 176.54 177.32 2nqt h ALA 202 N 1.42 1.63 -0.14 3.60 0.00 -1.91 0.53 119.26 124.39 2nqt h ALA 202 Ca 0.29 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2nqt h ALA 202 Cb 0.38 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2nqt h ALA 202 CO -0.34 0.32 -0.12 0.93 0.00 0.00 0.00 179.25 180.04 2nqt h GLU 203 N 0.58 0.33 0.22 0.00 4.39 -1.59 -3.36 114.58 115.14 2nqt h GLU 203 Ca 0.15 -0.17 -0.34 0.00 0.34 0.00 0.00 59.36 59.35 2nqt h GLU 203 Cb -0.00 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2nqt h GLU 203 CO -0.03 0.71 -1.57 -0.39 -1.16 0.00 0.00 179.01 176.57 2nqt h VAL 204 N -0.04 1.17 -2.72 3.13 -1.51 -0.80 -3.42 116.25 112.06 2nqt h VAL 204 Ca 0.02 -2.66 -0.54 0.00 -1.23 0.00 0.00 66.70 62.29 2nqt h VAL 204 Cb 0.64 2.93 0.07 0.00 -2.13 0.00 0.00 31.29 32.79 2nqt h VAL 204 CO 0.03 0.83 0.94 -0.38 -1.23 0.00 0.00 177.57 177.76 2nqt n ILE 205 N -3.65 0.25 -1.16 7.19 5.41 0.14 -1.97 119.36 125.57 2nqt n ILE 205 Ca -0.19 -0.06 -0.05 0.00 1.00 0.00 0.00 62.75 63.44 2nqt n ILE 205 Cb 1.09 -1.89 -0.02 0.00 -0.71 0.00 0.00 39.64 38.11 2nqt n ILE 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2nqt n GLY 206 N 3.44 0.79 3.03 7.39 0.00 -1.26 -4.93 105.19 113.65 2nqt n GLY 206 Ca 0.14 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.52 2nqt n GLY 206 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nqt s SER 207 N -2.70 0.18 0.01 1.61 0.15 -0.83 -5.09 113.70 107.03 2nqt s SER 207 Ca 0.00 -0.44 0.03 0.00 0.70 0.00 0.00 55.95 56.24 2nqt s SER 207 Cb 0.00 0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.44 2nqt s SER 207 CO 0.00 -0.35 -0.11 0.00 1.20 0.00 0.00 173.24 173.98 2nqt s ALA 208 N -1.65 0.89 -0.16 5.45 0.00 -1.26 -3.75 121.76 121.28 2nqt s ALA 208 Ca -0.14 -0.58 -0.13 0.00 0.00 0.00 0.00 51.96 51.11 2nqt s ALA 208 Cb -0.08 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.92 2nqt s ALA 208 CO -0.01 0.18 0.42 -0.98 0.00 0.00 0.00 175.76 175.37 2nqt s ARG 209 N -0.65 0.46 0.50 0.00 1.70 -0.86 -4.99 118.95 115.11 2nqt s ARG 209 Ca 0.02 0.65 -0.20 0.00 -0.47 0.00 0.00 55.73 55.73 2nqt s ARG 209 Cb -0.06 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.40 2nqt s ARG 209 CO 0.00 -0.09 1.04 0.00 -1.08 0.00 0.00 175.30 175.17 2nqt s ALA 210 N 0.58 2.87 0.10 7.88 0.00 -1.26 -0.54 121.76 131.38 2nqt s ALA 210 Ca -0.03 0.56 -0.09 0.00 0.00 0.00 0.00 51.96 52.40 2nqt s ALA 210 Cb -0.05 -3.24 -0.00 0.00 0.00 0.00 0.00 23.12 19.83 2nqt s ALA 210 CO -0.04 -0.36 0.21 1.52 0.00 0.00 0.00 175.76 177.10 2nqt s TYR 211 N -2.07 0.16 -1.33 0.00 -0.85 -0.78 -4.93 117.35 107.55 2nqt s TYR 211 Ca 0.66 -0.57 -0.13 0.00 -0.52 0.00 0.00 57.07 56.51 2nqt s TYR 211 Cb -0.16 -0.04 0.01 0.00 0.38 0.00 0.00 41.96 42.15 2nqt s TYR 211 CO 0.22 -0.57 0.48 0.09 -1.52 0.00 0.00 175.55 174.25 2nqt n ASN 212 N -0.09 -2.04 -4.94 -0.18 3.02 -1.26 -4.23 115.26 105.53 2nqt n ASN 212 Ca -0.14 -1.14 -0.24 0.00 -0.03 0.00 0.00 54.58 53.03 2nqt n ASN 212 Cb 0.63 -2.50 0.05 0.00 -0.61 0.00 0.00 39.78 37.35 2nqt n ASN 212 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2nqt s ILE 213 N -3.84 2.53 -1.44 2.41 -4.36 -1.26 -2.73 121.20 112.51 2nqt s ILE 213 Ca 0.22 -0.39 -0.03 0.00 -0.26 0.00 0.00 60.65 60.19 2nqt s ILE 213 Cb -0.10 -3.04 0.00 0.00 1.25 0.00 0.00 42.46 40.57 2nqt s ILE 213 CO 0.93 -0.04 0.40 0.00 0.24 0.00 0.00 174.94 176.47 2nqt n ALA 214 N -2.69 -0.78 -0.12 2.27 0.00 -1.26 -3.00 120.51 114.93 2nqt n ALA 214 Ca 0.08 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2nqt n ALA 214 Cb 0.60 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 16.91 2nqt n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqt n GLY 215 N -1.33 0.64 0.20 0.00 0.00 -1.26 -4.95 105.19 98.48 2nqt n GLY 215 Ca -0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.01 2nqt n GLY 215 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2nqt h VAL 216 N 0.00 0.00 -3.02 1.61 -1.51 -1.70 -3.46 116.25 108.18 2nqt h VAL 216 Ca 0.00 -1.00 -0.53 0.00 -1.23 0.00 0.00 66.70 63.94 2nqt h VAL 216 Cb 0.00 1.89 0.04 0.00 -2.13 0.00 0.00 31.29 31.09 2nqt h VAL 216 CO 0.00 0.00 0.79 -2.28 -1.23 0.00 0.00 177.57 174.85 2nqt s HIS 217 N -3.24 3.14 -0.58 5.19 5.04 -1.11 -4.90 115.29 118.83 2nqt s HIS 217 Ca 0.05 0.86 0.20 0.00 -1.54 0.00 0.00 55.06 54.63 2nqt s HIS 217 Cb 0.06 -3.80 0.88 0.00 0.04 0.00 0.00 32.58 29.76 2nqt s HIS 217 CO 0.70 -2.81 1.62 0.54 -2.34 0.00 0.00 174.74 172.45 2nqt n ARG 218 N 3.58 0.14 0.07 2.88 1.74 -1.26 -1.39 116.66 122.42 2nqt n ARG 218 Ca 0.11 0.42 0.13 0.00 -0.77 0.00 0.00 57.85 57.74 2nqt n ARG 218 Cb 0.40 -1.79 0.47 0.00 -1.02 0.00 0.00 32.46 30.53 2nqt n ARG 218 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2nqt n HIS 219 N -2.05 0.63 0.18 -1.55 8.25 -1.26 -3.97 115.22 115.46 2nqt n HIS 219 Ca 0.02 0.19 -0.15 0.00 -0.26 0.00 0.00 57.72 57.52 2nqt n HIS 219 Cb 0.18 -0.81 -0.07 0.00 1.12 0.00 0.00 29.99 30.41 2nqt n HIS 219 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2nqt h THR 220 N 0.00 0.32 0.00 1.59 2.02 -1.58 -0.95 112.91 114.31 2nqt h THR 220 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2nqt h THR 220 Cb 0.62 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2nqt h THR 220 CO 