#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 0.92 -0.04 -0.24 0.02 -1.26 -5.01 135.00 129.38 1nqt s PRO 7 Ca 0.00 1.11 -0.17 0.00 0.02 0.00 0.00 61.00 61.96 1nqt s PRO 7 Cb 0.00 -1.75 -0.05 0.00 0.02 0.00 0.00 34.50 32.72 1nqt s PRO 7 CO 0.00 -2.56 0.46 0.54 -0.33 0.00 0.00 177.00 175.11 1nqt s ASN 8 N -3.01 6.79 0.00 2.53 2.20 -1.26 -4.93 114.94 117.26 1nqt s ASN 8 Ca 0.65 0.94 0.00 0.00 -0.94 0.00 0.00 52.86 53.51 1nqt s ASN 8 Cb -0.21 -2.28 0.00 0.00 -2.00 0.00 0.00 41.25 36.76 1nqt s ASN 8 CO 0.59 0.17 0.00 2.22 -2.94 0.00 0.00 177.10 177.14 1nqt n PHE 9 N 2.65 0.00 0.02 1.54 1.16 -1.26 0.26 117.46 121.83 1nqt n PHE 9 Ca -0.10 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.35 1nqt n PHE 9 Cb 0.52 -0.48 -0.09 0.00 -1.61 0.00 0.00 39.48 37.82 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 -0.08 -0.89 2.97 3.57 -1.92 -1.43 116.94 119.17 1nqt h PHE 10 Ca 0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.56 1nqt h PHE 10 Cb 0.00 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 38.70 1nqt h PHE 10 CO 0.00 0.37 0.56 0.87 -2.23 0.00 0.00 178.31 177.88 1nqt h LYS 11 N -0.55 1.00 0.62 1.11 1.79 -0.58 -0.73 116.57 119.23 1nqt h LYS 11 Ca -0.01 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 1nqt h LYS 11 Cb 0.48 -0.22 -0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1nqt h LYS 11 CO 0.01 0.66 -0.40 0.52 -1.08 0.00 0.00 179.45 179.16 1nqt h MET 12 N 1.03 -0.92 -0.17 3.15 2.86 -1.43 0.12 114.93 119.56 1nqt h MET 12 Ca 0.38 0.06 0.05 0.00 -2.06 0.00 0.00 59.70 58.13 1nqt h MET 12 Cb 0.15 0.21 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 1nqt h MET 12 CO -0.16 -0.62 -0.18 0.28 1.06 0.00 0.00 176.91 177.29 1nqt h VAL 13 N -0.96 0.52 -0.70 -2.22 2.07 -1.07 0.20 116.25 114.10 1nqt h VAL 13 Ca -0.08 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 13 Cb 0.78 0.52 -0.10 0.00 -1.52 0.00 0.00 31.29 30.97 1nqt h VAL 13 CO 0.07 0.00 -0.54 -0.33 0.02 0.00 0.00 177.57 176.79 1nqt h GLU 14 N -0.21 -0.15 0.00 1.57 4.39 -1.08 0.52 114.58 119.63 1nqt h GLU 14 Ca 0.11 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1nqt h GLU 14 Cb 0.37 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1nqt h GLU 14 CO -0.29 -0.10 0.00 0.41 -1.16 0.00 0.00 179.01 177.87 1nqt n GLY 15 N -1.28 -3.06 0.22 -3.84 0.00 0.40 -0.54 105.19 97.09 1nqt n GLY 15 Ca -0.00 0.46 -0.00 0.00 0.00 0.00 0.00 46.02 46.47 1nqt n GLY 15 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nqt n PHE 16 N -2.30 0.03 -0.08 1.61 0.99 0.55 0.70 117.46 118.95 1nqt n PHE 16 Ca 0.00 0.70 -0.09 0.00 -0.00 0.00 0.00 57.45 58.06 1nqt n PHE 16 Cb 0.00 -0.72 -0.02 0.00 -1.00 0.00 0.00 39.48 37.74 1nqt n PHE 16 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.76 177.11 1nqt h PHE 17 N 0.00 0.38 0.00 1.38 3.57 0.12 -1.86 116.94 120.53 1nqt h PHE 17 Ca 0.20 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 1nqt h PHE 17 Cb 0.34 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1nqt h PHE 17 CO -0.50 0.29 -0.20 -0.44 -2.23 0.00 0.00 178.31 175.23 1nqt h ASP 18 N 0.36 0.00 0.07 0.41 3.32 0.29 0.34 116.42 121.21 1nqt h ASP 18 Ca 0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1nqt h ASP 18 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1nqt h ASP 18 CO -0.02 0.20 -0.03 -0.09 -1.72 0.00 0.00 179.24 177.58 1nqt h ARG 19 N 0.00 -0.09 -0.00 3.56 2.43 -0.45 -2.50 114.38 117.32 1nqt h ARG 19 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1nqt h ARG 19 Cb 0.38 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1nqt h ARG 19 CO 0.03 -0.06 0.06 0.78 -1.51 0.00 0.00 179.97 179.27 1nqt h GLY 20 N -0.11 0.00 0.36 2.80 0.00 -1.22 -2.03 103.07 102.88 1nqt h GLY 20 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1nqt h GLY 20 CO 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 176.54 176.38 1nqt h ALA 21 N 1.88 -0.95 -1.29 3.60 0.00 -0.26 -2.50 119.26 119.74 1nqt h ALA 21 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nqt h ALA 21 Cb 0.13 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1nqt h ALA 21 CO -0.00 -0.92 0.00 -1.13 0.00 0.00 0.00 179.25 177.20 1nqt n SER 22 N -3.52 0.00 -0.16 0.00 3.41 -0.81 -1.13 113.62 111.42 1nqt n SER 22 Ca -0.06 0.78 -0.04 0.00 -0.26 0.00 0.00 58.87 59.30 1nqt n SER 22 Cb 0.19 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.83 1nqt n SER 22 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1nqt n ILE 23 N -2.09 -0.26 0.00 -1.33 5.41 -0.94 -0.85 119.36 119.30 1nqt n ILE 23 Ca 0.00 0.93 0.00 0.00 1.00 0.00 0.00 62.75 64.68 1nqt n ILE 23 Cb 0.00 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 37.76 1nqt n ILE 23 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1nqt n VAL 24 N -4.50 0.00 0.00 1.39 0.31 -0.28 -4.14 118.33 111.11 1nqt n VAL 