0.00 0.00 -0.01 1.55 0.37 0.00 0.00 175.52 177.43 2nqt h PRO 221 N -0.64 0.00 -0.17 6.66 0.13 -1.79 -1.64 132.00 134.56 2nqt h PRO 221 Ca -0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.93 2nqt h PRO 221 Cb 0.61 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.74 2nqt h PRO 221 CO -0.10 0.01 -0.68 1.49 -0.23 0.00 0.00 178.00 178.49 2nqt h GLU 222 N 0.00 0.75 -0.14 0.86 4.81 -1.57 0.49 114.58 119.78 2nqt h GLU 222 Ca -0.00 -0.59 0.00 0.00 -0.13 0.00 0.00 59.36 58.64 2nqt h GLU 222 Cb 0.29 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2nqt h GLU 222 CO 0.00 1.20 0.09 0.82 -0.73 0.00 0.00 179.01 180.39 2nqt h ILE 223 N 0.47 1.02 -0.72 2.32 2.04 -0.72 -2.39 117.51 119.54 2nqt h ILE 223 Ca -0.04 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 65.83 2nqt h ILE 223 Cb 1.31 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 38.15 2nqt h ILE 223 CO 0.14 0.03 0.39 0.00 0.00 0.00 0.00 178.15 178.72 2nqt h ALA 224 N 1.06 0.98 -0.44 1.87 0.00 -1.16 -1.99 119.26 119.58 2nqt h ALA 224 Ca 0.06 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2nqt h ALA 224 Cb -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2nqt h ALA 224 CO -0.02 0.04 0.22 0.37 0.00 0.00 0.00 179.25 179.86 2nqt h GLN 225 N 0.70 0.64 -0.21 0.00 4.15 -0.74 0.75 115.11 120.38 2nqt h GLN 225 Ca 0.33 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.59 2nqt h GLN 225 Cb 0.26 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 2nqt h GLN 225 CO -0.22 0.54 -0.18 0.78 -1.93 0.00 0.00 178.83 177.82 2nqt h GLY 226 N 0.58 0.40 1.27 2.39 0.00 -1.10 -2.76 103.07 103.85 2nqt h GLY 226 Ca 0.15 -0.28 -0.24 0.00 0.00 0.00 0.00 47.33 46.96 2nqt h GLY 226 CO -0.02 0.26 -0.93 1.41 0.00 0.00 0.00 176.54 177.26 2nqt h LEU 227 N 0.34 0.85 -2.65 3.11 3.38 -0.99 -3.10 115.31 116.25 2nqt h LEU 227 Ca 0.06 -0.63 -0.00 0.00 0.09 0.00 0.00 57.88 57.39 2nqt h LEU 227 Cb 0.52 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2nqt h LEU 227 CO 0.03 1.43 -0.01 0.03 0.09 0.00 0.00 178.44 180.01 2nqt h ARG 228 N 0.42 0.00 0.00 1.13 3.08 -0.66 -1.52 114.38 116.83 2nqt h ARG 228 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2nqt h ARG 228 Cb 1.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.62 2nqt h ARG 228 CO 0.18 0.01 0.00 0.00 -1.07 0.00 0.00 179.97 179.09 2nqt h ALA 229 N 1.99 1.00 -0.06 0.04 0.00 -1.41 -3.23 119.26 117.59 2nqt h ALA 229 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nqt h ALA 229 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2nqt h ALA 229 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 2nqt n VAL 230 N -2.74 0.15 -3.87 0.00 0.24 -0.58 -5.02 118.33 106.51 2nqt n VAL 230 Ca 0.03 -0.58 -0.10 0.00 -2.04 0.00 0.00 64.34 61.65 2nqt n VAL 230 Cb 0.37 1.12 -0.09 0.00 -1.47 0.00 0.00 33.84 33.77 2nqt n VAL 230 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2nqt s THR 231 N -0.94 0.12 -1.26 3.34 -1.32 -1.18 -4.22 115.64 110.18 2nqt s THR 231 Ca 0.14 -0.97 0.25 0.00 -1.21 0.00 0.00 61.69 59.91 2nqt s THR 231 Cb 0.10 -0.92 0.09 0.00 -1.51 0.00 0.00 72.50 70.25 2nqt s THR 231 CO 0.14 -0.54 1.45 0.47 -2.21 0.00 0.00 174.62 173.94 2nqt n ASP 232 N 0.68 0.69 -4.83 8.08 8.00 -1.26 -4.77 116.55 123.15 2nqt n ASP 232 Ca -0.19 -0.49 -0.31 0.00 0.71 0.00 0.00 54.79 54.51 2nqt n ASP 232 Cb 0.59 0.23 0.03 0.00 -0.02 0.00 0.00 41.12 41.94 2nqt n ASP 232 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2nqt s ARG 233 N -2.83 3.24 -0.21 -1.24 0.52 -1.26 -4.99 118.95 112.18 2nqt s ARG 233 Ca 0.15 0.97 -0.29 0.00 -0.52 0.00 0.00 55.73 56.04 2nqt s ARG 233 Cb 0.18 -2.03 -0.00 0.00 0.52 0.00 0.00 34.95 33.62 2nqt s ARG 233 CO 0.64 -0.86 1.21 -0.51 0.02 0.00 0.00 175.30 175.80 2nqt s ASP 234 N -3.58 6.93 -0.01 0.23 1.01 -1.26 -4.96 116.67 115.03 2nqt s ASP 234 Ca 0.59 1.50 -0.14 0.00 0.71 0.00 0.00 52.55 55.20 2nqt s ASP 234 Cb -0.13 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.20 2nqt s ASP 234 CO 0.49 -0.80 0.39 -0.69 0.21 0.00 0.00 175.17 174.77 2nqt s VAL 235 N 3.59 5.06 0.05 -1.27 1.01 -1.26 -4.63 120.40 122.96 2nqt s VAL 235 Ca 0.52 0.80 0.05 0.00 0.00 0.00 0.00 61.98 63.35 2nqt s VAL 235 Cb -0.19 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2nqt s VAL 235 CO 0.14 0.58 -0.14 -0.94 0.00 0.00 0.00 175.10 174.73 2nqt s SER 236 N -1.03 1.69 -0.11 3.32 1.04 -0.69 -4.99 113.70 112.93 2nqt s SER 236 Ca 0.23 -0.53 -0.01 0.00 0.48 0.00 0.00 55.95 56.12 2nqt s SER 236 Cb -0.16 -0.08 0.03 0.00 0.10 0.00 0.00 66.02 65.90 2nqt s SER 236 CO 0.13 -0.01 -0.07 -0.69 0.98 0.00 0.00 173.24 173.58 2nqt s VAL 237 N -1.04 0.95 -0.39 5.02 1.01 -1.26 -0.97 120.40 123.72 2nqt s VAL 237 Ca 0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 2nqt s VAL 237 Cb -0.09 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.31 2nqt s VAL 237 CO 0.02 0.34 0.27 -0.55 0.00 0.00 0.00 175.10 175.18 2nqt s SER 238 N 1.74 6.00 -0.15 3.32 0.15 -0.29 -4.91 113.70 119.56 2nqt s SER 238 Ca 0.05 -0.85 0.02 0.00 0.70 0.00 0.00 55.95 55.86 2nqt s SER 238 Cb -0.13 -2.12 0.02 0.00 -1.71 0.00 0.00 66.02 62.08 2nqt s SER 238 CO -0.08 -0.40 -0.19 0.12 1.20 0.00 0.00 173.24 173.89 2nqt s PHE 239 N 1.65 2.51 -0.19 3.44 5.36 -1.26 -0.03 117.98 129.46 2nqt s PHE 239 Ca 0.04 -1.35 0.01 0.00 -0.96 0.00 0.00 56.93 54.67 2nqt s PHE 239 Cb -0.19 -1.75 0.04 0.00 -0.34 0.00 0.00 43.02 40.79 2nqt s PHE 239 CO 0.09 -0.66 -0.09 0.99 -1.46 0.00 0.00 175.22 174.09 2nqt s THR 240 N 1.10 1.51 0.13 0.12 2.01 -0.00 -4.32 115.64 116.18 2nqt s THR 240 Ca -0.01 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 60.92 2nqt s THR 240 Cb -0.14 -1.61 -0.07 0.00 0.01 0.00 0.00 72.50 70.69 2nqt s THR 240 CO -0.07 0.15 0.54 -2.16 -0.69 0.00 0.00 174.62 172.39 2nqt s PRO 241 N 1.45 4.00 -0.09 4.92 0.04 -1.26 -1.10 135.00 142.95 2nqt s PRO 241 Ca -0.01 0.51 -0.01 0.00 0.04 0.00 0.00 61.00 61.53 2nqt s PRO 241 Cb -0.16 -2.98 0.03 0.00 0.04 0.00 0.00 34.50 31.42 2nqt s PRO 241 CO -0.08 0.51 -0.05 0.08 0.04 0.00 0.00 177.00 177.50 2nqt s VAL 242 N -1.41 0.77 0.03 -0.36 1.01 0.28 -1.86 120.40 118.87 2nqt s VAL 242 Ca 0.36 -0.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.93 2nqt s VAL 242 Cb -0.16 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 2nqt s VAL 242 CO 0.19 0.32 0.88 -0.76 0.00 0.00 0.00 175.10 175.73 2nqt s LEU 243 N 1.74 4.42 0.22 3.92 1.43 0.30 -0.58 118.68 130.13 2nqt s LEU 243 Ca 0.04 1.58 0.06 0.00 -1.03 0.00 0.00 54.13 54.78 2nqt s LEU 243 Cb -0.13 -3.42 -0.05 0.00 0.03 0.00 0.00 46.19 42.63 2nqt s LEU 243 CO -0.06 -0.11 -0.09 0.27 0.23 0.00 0.00 176.35 176.59 2nqt s ILE 244 N 0.41 1.51 -1.32 -0.59 -4.36 -0.38 -2.04 121.20 114.43 2nqt s ILE 244 Ca 0.45 -2.13 -0.13 0.00 -0.26 0.00 0.00 60.65 58.58 2nqt s ILE 244 Cb -0.21 -2.19 -0.05 0.00 1.25 0.00 0.00 42.46 41.26 2nqt s ILE 244 CO 0.26 -0.48 2.39 -0.81 0.24 0.00 0.00 174.94 176.54 2nqt n PRO 245 N -0.42 2.79 -4.03 0.37 -0.04 -1.25 -4.25 135.00 128.16 2nqt n PRO 245 Ca -0.07 -2.19 -0.10 0.00 -0.04 0.00 0.00 63.50 61.10 2nqt n PRO 245 Cb 0.62 -2.96 -0.11 0.00 -0.04 0.00 0.00 33.50 31.01 2nqt n PRO 245 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nqt s ALA 246 N 3.20 0.35 0.08 0.55 0.00 -1.26 -4.92 121.76 119.77 2nqt s ALA 246 Ca 0.55 -0.76 -0.08 0.00 0.00 0.00 0.00 51.96 51.67 2nqt s ALA 246 Cb 0.15 0.13 -0.24 0.00 0.00 0.00 0.00 23.12 23.16 2nqt s ALA 246 CO -0.04 -0.15 1.16 0.77 0.00 0.00 0.00 175.76 177.51 2nqt h SER 247 N 4.33 0.59 -4.18 0.00 0.02 -1.92 0.63 113.55 113.02 2nqt h SER 247 Ca -0.34 -0.57 -0.29 0.00 -0.84 0.00 0.00 61.79 59.75 2nqt h SER 247 Cb 1.20 -0.19 -0.15 0.00 0.14 0.00 0.00 62.40 63.40 2nqt h SER 247 CO 0.45 1.41 -0.71 -0.13 -1.14 0.00 0.00 176.83 176.72 2nqt s ARG 248 N -2.88 1.00 0.00 3.45 0.52 -1.26 -1.72 118.95 118.06 2nqt s ARG 248 Ca -0.06 -1.42 0.00 0.00 -0.52 0.00 0.00 55.73 53.73 2nqt s ARG 248 Cb 0.07 -0.48 0.00 0.00 0.52 0.00 0.00 34.95 35.06 2nqt s ARG 248 CO 0.90 0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.66 2nqt n GLY 249 N -0.15 3.15 3.04 -3.53 0.00 -1.26 -4.30 105.19 102.13 2nqt n GLY 249 Ca -0.11 -1.61 -0.25 0.00 0.00 0.00 0.00 46.02 44.06 2nqt n GLY 249 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nqt s ILE 250 N -1.32 1.20 -0.30 -0.61 1.01 -0.02 -0.86 121.20 120.30 2nqt s ILE 250 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2nqt s ILE 250 Cb 0.00 -1.09 0.06 0.00 0.01 0.00 0.00 42.46 41.44 2nqt s ILE 250 CO 0.00 0.37 -0.01 -0.22 0.00 0.00 0.00 174.94 175.08 2nqt s LEU 251 N 0.63 3.99 -0.25 2.97 2.96 -0.62 -1.57 118.68 126.80 2nqt s LEU 251 Ca -0.15 -1.48 -0.13 0.00 -0.22 0.00 0.00 54.13 52.15 2nqt s LEU 251 Cb -0.16 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 2nqt s LEU 251 CO 0.04 -0.28 0.29 0.00 -1.32 0.00 0.00 176.35 175.08 2nqt s ALA 252 N 1.16 3.57 -0.27 5.97 0.00 0.28 -1.27 121.76 131.20 2nqt s ALA 252 Ca -0.03 -0.81 -0.10 0.00 0.00 0.00 0.00 51.96 51.02 2nqt s ALA 252 Cb -0.20 -2.55 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2nqt s ALA 252 CO -0.03 -0.42 0.15 0.99 0.00 0.00 0.00 175.76 176.45 2nqt s THR 253 N 1.55 5.00 -0.08 0.00 2.01 -0.09 -1.55 115.64 122.48 2nqt s THR 253 Ca 0.13 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.22 2nqt s THR 253 Cb -0.15 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 69.00 2nqt s THR 253 CO 0.08 0.28 -0.16 0.00 -0.69 0.00 0.00 174.62 174.13 2nqt s THR 255 N 0.57 0.87 -0.03 0.00 -4.23 0.60 -0.49 115.64 112.92 2nqt s THR 255 Ca -0.16 -1.90 -0.29 0.00 -1.18 0.00 0.00 61.69 58.17 2nqt s THR 255 Cb -0.16 -1.64 0.09 0.00 1.34 0.00 0.00 72.50 72.12 2nqt s THR 255 CO 0.05 -0.77 0.78 0.00 -0.54 0.00 0.00 174.62 174.14 2nqt s ALA 256 N -3.27 -1.79 0.41 3.99 0.00 -0.99 -0.77 121.76 119.35 2nqt s ALA 256 Ca 0.11 1.19 -0.26 0.00 0.00 0.00 0.00 51.96 53.01 2nqt s ALA 256 Cb 0.03 0.04 -0.09 0.00 0.00 0.00 0.00 23.12 23.10 2nqt s ALA 256 CO -0.02 -0.48 1.32 1.03 0.00 0.00 0.00 175.76 177.61 2nqt s ARG 257 N -1.94 3.91 0.02 0.00 1.81 -1.26 -0.28 118.95 121.21 2nqt s ARG 257 Ca -0.04 2.20 -0.14 0.00 -1.72 0.00 0.00 55.73 56.03 2nqt s ARG 257 Cb -0.00 -2.73 0.02 0.00 -0.45 0.00 0.00 34.95 31.78 2nqt s ARG 257 CO 0.01 -0.56 0.30 -0.08 -0.68 0.00 0.00 175.30 174.29 2nqt s THR 258 N -1.25 0.07 -0.05 0.02 -1.32 -0.31 -0.97 115.64 111.82 2nqt s THR 258 Ca 0.58 -0.61 0.07 0.00 -1.21 0.00 0.00 61.69 60.52 2nqt s THR 258 Cb -0.39 -0.80 0.11 0.00 -1.51 0.00 0.00 72.50 69.92 2nqt s THR 258 CO 0.50 -0.34 