24 Ca 0.01 1.45 0.00 0.00 -0.01 0.00 0.00 64.34 65.79 1nqt n VAL 24 Cb 0.11 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 30.81 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 -2.25 0.00 0.00 5.55 2.13 -0.03 -0.80 120.64 125.25 1nqt n GLU 25 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1nqt n GLU 25 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 0.00 0.00 -0.32 4.31 8.00 -1.26 0.21 116.55 127.50 1nqt n ASP 26 Ca 0.00 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.65 1nqt n ASP 26 Cb 0.00 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.39 1nqt n ASP 26 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1nqt h LYS 27 N 0.00 0.07 0.00 -1.24 1.63 -1.16 0.24 116.57 116.11 1nqt h LYS 27 Ca 0.00 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1nqt h LYS 27 Cb 0.00 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 1nqt h LYS 27 CO 0.00 0.05 0.30 -0.11 -3.45 0.00 0.00 179.45 176.24 1nqt n LEU 28 N -5.38 0.32 -0.05 5.20 7.94 0.57 -2.81 117.00 122.78 1nqt n LEU 28 Ca 0.22 0.54 -0.10 0.00 -1.11 0.00 0.00 56.01 55.56 1nqt n LEU 28 Cb 0.74 -0.49 -0.03 0.00 0.53 0.00 0.00 43.42 44.16 1nqt n LEU 28 CO -0.01 -0.65 -0.66 0.52 -1.11 0.00 0.00 177.39 175.48 1nqt n VAL 29 N -2.01 1.25 0.00 1.96 0.31 0.84 -4.59 118.33 116.08 1nqt n VAL 29 Ca -0.01 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1nqt n VAL 29 Cb 0.32 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.30 1nqt n VAL 29 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1nqt n GLU 30 N -3.99 0.00 0.00 5.55 1.02 -1.12 -2.08 120.64 120.02 1nqt n GLU 30 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1nqt n GLU 30 Cb 0.47 -0.50 0.00 0.00 -0.02 0.00 0.00 31.44 31.40 1nqt n GLU 30 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1nqt n ASP 31 N 0.00 1.37 0.00 1.62 5.68 -1.24 -2.02 116.55 121.97 1nqt n ASP 31 Ca 0.00 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.36 1nqt n ASP 31 Cb 0.00 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.50 1nqt n ASP 31 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1nqt n LEU 32 N 0.12 0.00 -2.21 -2.12 7.94 -1.25 -4.93 117.00 114.56 1nqt n LEU 32 Ca 0.00 -0.33 -0.02 0.00 -1.11 0.00 0.00 56.01 54.55 1nqt n LEU 32 Cb 0.29 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.22 1nqt n LEU 32 CO 0.00 0.00 0.50 -2.11 -1.11 0.00 0.00 177.39 174.67 1nqt n ARG 33 N -0.82 0.00 -0.99 1.96 1.85 -0.88 -4.98 116.66 112.81 1nqt n ARG 33 Ca 0.00 -0.31 -0.06 0.00 -1.00 0.00 0.00 57.85 56.47 1nqt n ARG 33 Cb 0.00 0.00 0.17 0.00 -1.05 0.00 0.00 32.46 31.58 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 -0.31 2.51 -0.02 8.89 -1.04 -0.86 -4.43 114.28 119.02 1nqt n THR 34 Ca -0.20 -3.17 0.07 0.00 -2.04 0.00 0.00 64.05 58.72 1nqt n THR 34 Cb 0.57 -0.48 -0.14 0.00 -1.82 0.00 0.00 70.33 68.45 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 -1.05 0.64 -2.21 -2.82 3.00 -1.26 -4.43 116.66 108.53 1nqt n ARG 35 Ca 0.33 -0.15 -0.16 0.00 -0.01 0.00 0.00 57.85 57.86 1nqt n ARG 35 Cb 0.91 -1.44 0.03 0.00 0.00 0.00 0.00 32.46 31.96 1nqt n ARG 35 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1nqt n GLU 36 N -2.21 2.95 -1.97 5.56 -0.00 -1.26 -5.10 120.64 118.61 1nqt n GLU 36 Ca -0.07 -3.92 -0.42 0.00 -0.00 0.00 0.00 57.16 52.76 1nqt n GLU 36 Cb 0.56 -2.03 -0.02 0.00 -0.00 0.00 0.00 31.44 29.95 1nqt n GLU 36 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1nqt s SER 37 N -3.63 6.60 -0.31 -1.84 1.04 -1.26 -5.01 113.70 109.29 1nqt s SER 37 Ca 0.43 2.69 0.02 0.00 0.48 0.00 0.00 55.95 59.57 1nqt s SER 37 Cb 0.38 -2.62 0.09 0.00 0.10 0.00 0.00 66.02 63.97 1nqt s SER 37 CO 0.01 -0.76 0.02 -1.61 0.98 0.00 0.00 173.24 171.89 1nqt s GLU 38 N -0.03 1.45 -0.79 4.02 8.01 -1.26 -4.82 118.70 125.29 1nqt s GLU 38 Ca 0.62 -1.52 -0.02 0.00 0.01 0.00 0.00 54.97 54.06 1nqt s GLU 38 Cb -0.43 -2.84 0.02 0.00 -4.31 0.00 0.00 34.13 26.57 1nqt s GLU 38 CO 0.41 -0.85 0.10 0.39 0.01 0.00 0.00 175.26 175.32 1nqt n GLU 39 N 4.45 -2.62 -2.35 1.61 1.02 -1.26 -2.78 120.64 118.71 1nqt n GLU 39 Ca -0.02 0.38 -0.13 0.00 -0.02 0.00 0.00 57.16 57.37 1nqt n GLU 39 Cb 0.42 -4.97 -0.02 0.00 -0.02 0.00 0.00 31.44 26.85 1nqt n GLU 39 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1nqt n GLN 40 N -2.90 -1.18 -0.99 3.49 -0.06 -1.26 -4.57 117.38 109.92 1nqt n GLN 40 Ca -0.07 0.04 -0.03 0.00 -2.00 0.00 0.00 57.00 54.94 1nqt n GLN 40 Cb 0.56 -1.98 0.32 0.00 -4.06 0.00 0.00 30.24 25.09 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1nqt n LYS 41 N -1.72 3.92 0.10 3.69 5.02 -1.12 -3.47 118.16 124.59 1nqt n LYS 41 Ca 0.04 -3.11 0.11 0.00 -2.02 0.00 0.00 58.31 53.33 1nqt n LYS 41 Cb 0.20 -2.22 -0.00 0.00 -0.02 0.00 0.00 35.03 32.99 1nqt n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt h ARG 