0.99 0.54 -2.21 0.00 0.00 174.62 174.10 2nqt n ARG 259 N 0.88 1.34 -3.25 7.08 1.74 -1.26 -4.21 116.66 118.98 2nqt n ARG 259 Ca -0.20 -1.68 -0.37 0.00 -0.77 0.00 0.00 57.85 54.82 2nqt n ARG 259 Cb 0.58 -1.03 -0.06 0.00 -1.02 0.00 0.00 32.46 30.93 2nqt n ARG 259 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2nqt s SER 260 N -1.59 7.01 0.41 0.55 0.01 -1.26 -5.05 113.70 113.79 2nqt s SER 260 Ca 0.12 1.26 -0.26 0.00 1.31 0.00 0.00 55.95 58.38 2nqt s SER 260 Cb 0.11 -2.36 -0.10 0.00 0.21 0.00 0.00 66.02 63.88 2nqt s SER 260 CO 0.01 0.18 1.40 -2.65 0.41 0.00 0.00 173.24 172.59 2nqt n PRO 261 N 1.28 2.29 -0.31 12.44 -0.02 -1.26 -4.90 135.00 144.52 2nqt n PRO 261 Ca -0.07 0.81 0.10 0.00 -2.02 0.00 0.00 63.50 62.32 2nqt n PRO 261 Cb 0.51 -2.56 0.26 0.00 -0.02 0.00 0.00 33.50 31.69 2nqt n PRO 261 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2nqt h LEU 262 N 2.46 0.50 -1.48 2.45 5.85 -1.97 -1.59 115.31 121.53 2nqt h LEU 262 Ca -0.50 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.37 2nqt h LEU 262 Cb 1.27 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 2nqt h LEU 262 CO 0.62 0.16 0.39 -1.28 -0.34 0.00 0.00 178.44 177.98 2nqt h SER 263 N 0.57 0.59 -0.27 1.25 0.87 -1.99 0.17 113.55 114.73 2nqt h SER 263 Ca 0.51 -0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.88 2nqt h SER 263 Cb 0.81 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 2nqt h SER 263 CO -0.41 0.40 -0.54 1.56 -0.53 0.00 0.00 176.83 177.31 2nqt h GLN 264 N 0.68 0.87 -0.29 2.24 4.20 -1.67 -1.49 115.11 119.65 2nqt h GLN 264 Ca 0.23 -0.55 -0.00 0.00 0.06 0.00 0.00 58.65 58.39 2nqt h GLN 264 Cb 0.09 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 2nqt h GLN 264 CO -0.06 1.18 0.17 -0.07 -0.67 0.00 0.00 178.83 179.38 2nqt h LEU 265 N 0.67 0.36 -1.28 1.46 3.38 -0.99 -2.04 115.31 116.87 2nqt h LEU 265 Ca 0.02 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2nqt h LEU 265 Cb 1.15 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2nqt h LEU 265 CO 0.12 0.33 0.50 0.03 0.09 0.00 0.00 178.44 179.51 2nqt h ARG 266 N 0.36 0.91 -0.47 1.13 3.08 -0.64 -1.09 114.38 117.66 2nqt h ARG 266 Ca 0.10 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 2nqt h ARG 266 Cb 0.04 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 2nqt h ARG 266 CO -0.02 0.60 0.08 0.00 -1.07 0.00 0.00 179.97 179.56 2nqt h ALA 267 N 1.55 1.27 -0.52 0.04 0.00 -0.85 -0.52 119.26 120.23 2nqt h ALA 267 Ca 0.30 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2nqt h ALA 267 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2nqt h ALA 267 CO -0.09 0.50 0.07 0.00 0.00 0.00 0.00 179.25 179.74 2nqt h ALA 268 N 1.40 1.14 -0.11 0.00 0.00 -0.50 -0.79 119.26 120.40 2nqt h ALA 268 Ca 0.15 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 2nqt h ALA 268 Cb 0.31 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2nqt h ALA 268 CO 0.00 0.57 -0.69 1.88 0.00 0.00 0.00 179.25 181.01 2nqt h TYR 269 N 0.79 0.63 -0.09 0.00 0.05 -1.03 -2.10 116.97 115.22 2nqt h TYR 269 Ca 0.16 -0.26 -0.00 0.00 0.05 0.00 0.00 58.73 58.68 2nqt h TYR 269 Cb 0.38 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.01 2nqt h TYR 269 CO 0.02 1.02 0.05 0.93 -1.05 0.00 0.00 178.16 179.13 2nqt h GLU 270 N 0.33 0.12 -0.60 4.88 4.39 -0.91 -1.01 114.58 121.77 2nqt h GLU 270 Ca -0.02 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.73 2nqt h GLU 270 Cb 1.26 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.83 2nqt h GLU 270 CO 0.12 0.12 0.29 -0.22 -1.16 0.00 0.00 179.01 178.16 2nqt h LYS 271 N 0.08 0.51 -0.16 2.33 3.64 -1.05 -0.45 116.57 121.47 2nqt h LYS 271 Ca 0.03 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 2nqt h LYS 271 Cb 0.04 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2nqt h LYS 271 CO -0.01 0.34 -0.69 0.00 -2.27 0.00 0.00 179.45 176.82 2nqt h ALA 272 N 1.36 0.48 -0.00 5.00 0.00 -1.20 -3.39 119.26 121.51 2nqt h ALA 272 Ca 0.28 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2nqt h ALA 272 Cb 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2nqt h ALA 272 CO -0.22 0.71 -0.03 0.66 0.00 0.00 0.00 179.25 180.36 2nqt n TYR 273 N -3.92 0.00 0.17 0.00 4.01 -0.40 -4.68 117.16 112.33 2nqt n TYR 273 Ca -0.05 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.78 2nqt n TYR 273 Cb 0.69 0.00 0.61 0.00 -0.31 0.00 0.00 39.34 40.33 2nqt n TYR 273 CO 0.00 0.00 0.00 1.12 -0.46 0.00 0.00 176.86 177.52 2nqt h HIS 274 N 0.16 0.10 -0.45 -0.72 2.07 -1.26 -1.73 115.15 113.33 2nqt h HIS 274 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2nqt h HIS 274 Cb 0.05 -0.04 0.00 0.00 2.57 0.00 0.00 27.41 30.00 2nqt h HIS 274 CO 0.00 0.06 0.00 0.00 -3.07 0.00 0.00 177.93 174.92 2nqt n ALA 275 N -2.54 2.60 -2.60 6.11 0.00 -1.26 -4.92 120.51 117.90 2nqt n ALA 275 Ca 0.00 -1.52 -0.43 0.00 0.00 0.00 0.00 53.44 51.49 2nqt n ALA 275 Cb 0.16 -0.69 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 2nqt n ALA 275 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2nqt s GLU 276 N -1.59 3.00 0.54 0.00 0.41 -0.65 -4.97 118.70 115.44 2nqt s GLU 276 Ca 0.37 -1.06 0.28 0.00 -0.41 0.00 0.00 54.97 54.15 2nqt s GLU 276 Cb 0.23 -4.03 1.54 0.00 -1.78 0.00 0.00 34.13 30.10 2nqt s GLU 276 CO 0.19 -0.87 