42 N 2.89 0.00 -0.43 1.97 2.47 -1.81 -3.12 114.38 116.36 1nqt h ARG 42 Ca 0.21 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.81 1nqt h ARG 42 Cb 2.24 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.55 1nqt h ARG 42 CO 0.68 0.01 -0.21 -0.97 0.56 0.00 0.00 179.97 180.04 1nqt h ASN 43 N 0.00 0.86 0.06 7.04 -1.24 -1.93 -2.12 115.58 118.25 1nqt h ASN 43 Ca -0.01 -0.31 -0.00 0.00 0.71 0.00 0.00 56.30 56.69 1nqt h ASN 43 Cb 1.02 -0.24 -0.00 0.00 0.73 0.00 0.00 38.32 39.83 1nqt h ASN 43 CO 0.00 1.05 -0.02 0.03 -1.29 0.00 0.00 177.43 177.20 1nqt h ARG 44 N 0.74 0.00 0.00 6.67 3.08 -1.79 -1.70 114.38 121.37 1nqt h ARG 44 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1nqt h ARG 44 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.79 1nqt h ARG 44 CO 0.06 0.02 0.00 1.55 -1.07 0.00 0.00 179.97 180.53 1nqt n VAL 45 N -3.80 0.00 1.11 2.04 3.14 -0.80 -2.69 118.33 117.34 1nqt n VAL 45 Ca -0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 1nqt n VAL 45 Cb 0.11 -0.30 0.01 0.00 -1.06 0.00 0.00 33.84 32.60 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 -0.56 1.11 0.05 1.45 1.85 -0.64 -2.21 116.66 117.71 1nqt n ARG 46 Ca 0.02 -0.09 -0.12 0.00 -1.00 0.00 0.00 57.85 56.65 1nqt n ARG 46 Cb 0.01 -1.44 -0.13 0.00 -1.05 0.00 0.00 32.46 29.85 1nqt n ARG 46 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 1nqt h GLY 47 N 5.14 0.16 -0.40 2.89 0.00 -1.78 -3.21 103.07 105.86 1nqt h GLY 47 Ca 0.00 -0.40 0.12 0.00 0.00 0.00 0.00 47.33 47.05 1nqt h GLY 47 CO 0.01 0.35 -0.27 -2.22 0.00 0.00 0.00 176.54 174.41 1nqt h ILE 48 N 0.04 0.22 0.00 2.60 1.08 -1.74 1.85 117.51 121.57 1nqt h ILE 48 Ca -0.17 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 1nqt h ILE 48 Cb 1.94 0.22 -0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1nqt h ILE 48 CO 0.14 0.00 -0.10 -0.07 -0.69 0.00 0.00 178.15 177.43 1nqt h LEU 49 N -0.10 0.00 -0.24 1.44 4.07 -1.78 0.26 115.31 118.95 1nqt h LEU 49 Ca 0.27 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.23 1nqt h LEU 49 Cb 0.53 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1nqt h LEU 49 CO -0.69 0.10 0.00 0.54 -1.08 0.00 0.00 178.44 177.31 1nqt n ARG 50 N -3.82 0.19 -0.11 1.13 1.74 0.60 -1.90 116.66 114.49 1nqt n ARG 50 Ca -0.02 0.26 -0.22 0.00 -0.77 0.00 0.00 57.85 57.11 1nqt n ARG 50 Cb 0.20 -1.77 -0.11 0.00 -1.02 0.00 0.00 32.46 29.76 1nqt n ARG 50 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1nqt n ILE 51 N -2.11 1.53 0.07 0.55 5.41 0.64 -4.19 119.36 121.27 1nqt n ILE 51 Ca 0.04 -0.04 0.19 0.00 1.00 0.00 0.00 62.75 63.94 1nqt n ILE 51 Cb 0.33 -2.05 0.72 0.00 -0.71 0.00 0.00 39.64 37.93 1nqt n ILE 51 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1nqt h ILE 52 N -1.00 0.67 0.95 1.39 2.04 -0.62 -3.18 117.51 117.75 1nqt h ILE 52 Ca -0.36 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1nqt h ILE 52 Cb 1.29 0.77 0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1nqt h ILE 52 CO -0.22 0.00 -0.46 0.50 0.00 0.00 0.00 178.15 177.98 1nqt h LYS 53 N 0.00 -1.23 -7.16 2.37 3.64 -1.55 -3.45 116.57 109.19 1nqt h LYS 53 Ca 0.19 0.08 -0.47 0.00 -1.27 0.00 0.00 60.65 59.19 1nqt h LYS 53 Cb 0.83 0.28 0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1nqt h LYS 53 CO -0.00 -0.82 0.36 -1.25 -2.27 0.00 0.00 179.45 175.47 1nqt s PRO 54 N -5.78 3.97 0.07 1.90 0.04 -1.20 -5.02 135.00 128.98 1nqt s PRO 54 Ca -0.19 0.95 -0.31 0.00 0.04 0.00 0.00 61.00 61.49 1nqt s PRO 54 Cb 0.02 -2.15 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1nqt s PRO 54 CO 0.56 -0.24 1.42 0.00 0.04 0.00 0.00 177.00 178.79 1nqt h ASN 56 N 7.32 0.00 -2.87 0.00 2.35 -0.96 -3.45 115.58 117.98 1nqt h ASN 56 Ca -0.41 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.23 1nqt h ASN 56 Cb 1.20 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 39.30 1nqt h ASN 56 CO 0.88 0.47 -0.34 -1.00 -1.65 0.00 0.00 177.43 175.79 1nqt s HIS 57 N -3.45 -0.69 -0.08 1.19 3.76 -1.08 -5.05 115.29 109.88 1nqt s HIS 57 Ca 0.01 1.39 0.02 0.00 -0.15 0.00 0.00 55.06 56.32 1nqt s HIS 57 Cb 0.11 0.27 0.02 0.00 1.11 0.00 0.00 32.58 34.08 1nqt s HIS 57 CO 0.71 -0.41 -0.11 0.54 -0.85 0.00 0.00 174.74 174.62 1nqt s VAL 58 N 2.03 1.15 -0.19 -0.90 0.11 -1.26 0.28 120.40 121.61 1nqt s VAL 58 Ca -0.05 -0.45 -0.04 0.00 -2.93 0.00 0.00 61.98 58.50 1nqt s VAL 58 Cb -0.10 -1.08 -0.02 0.00 -1.53 0.00 0.00 36.38 33.65 1nqt s VAL 58 CO -0.13 0.37 -0.02 -0.22 -3.33 0.00 0.00 175.10 171.77 1nqt s LEU 59 N 0.96 3.17 -0.08 2.54 2.96 -0.51 -5.02 118.68 122.71 1nqt s LEU 59 Ca -0.09 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.63 1nqt s LEU 59 Cb -0.15 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.73 1nqt s LEU 59 CO 0.00 0.07 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.50 1nqt s SER 60 N 0.95 