2.11 -1.00 -0.49 0.00 0.00 175.26 175.20 2nqt h PRO 277 N 8.70 0.00 0.00 0.39 0.13 -1.91 -2.70 132.00 136.62 2nqt h PRO 277 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2nqt h PRO 277 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2nqt h PRO 277 CO 0.80 0.09 -0.51 1.19 -0.23 0.00 0.00 178.00 179.33 2nqt n PHE 278 N -3.67 0.20 -3.69 1.56 3.72 -1.26 -4.82 117.46 109.51 2nqt n PHE 278 Ca -0.02 0.06 -0.38 0.00 -0.05 0.00 0.00 57.45 57.06 2nqt n PHE 278 Cb 0.20 -0.42 -0.12 0.00 -0.94 0.00 0.00 39.48 38.21 2nqt n PHE 278 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2nqt s ILE 279 N -3.06 4.56 -0.22 4.37 -1.09 -1.02 -1.00 121.20 123.74 2nqt s ILE 279 Ca 0.09 -0.27 -0.04 0.00 -2.23 0.00 0.00 60.65 58.21 2nqt s ILE 279 Cb 0.16 -3.24 -0.01 0.00 -1.58 0.00 0.00 42.46 37.79 2nqt s ILE 279 CO 0.70 0.19 -0.04 -0.47 -1.23 0.00 0.00 174.94 174.08 2nqt s TYR 280 N 1.63 2.96 -0.18 3.97 5.04 0.11 -4.82 117.35 126.06 2nqt s TYR 280 Ca 0.05 -0.97 -0.20 0.00 -2.44 0.00 0.00 57.07 53.52 2nqt s TYR 280 Cb -0.16 -2.10 -0.03 0.00 0.35 0.00 0.00 41.96 40.02 2nqt s TYR 280 CO 0.06 -0.56 0.59 -0.51 -1.34 0.00 0.00 175.55 173.79 2nqt s LEU 281 N 1.47 4.17 0.36 6.97 1.43 -1.26 -0.78 118.68 131.04 2nqt s LEU 281 Ca 0.06 0.82 -0.28 0.00 -1.03 0.00 0.00 54.13 53.69 2nqt s LEU 281 Cb -0.14 -2.84 -0.11 0.00 0.03 0.00 0.00 46.19 43.13 2nqt s LEU 281 CO -0.03 -0.21 1.45 -0.04 0.23 0.00 0.00 176.35 177.74 2nqt s MET 282 N 1.65 4.17 0.79 1.70 -1.94 -0.17 -4.94 119.30 120.57 2nqt s MET 282 Ca 0.28 2.49 -0.15 0.00 -1.71 0.00 0.00 55.69 56.60 2nqt s MET 282 Cb -0.16 -2.99 0.02 0.00 2.01 0.00 0.00 34.83 33.70 2nqt s MET 282 CO 0.11 -0.45 0.74 -2.30 -0.01 0.00 0.00 175.02 173.10 2nqt n PRO 283 N 0.58 0.17 -1.68 2.03 -0.02 -1.26 -4.87 135.00 129.94 2nqt n PRO 283 Ca 0.01 0.11 -0.45 0.00 -2.02 0.00 0.00 63.50 61.15 2nqt n PRO 283 Cb 0.40 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 2nqt n PRO 283 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2nqt n GLU 284 N -1.77 2.28 -0.56 -0.52 -0.58 -1.26 -1.66 120.64 116.58 2nqt n GLU 284 Ca 0.11 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.67 2nqt n GLU 284 Cb 0.51 -2.58 0.00 0.00 -0.57 0.00 0.00 31.44 28.80 2nqt n GLU 284 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2nqt n GLY 285 N 3.13 0.76 3.48 0.62 0.00 -1.26 -5.05 105.19 106.87 2nqt n GLY 285 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2nqt n GLY 285 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqt s GLN 286 N -0.44 1.82 0.11 1.61 -0.21 -0.66 -5.15 119.66 116.74 2nqt s GLN 286 Ca 0.00 -1.15 0.05 0.00 0.02 0.00 0.00 55.36 54.28 2nqt s GLN 286 Cb 0.00 -2.12 -0.04 0.00 1.00 0.00 0.00 33.01 31.86 2nqt s GLN 286 CO 0.00 0.49 -0.13 -0.51 -2.12 0.00 0.00 175.29 173.02 2nqt s LEU 287 N -2.02 2.40 0.64 2.90 1.43 -1.26 -4.73 118.68 118.04 2nqt s LEU 287 Ca 0.17 -0.80 -0.16 0.00 -1.03 0.00 0.00 54.13 52.32 2nqt s LEU 287 Cb -0.11 -0.47 -0.01 0.00 0.03 0.00 0.00 46.19 45.64 2nqt s LEU 287 CO 0.09 -0.18 1.12 -2.84 0.23 0.00 0.00 176.35 174.78 2nqt s PRO 288 N -2.65 2.83 -0.00 1.29 0.02 -1.26 -5.06 135.00 130.17 2nqt s PRO 288 Ca 0.07 1.47 0.01 0.00 0.02 0.00 0.00 61.00 62.57 2nqt s PRO 288 Cb -0.05 -1.95 -0.00 0.00 0.02 0.00 0.00 34.50 32.53 2nqt s PRO 288 CO 0.02 -1.24 -0.02 -0.98 -0.33 0.00 0.00 177.00 174.45 2nqt s ARG 289 N -3.92 0.17 0.41 5.54 1.70 -1.26 -4.97 118.95 116.62 2nqt s ARG 289 Ca 0.69 -0.07 0.09 0.00 -0.47 0.00 0.00 55.73 55.97 2nqt s ARG 289 Cb -0.22 -0.17 0.88 0.00 -0.57 0.00 0.00 34.95 34.88 2nqt s ARG 289 CO 0.39 0.04 2.01 1.79 -1.08 0.00 0.00 175.30 178.45 2nqt h THR 290 N 5.12 1.12 -0.68 4.99 1.35 -1.92 -1.96 112.91 120.93 2nqt h THR 290 Ca -0.26 -0.41 0.17 0.00 -0.55 0.00 0.00 66.41 65.36 2nqt h THR 290 Cb 1.20 0.86 -0.04 0.00 -1.73 0.00 0.00 68.15 68.45 2nqt h THR 290 CO 0.51 0.15 0.47 1.23 -0.25 0.00 0.00 175.52 177.63 2nqt h GLY 291 N 0.54 0.31 2.00 5.82 0.00 -1.96 -1.95 103.07 107.84 2nqt h GLY 291 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2nqt h GLY 291 CO -0.00 0.02 0.00 0.00 0.00 0.00 0.00 176.54 176.56 2nqt h ALA 292 N 1.67 1.00 -0.01 3.60 0.00 -1.72 -3.26 119.26 120.54 2nqt h ALA 292 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2nqt h ALA 292 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2nqt h ALA 292 CO -0.06 0.00 -0.21 1.33 0.00 0.00 0.00 179.25 180.32 2nqt n VAL 293 N -2.45 0.00 -1.70 0.00 0.24 -0.76 -3.39 118.33 110.28 2nqt n VAL 293 Ca 0.04 -0.40 -0.44 0.00 -2.04 0.00 0.00 64.34 61.51 2nqt n VAL 293 Cb 0.40 1.08 -0.03 0.00 -1.47 0.00 0.00 33.84 33.82 2nqt n VAL 293 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2nqt n ILE 294 N -0.43 0.19 -1.00 1.34 2.08 -1.06 -1.15 119.36 119.34 2nqt n ILE 294 Ca 0.03 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.29 2nqt n ILE 294 Cb 0.17 -1.77 0.00 0.00 -0.75 0.00 0.00 39.64 37.29 2nqt n ILE 294 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2nqt n GLY 295 N 3.41 0.82 3.64 7.39 0.00 -1.26 -0.40 105.19 118.78 2nqt n GLY 295 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 2nqt n GLY 295 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nqt s SER 296 N -2.65 4.20 -0.13 1.61 1.04 -0.30 -4.82 113.70 112.65 2nqt s SER 296 Ca 0.00 -0.98 0.12 0.00 0.48 0.00 0.00 55.95 55.57 2nqt s SER 296 Cb 0.00 -0.54 0.57 0.00 0.10 0.00 0.00 66.02 66.15 2nqt s SER 296 CO 0.00 -0.24 1.41 -3.20 0.98 0.00 0.00 173.24 172.19 2nqt n ASN 297 N -0.96 4.07 -4.87 7.02 5.15 0.37 -4.18 115.26 121.86 2nqt n ASN 297 Ca -0.04 -2.50 -0.30 0.00 -0.60 0.00 0.00 54.58 51.13 2nqt n ASN 297 Cb 0.62 -0.57 -0.03 0.00 -0.53 0.00 0.00 39.78 39.27 2nqt n ASN 297 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nqt s ALA 298 N -2.03 3.34 -0.10 5.20 0.00 -1.26 -4.60 121.76 122.31 2nqt s ALA 298 Ca 0.39 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.21 2nqt s ALA 298 Cb 0.27 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.68 2nqt s ALA 298 CO 0.15 0.01 -0.22 0.00 0.00 0.00 0.00 175.76 175.71 2nqt s ALA 299 N -2.35 2.02 -0.17 0.00 0.00 -0.17 -4.34 121.76 116.75 2nqt s ALA 299 Ca 0.52 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 2nqt s ALA 299 Cb -0.10 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 2nqt s ALA 299 CO 0.30 0.20 0.03 -1.01 0.00 0.00 0.00 175.76 175.29 2nqt s HIS 300 N 0.48 3.18 -0.03 0.00 3.76 -0.46 -0.71 115.29 121.51 2nqt s HIS 300 Ca -0.16 -0.03 0.02 0.00 -0.15 0.00 0.00 55.06 54.74 2nqt s HIS 300 Cb -0.17 -2.03 0.00 0.00 1.11 0.00 0.00 32.58 31.49 2nqt s HIS 300 CO 0.06 0.12 -0.08 0.42 -0.85 0.00 0.00 174.74 174.41 2nqt s ILE 301 N 0.30 0.71 0.06 0.60 1.01 0.04 -0.94 121.20 122.97 2nqt s ILE 301 Ca 0.01 -0.31 0.04 0.00 0.00 0.00 0.00 60.65 60.39 2nqt s ILE 301 Cb -0.13 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.68 2nqt s ILE 301 CO 0.01 0.23 -0.12 0.00 0.00 0.00 0.00 174.94 175.06 2nqt s ALA 302 N 0.24 1.00 0.14 9.38 0.00 -0.65 -1.00 121.76 130.88 2nqt s ALA 302 Ca -0.04 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.05 2nqt s ALA 302 Cb -0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 2nqt s ALA 302 CO 0.00 0.11 -0.14 0.14 0.00 0.00 0.00 175.76 175.87 2nqt s VAL 303 N -1.34 1.42 0.20 0.00 -7.23 -1.26 -0.85 120.40 111.34 2nqt s VAL 303 Ca -0.04 -1.86 -0.19 0.00 -1.81 0.00 0.00 61.98 58.08 2nqt s VAL 303 Cb -0.10 -1.69 0.03 0.00 0.56 0.00 0.00 36.38 35.19 2nqt s VAL 303 CO 0.02 -0.48 0.56 0.00 -0.31 0.00 0.00 175.10 174.88 2nqt s ALA 304 N -2.43 -1.06 -0.10 1.32 0.00 0.18 -5.00 121.76 114.68 2nqt s ALA 304 Ca 0.13 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.97 2nqt s ALA 304 Cb -0.03 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.96 2nqt s ALA 304 CO 0.04 -0.83 -0.19 0.08 0.00 0.00 0.00 175.76 174.86 2nqt s VAL 305 N -3.86 1.68 -0.63 0.00 1.01 -1.26 -1.01 120.40 116.33 2nqt s VAL 305 Ca 0.08 -0.78 -0.20 0.00 0.00 0.00 0.00 61.98 61.09 2nqt s VAL 305 Cb -0.02 -1.49 0.10 0.00 0.00 0.00 0.00 36.38 34.97 2nqt s VAL 305 CO -0.03 0.48 0.79 -0.62 0.00 0.00 0.00 175.10 175.72 2nqt s ASP 306 N 0.63 6.21 0.12 3.32 -1.08 0.85 -4.94 116.67 121.78 2nqt s ASP 306 Ca -0.14 -1.36 -0.14 0.00 -0.52 0.00 0.00 52.55 50.39 2nqt s ASP 306 Cb -0.16 -2.33 -0.04 0.00 -1.46 0.00 0.00 42.92 38.92 2nqt s ASP 306 CO 0.04 -1.19 1.51 -0.33 0.52 0.00 0.00 175.17 175.72 2nqt h GLU 307 N 9.25 0.74 -0.95 4.34 5.08 -1.97 0.20 114.58 131.28 2nqt h GLU 307 Ca -0.27 -0.30 0.04 0.00 -1.00 0.00 0.00 59.36 57.83 2nqt h GLU 307 Cb 1.08 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.24 2nqt h GLU 307 CO 1.12 0.91 0.62 -0.44 -1.00 0.00 0.00 179.01 180.21 2nqt h ASP 308 N 0.54 1.03 0.02 1.42 5.19 -1.97 -1.94 116.42 120.71 2nqt h ASP 308 Ca 0.09 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2nqt h ASP 308 Cb 0.65 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2nqt h ASP 308 CO 0.04 0.71 -0.04 0.00 -3.12 0.00 0.00 179.24 176.83 2nqt n ALA 309 N -2.36 2.65 -4.06 3.45 0.00 -1.08 -4.95 120.51 114.17 2nqt n ALA 309 Ca 0.13 -0.44 -0.27 0.00 0.00 0.00 0.00 53.44 52.85 2nqt n ALA 309 Cb 0.10 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.35 2nqt n ALA 309 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2nqt n GLN 310 N 0.06 -2.50 -4.34 0.00 6.02 -0.03 -4.92 117.38 111.68 2nqt n GLN 310 Ca 0.18 0.30 -0.22 0.00 -0.01 0.00 0.00 57.00 57.26 2nqt n GLN 310 Cb 0.36 -4.20 -0.16 0.00 1.02 0.00 0.00 30.24 27.25 2nqt n GLN 310 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2nqt s THR 311 N -4.08 0.76 0.17 5.09 2.01 -0.69 -1.17 115.64 117.73 2nqt s THR 311 Ca 0.01 -0.27 -0.27 0.00 0.31 0.00 0.00 61.69 61.48 2nqt s THR 311 Cb -0.01 -0.74 -0.08 0.00 0.01 0.00 0.00 72.50 71.69 2nqt s THR 311 CO 0.92 0.27 0.84 0.12 -0.69 0.00 0.00 174.62 176.09 2nqt s PHE 312 N 0.77 3.90 -0.10 4.92 5.36 0.61 -0.10 117.98 133.34 2nqt s PHE 312 Ca -0.13 1.72 0.01 0.00 -0.96 0.00 0.00 56.93 57.58 2nqt s PHE 312 Cb -0.15 -2.87 0.02 0.00 -0.34 0.00 0.00 43.02 39.68 2nqt s PHE 312 CO 0.02 0.43 -0.13 0.08 -1.46 0.00 0.00 175.22 174.16 2nqt s VAL 313 N -0.88 1.34 -0.08 3.12 1.01 -0.18 -2.34 120.40 122.39 2nqt s VAL 313 Ca 0.39 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.85 2nqt s VAL 313 Cb -0.24 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 34.91 2nqt s VAL 313 CO 0.28 0.41 -0.19 0.00 0.00 0.00 0.00 175.10 175.60 2nqt s ALA 314 N 1.02 1.78 -0.14 5.51 0.00 0.36 -0.65 121.76 129.64 2nqt s ALA 314 Ca -0.07 