3.78 0.15 3.68 0.01 -1.26 -2.20 113.70 118.80 1nqt s SER 60 Ca 0.01 -0.31 0.04 0.00 1.31 0.00 0.00 55.95 56.99 1nqt s SER 60 Cb -0.14 -1.08 -0.04 0.00 0.21 0.00 0.00 66.02 64.97 1nqt s SER 60 CO 0.01 0.27 -0.09 -0.76 0.41 0.00 0.00 173.24 173.08 1nqt s LEU 61 N -0.26 2.51 -0.25 2.44 1.43 0.54 -5.01 118.68 120.08 1nqt s LEU 61 Ca 0.01 -1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 52.05 1nqt s LEU 61 Cb -0.13 -0.31 0.09 0.00 0.03 0.00 0.00 46.19 45.86 1nqt s LEU 61 CO 0.03 -0.35 0.11 -0.94 0.23 0.00 0.00 176.35 175.43 1nqt s SER 62 N -3.16 3.19 -0.04 2.29 1.04 -1.26 -1.89 113.70 113.88 1nqt s SER 62 Ca 0.17 -1.09 0.04 0.00 0.48 0.00 0.00 55.95 55.54 1nqt s SER 62 Cb 0.03 -0.36 -0.00 0.00 0.10 0.00 0.00 66.02 65.79 1nqt s SER 62 CO 0.00 -0.41 -0.14 0.72 0.98 0.00 0.00 173.24 174.40 1nqt s PHE 63 N 2.07 1.41 0.71 5.02 -0.12 -0.44 -4.94 117.98 121.70 1nqt s PHE 63 Ca 0.07 -0.38 -0.11 0.00 -0.05 0.00 0.00 56.93 56.45 1nqt s PHE 63 Cb -0.16 -0.96 0.02 0.00 -0.63 0.00 0.00 43.02 41.28 1nqt s PHE 63 CO -0.27 -0.13 1.10 -1.25 -0.05 0.00 0.00 175.22 174.61 1nqt s PRO 64 N 0.08 2.83 0.09 1.99 0.04 -1.26 -1.93 135.00 136.84 1nqt s PRO 64 Ca -0.03 0.44 -0.15 0.00 0.04 0.00 0.00 61.00 61.30 1nqt s PRO 64 Cb -0.10 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1nqt s PRO 64 CO 0.01 -1.05 0.35 0.96 0.04 0.00 0.00 177.00 177.31 1nqt s ILE 65 N -3.36 0.08 -0.36 0.56 -4.36 -0.76 -4.91 121.20 108.09 1nqt s ILE 65 Ca 0.58 -0.69 -0.09 0.00 -0.26 0.00 0.00 60.65 60.19 1nqt s ILE 65 Cb -0.11 -1.13 0.03 0.00 1.25 0.00 0.00 42.46 42.51 1nqt s ILE 65 CO 0.52 -0.38 0.16 -0.60 0.24 0.00 0.00 174.94 174.88 1nqt s ARG 66 N -3.39 2.76 0.71 0.37 3.52 -1.26 -1.94 118.95 119.71 1nqt s ARG 66 Ca 0.01 -1.11 -0.15 0.00 -0.13 0.00 0.00 55.73 54.34 1nqt s ARG 66 Cb 0.02 -3.62 0.03 0.00 -1.56 0.00 0.00 34.95 29.81 1nqt s ARG 66 CO -0.09 -0.68 1.19 1.03 -0.81 0.00 0.00 175.30 175.94 1nqt s ARG 67 N 1.50 2.32 0.09 5.12 0.52 -0.56 -4.84 118.95 123.10 1nqt s ARG 67 Ca 0.01 1.69 -0.18 0.00 -0.52 0.00 0.00 55.73 56.73 1nqt s ARG 67 Cb -0.19 -1.86 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 1nqt s ARG 67 CO 0.05 -1.68 1.22 -0.25 0.02 0.00 0.00 175.30 174.66 1nqt n ASP 68 N -2.59 -0.61 -0.29 0.23 9.92 -1.26 -0.01 116.55 121.94 1nqt n ASP 68 Ca 0.13 1.36 0.20 0.00 -0.53 0.00 0.00 54.79 55.95 1nqt n ASP 68 Cb 0.51 -0.30 0.38 0.00 -0.64 0.00 0.00 41.12 41.06 1nqt n ASP 68 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1nqt n ASP 69 N -4.31 0.09 0.00 -2.24 5.68 -1.26 -4.70 116.55 109.81 1nqt n ASP 69 Ca 0.01 1.46 0.00 0.00 -0.50 0.00 0.00 54.79 55.76 1nqt n ASP 69 Cb 0.15 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.51 1nqt n ASP 69 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nqt n GLY 70 N -1.34 1.08 3.76 6.12 0.00 0.98 -5.12 105.19 110.67 1nqt n GLY 70 Ca 0.26 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 1nqt n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nqt s SER 71 N -0.58 7.46 0.41 1.61 1.04 -1.26 -4.73 113.70 117.66 1nqt s SER 71 Ca 0.00 2.00 -0.16 0.00 0.48 0.00 0.00 55.95 58.26 1nqt s SER 71 Cb 0.00 -2.61 -0.09 0.00 0.10 0.00 0.00 66.02 63.43 1nqt s SER 71 CO 0.00 0.02 0.86 0.26 0.98 0.00 0.00 173.24 175.36 1nqt s TRP 72 N -1.29 3.39 -0.11 5.02 0.51 -1.26 -1.50 118.94 123.69 1nqt s TRP 72 Ca 0.44 1.36 -0.10 0.00 -2.12 0.00 0.00 56.10 55.68 1nqt s TRP 72 Cb -0.26 -2.67 0.03 0.00 -0.81 0.00 0.00 33.47 29.76 1nqt s TRP 72 CO 0.32 -0.10 0.29 -2.00 -0.51 0.00 0.00 176.95 174.94 1nqt s GLU 73 N -3.44 0.33 -0.46 4.98 2.12 -0.82 -4.92 118.70 116.50 1nqt s GLU 73 Ca 0.57 0.41 0.00 0.00 0.36 0.00 0.00 54.97 56.31 1nqt s GLU 73 Cb -0.10 0.15 0.12 0.00 0.26 0.00 0.00 34.13 34.57 1nqt s GLU 73 CO 0.22 -0.05 0.22 0.14 -0.54 0.00 0.00 175.26 175.26 1nqt s VAL 74 N 0.20 2.98 0.23 3.70 -7.23 -1.26 -1.82 120.40 117.20 1nqt s VAL 74 Ca -0.00 -2.57 -0.31 0.00 -1.81 0.00 0.00 61.98 57.28 1nqt s VAL 74 Cb -0.02 -3.05 -0.11 0.00 0.56 0.00 0.00 36.38 33.75 1nqt s VAL 74 CO -0.00 -0.73 1.59 -0.63 -0.31 0.00 0.00 175.10 175.02 1nqt s ILE 75 N 0.54 2.32 0.08 -0.62 1.01 -0.81 -4.70 121.20 119.03 1nqt s ILE 75 Ca 0.13 0.25 0.05 0.00 0.00 0.00 0.00 60.65 61.08 1nqt s ILE 75 Cb -0.22 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 1nqt s ILE 75 CO -0.04 0.03 -0.03 -1.83 0.00 0.00 0.00 174.94 173.07 1nqt s GLU 76 N 0.34 2.44 0.13 2.79 -1.05 -1.26 -1.32 118.70 120.78 1nqt s GLU 76 Ca 0.67 -0.87 -0.25 0.00 -0.15 0.00 0.00 54.97 54.36 1nqt s GLU 76 Cb -0.46 -2.48 0.07 0.00 -0.44 0.00 0.00 34.13 30.82 1nqt s GLU 76 CO 0.39 0.54 0.95 0.20 0.95 0.00 0.00 175.26 178.29 1nqt s GLY 77 N -2.20 -0.27 -0.02 -3.83 0.00 -0.79 -0.85 107.32 99.36 1nqt s GLY 77 Ca 0.24 0.24 -0.23 0.00 0.00 0.00 0.00 44.72 44.97 1nqt s GLY 77 