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.15 2nqt s ALA 314 Cb -0.15 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 2nqt s ALA 314 CO -0.01 0.22 -0.11 0.42 0.00 0.00 0.00 175.76 176.28 2nqt s ILE 315 N 0.43 3.19 -0.05 0.00 -1.09 -0.03 -0.82 121.20 122.83 2nqt s ILE 315 Ca -0.16 -0.61 0.03 0.00 -2.23 0.00 0.00 60.65 57.68 2nqt s ILE 315 Cb -0.17 -2.35 0.01 0.00 -1.58 0.00 0.00 42.46 38.37 2nqt s ILE 315 CO 0.06 0.52 -0.12 0.00 -1.23 0.00 0.00 174.94 174.17 2nqt s ALA 316 N 0.41 1.19 -0.10 9.38 0.00 -0.60 -1.63 121.76 130.40 2nqt s ALA 316 Ca -0.09 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.47 2nqt s ALA 316 Cb -0.16 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 2nqt s ALA 316 CO 0.05 0.13 -0.14 0.00 0.00 0.00 0.00 175.76 175.80 2nqt s ALA 317 N 0.51 2.62 0.08 0.00 0.00 -0.12 -0.56 121.76 124.29 2nqt s ALA 317 Ca -0.11 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 2nqt s ALA 317 Cb -0.14 -1.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 2nqt s ALA 317 CO 0.03 0.37 0.02 0.96 0.00 0.00 0.00 175.76 177.13 2nqt s ILE 318 N -0.06 0.18 -0.28 0.00 -4.36 -0.61 -1.36 121.20 114.71 2nqt s ILE 318 Ca -0.03 -1.78 -0.26 0.00 -0.26 0.00 0.00 60.65 58.31 2nqt s ILE 318 Cb -0.14 -1.66 0.01 0.00 1.25 0.00 0.00 42.46 41.92 2nqt s ILE 318 CO 0.04 -0.81 0.93 -0.62 0.24 0.00 0.00 174.94 174.71 2nqt s ASP 319 N -2.95 6.85 0.51 4.36 -1.08 -1.26 -0.84 116.67 122.26 2nqt s ASP 319 Ca 0.12 0.98 0.20 0.00 -0.52 0.00 0.00 52.55 53.33 2nqt s ASP 319 Cb 0.08 -2.48 1.28 0.00 -1.46 0.00 0.00 42.92 40.34 2nqt s ASP 319 CO -0.07 -0.68 2.03 -0.55 0.52 0.00 0.00 175.17 176.42 2nqt h ASN 320 N 7.90 0.08 1.13 -0.34 -1.07 -1.92 -2.01 115.58 119.35 2nqt h ASN 320 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.15 2nqt h ASN 320 Cb 1.08 -0.02 0.00 0.00 -2.07 0.00 0.00 38.32 37.31 2nqt h ASN 320 CO 0.94 0.05 -0.73 -0.07 0.07 0.00 0.00 177.43 177.69 2nqt h LEU 321 N 0.09 0.00 0.00 6.14 3.38 -1.92 -2.54 115.31 120.46 2nqt h LEU 321 Ca 0.19 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2nqt h LEU 321 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2nqt h LEU 321 CO -0.02 0.03 0.00 0.52 0.09 0.00 0.00 178.44 179.06 2nqt n VAL 322 N -2.59 0.00 0.26 1.22 0.31 -0.81 -0.63 118.33 116.09 2nqt n VAL 322 Ca 0.02 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.43 2nqt n VAL 322 Cb 0.52 -0.58 0.66 0.00 -0.91 0.00 0.00 33.84 33.52 2nqt n VAL 322 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2nqt h LYS 323 N 0.00 0.00 0.00 5.55 1.63 -1.64 0.31 116.57 122.43 2nqt h LYS 323 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2nqt h LYS 323 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2nqt h LYS 323 CO 0.00 0.06 0.00 0.41 -3.45 0.00 0.00 179.45 176.47 2nqt n GLY 324 N -1.31 -1.58 0.00 5.01 0.00 -0.85 -4.06 105.19 102.40 2nqt n GLY 324 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2nqt n GLY 324 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2nqt n THR 325 N -2.01 0.00 0.04 2.61 -1.04 -0.45 -4.69 114.28 108.74 2nqt n THR 325 Ca 0.06 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.00 2nqt n THR 325 Cb 0.37 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 68.99 2nqt n THR 325 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nqt h ALA 326 N 1.52 0.83 -0.42 2.41 0.00 -0.73 -1.51 119.26 121.37 2nqt h ALA 326 Ca 0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 2nqt h ALA 326 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2nqt h ALA 326 CO 0.00 0.67 -0.10 0.78 0.00 0.00 0.00 179.25 180.61 2nqt h GLY 327 N 1.20 0.88 0.77 0.00 0.00 -0.53 -0.03 103.07 105.36 2nqt h GLY 327 Ca 0.01 -0.72 0.04 0.00 0.00 0.00 0.00 47.33 46.66 2nqt h GLY 327 CO 0.09 0.66 0.38 0.00 0.00 0.00 0.00 176.54 177.67 2nqt h ALA 328 N 0.86 0.85 -0.34 3.60 0.00 -1.24 0.31 119.26 123.31 2nqt h ALA 328 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nqt h ALA 328 Cb 0.63 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2nqt h ALA 328 CO 0.04 0.09 0.21 0.00 0.00 0.00 0.00 179.25 179.59 2nqt h ALA 329 N 1.31 0.43 -0.32 0.00 0.00 -0.94 -0.90 119.26 118.85 2nqt h ALA 329 Ca 0.28 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 2nqt h ALA 329 Cb 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2nqt h ALA 329 CO -0.14 -0.09 -0.48 0.28 0.00 0.00 0.00 179.25 178.82 2nqt h VAL 330 N 0.45 1.28 -0.34 0.00 2.07 -0.67 0.43 116.25 119.46 2nqt h VAL 330 Ca 0.12 -1.67 0.03 0.00 0.82 0.00 0.00 66.70 66.01 2nqt h VAL 330 Cb -0.02 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2nqt h VAL 330 CO -0.02 0.55 0.13 -0.61 0.02 0.00 0.00 177.57 177.64 2nqt h GLN 331 N 0.68 0.28 -0.53 1.57 4.15 -0.25 0.20 115.11 121.22 2nqt h GLN 331 Ca 0.03 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.33 2nqt h GLN 331 Cb 1.08 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 2nqt h GLN 331 CO 0.11 0.19 -0.08 0.77 -1.93 0.00 0.00 178.83 177.88 2nqt h SER 332 N 0.29 0.96 -0.55 -0.69 0.02 -1.08 -2.74 113.55 109.77 2nqt h SER 332 Ca 0.15 -0.30 0.05 0.00 -0.84 0.00 0.00 61.79 60.85 2nqt h SER 332 Cb 0.10 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.33 2nqt h SER 332 CO -0.14 1.07 0.27 -0.03 -1.14 0.00 0.00 176.83 176.86 2nqt h MET 333 N 0.87 0.51 -0.38 3.45 1.85 -0.52 0.31 114.93 121.01 2nqt h MET 333 Ca 0.14 -0.03 0.05 0.00 -0.61 0.00 0.00 59.70 59.25 2nqt h MET 333 Cb 0.63 -0.11 -0.04 0.00 0.43 0.00 0.00 31.60 32.50 2nqt h MET 333 CO 0.04 0.34 0.13 -0.91 -0.40 0.00 0.00 176.91 176.10 2nqt h ASN 334 N 0.52 0.12 -0.81 1.39 2.35 -0.73 -0.42 115.58 118.01 2nqt h ASN 334 Ca 0.25 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2nqt h ASN 334 Cb 0.17 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 2nqt h ASN 334 CO -0.18 0.10 0.50 -0.07 -1.65 0.00 0.00 177.43 176.14 2nqt h LEU 335 N 0.28 0.96 -1.09 1.61 3.38 -1.16 0.17 115.31 119.46 2nqt h LEU 335 Ca 0.18 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2nqt h LEU 335 Cb 0.17 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 2nqt h LEU 335 CO -0.19 0.73 0.62 0.00 0.09 0.00 0.00 178.44 179.68 2nqt h ALA 336 N 1.27 1.35 -0.01 1.53 0.00 -0.13 -2.51 119.26 120.77 2nqt h ALA 336 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2nqt h ALA 336 Cb -0.07 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.35 2nqt h ALA 336 CO -0.06 0.60 -0.29 1.28 0.00 0.00 0.00 179.25 180.79 2nqt n LEU 337 N -4.40 1.36 -0.22 0.00 4.77 -0.24 -3.21 117.00 115.06 2nqt n LEU 337 Ca 0.11 -0.42 -0.02 0.00 -0.03 0.00 0.00 56.01 55.64 2nqt n LEU 337 Cb 0.03 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.03 2nqt n LEU 337 CO 0.36 0.25 -0.03 0.61 -1.33 0.00 0.00 177.39 177.26 2nqt n GLY 338 N 1.35 0.47 3.93 -0.72 0.00 -0.65 -1.23 105.19 108.34 2nqt n GLY 338 Ca 0.12 -0.91 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 2nqt n GLY 338 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2nqt s TRP 339 N -2.10 3.48 0.13 1.61 0.51 -0.04 -4.83 118.94 117.70 2nqt s TRP 339 Ca 0.00 0.33 -0.35 0.00 -2.12 0.00 0.00 56.10 53.96 2nqt s TRP 339 Cb 0.00 -1.86 -0.16 0.00 -0.81 0.00 0.00 33.47 30.65 2nqt s TRP 339 CO 0.00 0.30 1.38 -2.30 -0.51 0.00 0.00 176.95 175.82 2nqt n PRO 340 N -1.07 1.47 0.02 4.98 -0.02 -1.26 -4.24 135.00 134.88 2nqt n PRO 340 Ca -0.05 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 62.04 2nqt n PRO 340 Cb 0.55 -2.18 0.50 0.00 -0.02 0.00 0.00 33.50 32.34 2nqt n PRO 340 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2nqt h GLU 341 N 4.70 0.38 -0.00 -0.52 4.81 -1.90 -1.75 114.58 120.30 2nqt h GLU 341 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2nqt h GLU 341 Cb 1.31 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2nqt h GLU 341 CO 0.79 0.25 -0.07 0.25 -0.73 0.00 0.00 179.01 179.50 2nqt n THR 342 N -4.48 0.00 -1.68 0.32 -2.24 -1.26 -4.69 114.28 100.25 2nqt n THR 342 Ca 0.04 -0.08 -0.45 0.00 -2.27 0.00 0.00 64.05 61.30 2nqt n THR 342 Cb 0.18 -0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 68.29 2nqt n THR 342 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2nqt n ASP 343 N -0.80 3.67 0.00 3.42 9.92 -0.66 -1.54 116.55 130.57 2nqt n ASP 343 Ca 0.17 1.00 0.00 0.00 -0.53 0.00 0.00 54.79 55.43 2nqt n ASP 343 Cb 0.26 -1.47 0.00 0.00 -0.64 0.00 0.00 41.12 39.27 2nqt n ASP 343 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2nqt n GLY 344 N 4.13 0.76 2.84 0.44 0.00 -1.26 -4.88 105.19 107.21 2nqt n GLY 344 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2nqt n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nqt s LEU 345 N 0.00 3.19 0.39 0.99 1.43 -0.59 -4.77 118.68 119.32 2nqt s LEU 345 Ca 0.00 -1.90 -0.21 0.00 -1.03 0.00 0.00 54.13 50.98 2nqt s LEU 345 Cb 0.00 -1.16 -0.10 0.00 0.03 0.00 0.00 46.19 44.96 2nqt s LEU 345 CO 0.00 -0.39 0.92 -0.55 0.23 0.00 0.00 176.35 176.56 2nqt s SER 346 N 1.26 7.02 0.00 2.29 0.15 -1.26 -4.84 113.70 118.32 2nqt s SER 346 Ca 0.11 1.67 0.26 0.00 0.70 0.00 0.00 55.95 58.69 2nqt s SER 346 Cb -0.18 -2.53 0.70 0.00 -1.71 0.00 0.00 66.02 62.30 2nqt s SER 346 CO -0.17 -0.26 1.53 1.33 1.20 0.00 0.00 173.24 176.87 2nqt n VAL 347 N -0.29 0.00 -3.35 4.45 0.24 -1.26 -0.48 118.33 117.64 2nqt n VAL 347 Ca 0.05 -0.23 -0.39 0.00 -2.04 0.00 0.00 64.34 61.74 2nqt n VAL 347 Cb 0.53 0.66 -0.08 0.00 -1.47 0.00 0.00 33.84 33.48 2nqt n VAL 347 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2nqt s VAL 348 N -2.27 5.16 0.70 3.34 1.01 -1.26 -4.69 120.40 122.39 2nqt s VAL 348 Ca 0.29 0.71 -0.11 0.00 0.00 0.00 0.00 61.98 62.87 2nqt s VAL 348 Cb 0.20 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.84 2nqt s VAL 348 CO 0.44 0.18 1.07 -0.83 0.00 0.00 0.00 175.10 175.96 2nqt s GLY 349 N 1.35 1.64 -0.72 4.51 0.00 -1.22 -4.29 107.32 108.59 2nqt s GLY 349 Ca 0.18 -0.17 -0.09 0.00 0.00 0.00 0.00 44.72 44.65 2nqt s GLY 349 CO 0.09 0.17 0.60 0.14 0.00 0.00 0.00 173.10 174.11 2nqt s VAL 350 N -3.21 4.71 0.13 1.40 1.01 0.46 -4.96 120.40 119.94 2nqt s VAL 350 Ca 0.58 -2.65 0.07 0.00 0.00 0.00 0.00 61.98 59.98 2nqt s VAL 350 Cb -0.12 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2nqt s VAL 350 CO 0.53 -0.95 -0.17 0.00 0.00 0.00 0.00 175.10 174.51 2nqt s ALA 351 N 0.12 1.75 -2.00 5.51 0.00 -1.26 -4.76 121.76 121.12 2nqt s ALA 351 Ca 0.17 -1.34 0.25 0.00 0.00 0.00 0.00 51.96 51.04 2nqt s ALA 351 Cb -0.16 -0.16 1.50 0.00 0.00 0.00 0.00 23.12 24.30 2nqt s ALA 351 CO -0.06 0.22 1.86 -0.35 0.00 0.00 0.00 175.76 177.43