CO 0.16 0.05 0.50 -0.19 0.00 0.00 0.00 173.10 173.62 1nqt s TYR 78 N -3.26 -0.42 -0.03 1.90 1.51 0.19 -0.34 117.35 116.90 1nqt s TYR 78 Ca 0.11 0.64 0.01 0.00 -1.01 0.00 0.00 57.07 56.82 1nqt s TYR 78 Cb -0.01 0.27 0.03 0.00 -0.11 0.00 0.00 41.96 42.13 1nqt s TYR 78 CO 0.01 -0.53 -0.00 0.50 -1.11 0.00 0.00 175.55 174.41 1nqt s ARG 79 N -1.52 0.35 -0.09 -0.62 3.52 -0.94 0.20 118.95 119.86 1nqt s ARG 79 Ca -0.11 0.05 0.04 0.00 -0.13 0.00 0.00 55.73 55.59 1nqt s ARG 79 Cb -0.02 -0.51 -0.00 0.00 -1.56 0.00 0.00 34.95 32.85 1nqt s ARG 79 CO 0.05 -0.13 -0.23 0.00 -0.81 0.00 0.00 175.30 174.18 1nqt s ALA 80 N 0.99 2.20 -0.35 6.12 0.00 0.18 -1.43 121.76 129.48 1nqt s ALA 80 Ca -0.10 -0.98 -0.07 0.00 0.00 0.00 0.00 51.96 50.80 1nqt s ALA 80 Cb -0.14 -0.80 0.04 0.00 0.00 0.00 0.00 23.12 22.22 1nqt s ALA 80 CO -0.01 0.32 0.12 -0.65 0.00 0.00 0.00 175.76 175.54 1nqt s GLN 81 N 0.21 2.65 0.00 0.00 -0.21 0.14 -0.68 119.66 121.77 1nqt s GLN 81 Ca -0.15 -1.16 0.00 0.00 0.02 0.00 0.00 55.36 54.07 1nqt s GLN 81 Cb -0.17 -3.51 0.00 0.00 1.00 0.00 0.00 33.01 30.33 1nqt s GLN 81 CO 0.07 -0.67 0.52 1.58 -2.12 0.00 0.00 175.29 174.67 1nqt n HIS 82 N 4.84 0.00 -5.02 0.91 -0.00 0.16 -2.64 115.22 113.47 1nqt n HIS 82 Ca -0.12 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.32 1nqt n HIS 82 Cb 0.45 -0.43 -0.15 0.00 -0.00 0.00 0.00 29.99 29.85 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 -2.32 2.54 -0.27 0.26 0.15 -1.24 -1.14 113.70 111.69 1nqt s SER 83 Ca 0.00 -0.41 0.12 0.00 0.70 0.00 0.00 55.95 56.36 1nqt s SER 83 Cb 0.00 -0.27 0.60 0.00 -1.71 0.00 0.00 66.02 64.63 1nqt s SER 83 CO 0.00 0.26 1.57 1.41 1.20 0.00 0.00 173.24 177.68 1nqt n HIS 84 N 2.46 1.54 -0.00 3.44 -0.00 -1.26 -3.75 115.22 117.64 1nqt n HIS 84 Ca -0.16 -1.22 0.07 0.00 -0.00 0.00 0.00 57.72 56.42 1nqt n HIS 84 Cb 0.53 -0.51 0.48 0.00 -0.00 0.00 0.00 29.99 30.49 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 1.81 0.42 -4.77 -0.41 3.07 -1.95 -3.31 115.11 109.98 1nqt h GLN 85 Ca 0.17 -0.03 -0.66 0.00 0.09 0.00 0.00 58.65 58.22 1nqt h GLN 85 Cb 1.84 -0.10 -0.39 0.00 0.08 0.00 0.00 27.48 28.92 1nqt h GLN 85 CO 0.46 0.28 -0.76 0.50 0.09 0.00 0.00 178.83 179.41 1nqt s ARG 86 N -5.40 1.84 0.06 0.06 6.06 -1.26 -4.98 118.95 115.33 1nqt s ARG 86 Ca -0.08 -1.62 -0.07 0.00 -2.50 0.00 0.00 55.73 51.46 1nqt s ARG 86 Cb 0.18 -3.05 0.03 0.00 0.06 0.00 0.00 34.95 32.16 1nqt s ARG 86 CO 0.73 -0.76 0.46 2.41 -2.50 0.00 0.00 175.30 175.64 1nqt n THR 87 N 4.34 -0.18 -2.95 4.11 -1.04 -1.25 -2.80 114.28 114.51 1nqt n THR 87 Ca -0.05 0.71 -0.41 0.00 -2.04 0.00 0.00 64.05 62.26 1nqt n THR 87 Cb 0.42 -0.91 -0.05 0.00 -1.82 0.00 0.00 70.33 67.97 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 -5.22 4.20 0.27 -2.82 0.02 -1.25 -4.53 135.00 125.67 1nqt s PRO 88 Ca -0.04 0.86 -0.28 0.00 0.02 0.00 0.00 61.00 61.57 1nqt s PRO 88 Cb 0.05 -3.62 -0.09 0.00 0.02 0.00 0.00 34.50 30.85 1nqt s PRO 88 CO 0.20 -0.43 0.92 0.00 -0.33 0.00 0.00 177.00 177.36 1nqt s LYS 90 N -1.56 1.40 0.00 0.00 2.47 0.13 0.47 119.74 122.65 1nqt s LYS 90 Ca 0.44 -1.39 0.00 0.00 -1.56 0.00 0.00 55.97 53.46 1nqt s LYS 90 Cb -0.22 -1.76 0.00 0.00 -1.46 0.00 0.00 37.83 34.38 1nqt s LYS 90 CO 0.28 0.40 0.00 0.41 0.16 0.00 0.00 175.35 176.60 1nqt n GLY 91 N 0.64 3.52 3.11 5.54 0.00 -1.17 -1.28 105.19 115.55 1nqt n GLY 91 Ca -0.16 -0.62 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 1nqt n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nqt n GLY 92 N -1.02 -0.89 3.18 -0.02 0.00 -1.25 -1.99 105.19 103.20 1nqt n GLY 92 Ca 0.00 -1.78 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 1nqt n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 93 N -3.11 1.53 -0.21 -0.61 1.01 0.25 -0.91 121.20 119.15 1nqt s ILE 93 Ca 0.59 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 60.44 1nqt s ILE 93 Cb -0.02 -1.29 0.05 0.00 0.01 0.00 0.00 42.46 41.21 1nqt s ILE 93 CO 0.41 0.44 -0.06 -0.60 0.00 0.00 0.00 174.94 175.12 1nqt s ARG 94 N -0.24 1.64 -0.59 2.79 3.52 -0.65 -3.19 118.95 122.23 1nqt s ARG 94 Ca 0.02 -0.83 -0.22 0.00 -0.13 0.00 0.00 55.73 54.58 1nqt s ARG 94 Cb -0.10 -2.40 0.06 0.00 -1.56 0.00 0.00 34.95 30.96 1nqt s ARG 94 CO 0.01 -0.52 0.87 0.71 -0.81 0.00 0.00 175.30 175.55 1nqt s TYR 95 N 1.47 2.81 -0.16 5.12 4.12 -1.26 -1.73 117.35 127.72 1nqt s TYR 95 Ca -0.03 -0.45 -0.28 0.00 0.02 0.00 0.00 57.07 56.33 1nqt s TYR 95 Cb -0.17 -4.06 0.09 0.00 -1.52 0.00 0.00 41.96 36.29 1nqt s TYR 95 CO -0.07 -1.42 0.80 0.45 0.02 0.00 0.00 175.55 175.34 1nqt s SER 96 N 3.26 -0.60 0.65 2.29 0.15 -0.23 -4.62 113.70 114.61 1nqt s SER 96 Ca 0.22 0.87 0.42 0.00 0.70 0.00 0.00 55.95 58.16 1nqt s SER 96 Cb -0.17 0.79 2.24 0.00 -1.71 0.00 0.00 66.02 67.17 1nqt s SER 96 CO 0.13 -0.40 2.31 0.74 1.20 0.00 0.00 173.24 177.22 1nqt h THR 97 N 3.27 0.05 -0.95 6.45 2.02 -1.78 -2.99 112.91 118.96 1nqt h THR 97 Ca -0.26 -0.09 -0.64 0.00 0.77 0.00 0.00 66.41 66.19 1nqt h THR 97 Cb 1.15 1.08 -0.28 0.00 -1.74 0.00 0.00 68.15 68.37 1nqt h THR 97 CO 0.24 0.00 0.83 0.47 0.37 0.00 0.00 175.52 177.44 1nqt n ASP 98 N -3.14 7.41 -4.86 4.18 10.43 -1.26 -4.85 116.55 124.46 1nqt n ASP 98 Ca -0.02 -3.72 -0.29 0.00 2.57 0.00 0.00 54.79 53.33 1nqt n ASP 98 Cb 0.11 -0.98 -0.05 0.00 1.84 0.00 0.00 41.12 42.04 1nqt n ASP 98 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 1nqt s VAL 99 N -4.53 4.95 -0.16 2.53 -7.23 -1.13 -5.08 120.40 109.75 1nqt s VAL 99 Ca 0.62 -0.70 -0.13 0.00 -1.81 0.00 0.00 61.98 59.96 1nqt s VAL 99 Cb 0.49 -3.46 0.05 0.00 0.56 0.00 0.00 36.38 34.01 1nqt s VAL 99 CO -0.00 0.03 0.42 -0.94 -0.31 0.00 0.00 175.10 174.30 1nqt s SER 100 N -2.76 -0.47 0.64 4.85 1.04 -1.26 -4.93 113.70 110.81 1nqt s SER 100 Ca 0.32 0.87 0.22 0.00 0.48 0.00 0.00 55.95 57.85 1nqt s SER 100 Cb -0.12 0.84 1.14 0.00 0.10 0.00 0.00 66.02 67.98 1nqt s SER 100 CO 0.26 -0.16 1.63 0.58 0.98 0.00 0.00 173.24 176.52 1nqt h VAL 101 N 4.83 0.07 0.07 5.02 2.07 -1.98 0.94 116.25 127.27 1nqt h VAL 101 Ca -0.30 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 66.96 1nqt h VAL 101 Cb 1.18 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1nqt h VAL 101 CO 0.26 0.00 -1.24 0.44 0.02 0.00 0.00 177.57 177.05 1nqt h ASP 102 N 0.00 0.23 0.38 0.57 3.32 -1.99 -2.87 116.42 116.06 1nqt h ASP 102 Ca 0.09 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 1nqt h ASP 102 Cb 1.32 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1nqt h ASP 102 CO -0.00 1.21 -0.18 -0.08 -1.72 0.00 0.00 179.24 178.47 1nqt h GLU 103 N 0.04 -0.49 -1.05 3.56 4.81 0.50 -2.11 114.58 119.84 1nqt h GLU 103 Ca -0.12 0.03 0.27 0.00 -0.13 0.00 0.00 59.36 59.42 1nqt h GLU 103 Cb 1.91 0.11 -0.09 0.00 0.63 0.00 0.00 28.75 31.31 1nqt h GLU 103 CO 0.16 -0.33 0.68 -0.39 -0.73 0.00 0.00 179.01 178.40 1nqt h VAL 104 N -0.65 0.51 -0.21 0.32 -1.51 -1.56 0.73 116.25 113.89 1nqt h VAL 104 Ca -0.05 -0.13 -0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1nqt h VAL 104 Cb 0.39 0.11 -0.01 0.00 -2.13 0.00 0.00 31.29 29.66 1nqt h VAL 104 CO 0.09 0.07 0.12 0.50 -1.23 0.00 0.00 177.57 177.12 1nqt h LYS 105 N 0.37 0.29 0.37 5.19 3.64 -1.43 0.80 116.57 125.80 1nqt h LYS 105 Ca 0.59 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.93 1nqt h LYS 105 Cb 1.55 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.29 1nqt h LYS 105 CO -0.28 0.25 -0.40 0.00 -2.27 0.00 0.00 179.45 176.75 1nqt h ALA 106 N 1.02 -1.05 -0.09 5.00 0.00 0.11 -1.12 119.26 123.14 1nqt h ALA 106 Ca 0.08 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1nqt h ALA 106 Cb 0.04 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1nqt h ALA 106 CO -0.01 -1.09 0.07 -0.07 0.00 0.00 0.00 179.25 178.15 1nqt h LEU 107 N -0.78 0.00 -0.15 0.00 -0.00 -1.12 0.76 115.31 114.02 1nqt h LEU 107 Ca -0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.79 1nqt h LEU 107 Cb 0.68 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.34 1nqt h LEU 107 CO -0.07 0.00 -0.06 0.00 -0.00 0.00 0.00 178.44 178.31 1nqt h ALA 108 N 1.95 0.21 -0.37 1.53 0.00 -0.44 -2.45 119.26 119.69 1nqt h ALA 108 Ca 0.04 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1nqt h ALA 108 Cb 0.18 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.83 1nqt h ALA 108 CO -0.00 -0.00 -0.35 1.03 0.00 0.00 0.00 179.25 179.93 1nqt h SER 109 N -0.01 -1.14 -0.77 0.00 0.87 0.26 -1.09 113.55 111.67 1nqt h SER 109 Ca 0.04 0.19 0.12 0.00 -1.23 0.00 0.00 61.79 60.90 1nqt h SER 109 Cb 0.52 0.52 -0.08 0.00 -0.44 0.00 0.00 62.40 62.92 1nqt h SER 109 CO 0.02 -0.34 0.38 0.25 -0.53 0.00 0.00 176.83 176.61 1nqt h LEU 110 N -0.29 0.47 0.35 2.23 5.85 -0.83 -2.81 115.31 120.28 1nqt h LEU 110 Ca 0.16 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1nqt h LEU 110 Cb 0.55 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 1nqt h LEU 110 CO -0.52 0.24 -0.21 0.24 -0.34 0.00 0.00 178.44 177.85 1nqt h MET 111 N 0.60 -0.51 -0.99 1.25 2.86 -0.72 -0.02 114.93 117.41 1nqt h MET 111 Ca 0.40 0.03 0.30 0.00 -2.06 0.00 0.00 59.70 58.37 1nqt h MET 111 Cb 0.49 0.12 -0.14 0.00 0.06 0.00 0.00 31.60 32.13 1nqt h MET 111 CO -0.32 -0.34 0.53 0.00 1.06 0.00 0.00 176.91 177.85 1nqt h THR 112 N -0.53 0.35 0.00 2.22 1.03 -1.16 0.15 112.91 114.97 1nqt h THR 112 Ca -0.04 -0.12 -0.16 0.00 -0.01 0.00 0.00 66.41 66.08 1nqt h THR 112 Cb 0.43 -0.04 0.01 0.00 -1.07 0.00 0.00 68.15 67.48 1nqt h THR 112 CO 0.05 0.07 -0.63 1.88 -0.01 0.00 0.00 175.52 176.88 1nqt h TYR 113 N 0.36 0.63 -0.26 0.00 0.05 -1.47 -3.08 116.97 113.21 1nqt h TYR 113 Ca 0.69 -0.34 0.04 0.00 0.05 0.00 0.00 58.73 59.17 1nqt h TYR 113 Cb 1.51 -0.07 -0.04 0.00 1.01 0.00 0.00 36.73 39.14 1nqt h TYR 113 CO -0.04 1.16 0.03 -0.22 -1.05 0.00 0.00 178.16 178.05 1nqt h LYS 114 N -0.08 0.12 0.20 4.88 3.64 0.11 -1.56 116.57 123.88 1nqt h LYS 114 Ca -0.08 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1nqt h LYS 114 Cb 1.34 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1nqt h LYS 114 CO 0.12 0.08 -0.23 0.00 -2.27 0.00 0.00 179.45 177.15 1nqt h ALA 116 N 0.23 1.27 0.14 0.00 0.00 -1.35 0.91 119.26 120.46 1nqt h ALA 116 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1nqt h ALA 116 Cb 0.46 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 1nqt h ALA 116 CO -0.07 -0.46 -0.52 0.28 0.00 0.00 0.00 179.25 178.47 1nqt h VAL 117 N 0.21 0.00 -0.11 0.00 2.07 -0.22 -2.34 116.25 115.86 1nqt h VAL 117 Ca 0.55 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.07 1nqt h VAL 117 Cb 1.11 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1nqt h VAL 117 CO -0.65 0.00 0.00 1.33 0.02 0.00 0.00 177.57 178.27 1nqt n VAL 118 N -5.44 0.46 -4.05 2.57 0.24 0.12 -4.80 118.33 107.43 1nqt n VAL 118 Ca -0.09 -0.25 -0.31 0.00 -2.04 0.00 0.00 64.34 61.65 1nqt n VAL 118 Cb 0.41 -0.37 -0.01 0.00 -1.47 0.00 0.00 33.84 32.41 1nqt n VAL 118 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1nqt n ASP 119 N 0.08 -2.95 -4.49 -1.34 8.00 -0.08 -4.95 116.55 110.82 1nqt n ASP 119 Ca 0.05 -0.93 -0.40 0.00 0.71 0.00 0.00 54.79 54.22 1nqt n ASP 119 Cb 0.38 -3.22 -0.11 0.00 -0.02 0.00 0.00 41.12 38.15 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 -3.46 4.98 0.00 2.53 1.01 -0.91 -5.00 120.40 119.54 1nqt s VAL 120 Ca 0.52 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 1nqt s VAL 120 Cb -0.27 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.46 1nqt s VAL 120 CO 0.89 0.01 1.51 -0.81 0.00 0.00 0.00 175.10 176.69 1nqt n PRO 121 N 5.05 0.67 -4.33 2.72 -0.04 -1.26 -4.20 135.00 133.61 1nqt n PRO 121 Ca -0.13 -0.31 -0.20 0.00 -0.04 0.00 0.00 63.50 62.82 1nqt n PRO 121 Cb 0.49 -1.63 -0.11 0.00 -0.04 0.00 0.00 33.50 32.21 1nqt n PRO 121 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1nqt s PHE 122 N 2.16 1.73 0.10 0.54 2.99 -1.26 -4.49 117.98 119.76 1nqt s PHE 122 Ca 0.21 -0.52 -0.01 0.00 0.00 0.00 0.00 56.93 56.61 1nqt s PHE 122 Cb 0.10 -0.84 -0.04 0.00 0.00 0.00 0.00 43.02 42.24 1nqt s PHE 122 CO 0.00 0.33 0.27 0.20 -0.00 0.00 0.00 175.22 176.02 1nqt s GLY 123 N -2.96 2.11 0.39 4.36 0.00 -0.80 -4.78 107.32 105.64 1nqt s GLY 123 Ca 0.18 -0.80 -0.26 0.00 0.00 0.00 0.00 44.72 43.85 1nqt s GLY 123 CO 0.06 -0.77 1.19 -0.32 0.00 0.00 0.00 173.10 173.27 1nqt s GLY 124 N -2.63 2.90 -0.13 0.20 0.00 -1.25 0.19 107.32 106.60 1nqt s GLY 124 Ca 0.37 1.01 -0.30 0.00 0.00 0.00 0.00 44.72 45.79 1nqt s GLY 124 CO 0.27 1.55 0.92 0.00 0.00 0.00 0.00 173.10 175.84 1nqt s ALA 125 N -1.36 -1.89 -0.12 3.20 0.00 -0.40 0.40 121.76 121.59 1nqt s ALA 125 Ca 0.56 1.50 -0.21 0.00 0.00 0.00 0.00 51.96 53.80 1nqt s ALA 125 Cb -0.32 -0.50 0.05 0.00 0.00 0.00 0.00 23.12 22.35 1nqt s ALA 125 CO 0.41 -0.34 0.53 0.21 0.00 0.00 0.00 175.76 176.57 1nqt s LYS 126 N -1.22 0.76 0.28 0.00 2.47 0.14 -3.56 119.74 118.61 1nqt s LYS 126 Ca -0.04 0.42 0.10 0.00 -1.56 0.00 0.00 55.97 54.90 1nqt s LYS 126 Cb -0.00 0.36 -0.05 0.00 -1.46 0.00 0.00 37.83 36.67 1nqt s LYS 126 CO 0.03 -0.17 -0.15 0.00 0.16 0.00 0.00 175.35 175.22 1nqt s ALA 127 N -0.46 2.61 -0.17 3.13 0.00 -0.09 -0.64 121.76 126.14 1nqt s ALA 127 Ca -0.06 -1.88 -0.14 0.00 0.00 0.00 0.00 51.96 49.88 1nqt s ALA 127 Cb -0.03 -0.14 0.05 0.00 0.00 0.00 0.00 23.12 23.00 1nqt s ALA 127 CO 0.04 0.16 0.45 0.20 0.00 0.00 0.00 175.76 176.61 1nqt s GLY 128 N -3.49 -0.35 -0.20 0.00 0.00 0.53 -1.63 107.32 102.18 1nqt s GLY 128 Ca 0.29 1.37 0.00 0.00 0.00 0.00 0.00 44.72 46.38 1nqt s GLY 128 CO 0.13 1.27 -0.16 0.14 0.00 0.00 0.00 173.10 174.49 1nqt s VAL 129 N 0.54 2.33 -1.13 1.40 1.01 -0.70 0.54 120.40 124.39 1nqt s VAL 129 Ca -0.02 -0.93 -0.23 0.00 0.00 0.00 0.00 61.98 60.79 1nqt s VAL 129 Cb -0.04 -2.04 -0.08 0.00 0.00 0.00 0.00 36.38 34.21 1nqt s VAL 129 CO -0.03 0.45 1.94 -0.75 0.00 0.00 0.00 175.10 176.71 1nqt s LYS 130 N 1.31 2.47 -0.09 2.72 2.20 -0.03 -1.72 119.74 126.60 1nqt s LYS 130 Ca 0.04 -1.00 -0.21 0.00 -0.36 0.00 0.00 55.97 54.43 1nqt s LYS 130 Cb -0.14 -5.21 0.05 0.00 -1.51 0.00 0.00 37.83 31.02 1nqt s LYS 130 CO -0.10 -3.92 0.50 0.42 -0.36 0.00 0.00 175.35 171.89 1nqt s ILE 131 N 11.02 0.02 -0.41 5.43 1.09 -1.22 -4.57 121.20 132.56 1nqt s ILE 131 Ca 0.69 -0.16 -0.02 0.00 -1.10 0.00 0.00 60.65 60.07 1nqt s ILE 131 Cb -0.02 -0.78 0.11 0.00 -1.06 0.00 0.00 42.46 40.71 1nqt s ILE 131 CO 0.11 -0.09 0.19 0.21 -0.10 0.00 0.00 174.94 175.27 1nqt s ASN 132 N -0.71 5.18 0.60 3.58 3.84 -1.26 -1.06 114.94 125.11 1nqt s ASN 132 Ca -0.08 -2.09 0.27 0.00 0.21 0.00 0.00 52.86 51.18 1nqt s ASN 132 Cb -0.03 -1.80 1.04 0.00 -0.55 0.00 0.00 41.25 39.91 1nqt s ASN 132 CO 0.05 -0.51 1.42 -0.65 -2.79 0.00 0.00 177.10 174.62 1nqt h PRO 133 N 7.94 0.00 0.00 0.43 0.11 -1.93 0.79 132.00 139.35 1nqt h PRO 133 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1nqt h PRO 133 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1nqt h PRO 133 CO 0.67 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.33 1nqt h LYS 134 N 0.00 0.00 -0.73 1.05 1.79 -1.97 -3.03 116.57 113.69 1nqt h LYS 134 Ca 0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 1nqt h LYS 134 Cb 2.59 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 33.24 1nqt h LYS 134 CO -0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 1nqt n ASN 135 N -2.61 4.16 -4.14 0.86 4.13 0.28 -4.93 115.26 113.00 1nqt n ASN 135 Ca 0.04 -2.09 -0.15 0.00 1.68 0.00 0.00 54.58 54.05 1nqt n ASN 135 Cb 0.40 -0.51 -0.11 0.00 -1.54 0.00 0.00 39.78 38.01 1nqt n ASN 135 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1nqt s TYR 136 N -1.18 0.99 0.71 3.10 2.02 -1.15 -5.04 117.35 116.81 1nqt s TYR 136 Ca 0.50 -0.54 -0.11 0.00 -0.37 0.00 0.00 57.07 56.54 1nqt s TYR 136 Cb 0.27 -0.56 0.02 0.00 -0.40 0.00 0.00 41.96 41.29 1nqt s TYR 136 CO 0.32 -0.01 1.10 0.95 -1.57 0.00 0.00 175.55 176.34 1nqt s THR 137 N -1.73 3.43 0.06 -0.71 -4.23 -1.26 -4.79 115.64 106.41 1nqt s THR 137 Ca -0.02 0.46 -0.23 0.00 -1.18 0.00 0.00 61.69 60.73 1nqt s THR 137 Cb -0.07 -3.46 -0.10 0.00 1.34 0.00 0.00 72.50 70.21 1nqt s THR 137 CO 0.01 -0.61 1.36 0.44 -0.54 0.00 0.00 174.62 175.28 1nqt h ASP 138 N -0.67 -1.00 -0.77 3.99 5.19 -1.99 0.11 116.42 121.27 1nqt h ASP 138 Ca -0.45 0.10 0.12 0.00 -0.62 0.00 0.00 57.03 56.18 1nqt h ASP 138 Cb 1.26 0.36 -0.12 0.00 0.18 0.00 0.00 39.33 41.00 1nqt h ASP 138 CO 0.64 -0.39 -0.30 -3.20 -3.12 0.00 0.00 179.24 172.86 1nqt n ASN 139 N -4.42 -0.51 -0.03 6.45 4.05 -1.26 -0.13 115.26 119.42 1nqt n ASN 139 Ca -0.06 1.34 -0.10 0.00 0.45 0.00 0.00 54.58 56.21 1nqt n ASN 139 Cb 0.28 -0.30 -0.03 0.00 1.23 0.00 0.00 39.78 40.95 1nqt n ASN 139 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 177.26 173.88 1nqt h GLU 140 N 0.00 0.19 -0.23 1.20 5.08 -1.72 -1.77 114.58 117.34 1nqt h GLU 140 Ca 0.26 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.65 1nqt h GLU 140 Cb 0.46 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 1nqt h GLU 140 CO -0.76 0.12 -0.46 -0.07 -1.00 0.00 0.00 179.01 176.84 1nqt h LEU 141 N 0.19 -1.49 -0.68 1.33 3.38 0.21 0.18 115.31 118.43 1nqt h LEU 141 Ca 0.07 0.19 0.15 0.00 0.09 0.00 0.00 57.88 58.37 1nqt h LEU 141 Cb 0.01 0.60 -0.11 0.00 0.09 0.00 0.00 40.66 41.24 1nqt h LEU 141 CO -0.05 -0.37 0.01 -0.08 0.09 0.00 0.00 178.44 178.05 1nqt h GLU 142 N -0.41 0.12 -0.23 1.13 4.81 -1.12 0.20 114.58 119.08 1nqt h GLU 142 Ca 0.04 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1nqt h GLU 142 Cb 0.53 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 1nqt h GLU 142 CO -0.43 0.08 -0.17 0.87 -0.73 0.00 0.00 179.01 178.63 1nqt h LYS 143 N 0.12 -0.16 0.40 1.92 1.57 -0.29 0.15 116.57 120.28 1nqt h LYS 143 Ca 0.36 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.15 1nqt h LYS 143 Cb 0.61 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1nqt h LYS 143 CO -0.58 -0.11 -0.33 0.82 -0.57 0.00 0.00 179.45 178.68 1nqt h ILE 144 N -0.16 0.31 -0.80 1.86 2.04 0.17 -2.18 117.51 118.73 1nqt h ILE 144 Ca 0.13 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.09 1nqt h ILE 144 Cb 0.36 0.31 -0.07 0.00 -0.74 0.00 0.00 36.82 36.68 1nqt h ILE 144 CO -0.33 0.00 0.45 0.71 0.00 0.00 0.00 178.15 178.98 1nqt h THR 145 N -0.74 0.90 0.99 -0.27 1.35 -0.31 -0.03 112.91 114.80 1nqt h THR 145 Ca -0.03 -0.26 -0.05 0.00 -0.55 0.00 0.00 66.41 65.52 1nqt h THR 145 Cb 0.65 0.08 0.01 0.00 -1.73 0.00 0.00 68.15 67.15 1nqt h THR 145 CO -0.02 0.14 -0.48 0.03 -0.25 0.00 0.00 175.52 174.94 1nqt h ARG 146 N 0.75 -1.29 0.00 4.72 3.08 -0.44 0.96 114.38 122.17 1nqt h ARG 146 Ca 0.39 0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.53 1nqt h ARG 146 Cb 0.37 0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1nqt h ARG 146 CO -0.25 -0.86 0.18 -0.09 -1.07 0.00 0.00 179.97 177.88 1nqt h ARG 147 N -1.36 0.00 0.14 0.04 9.65 -1.21 0.53 114.38 122.17 1nqt h ARG 147 Ca -0.14 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.54 1nqt h ARG 147 Cb 1.02 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.63 1nqt h ARG 147 CO 0.22 0.00 -0.88 0.35 2.80 0.00 0.00 179.97 182.47 1nqt h PHE 148 N 0.00 0.62 -0.79 2.20 3.57 0.12 -3.23 116.94 119.43 1nqt h PHE 148 Ca 0.00 -0.44 0.08 0.00 3.53 0.00 0.00 57.97 61.14 1nqt h PHE 148 Cb 0.35 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 1nqt h PHE 148 CO 0.00 1.32 0.46 1.15 -2.23 0.00 0.00 178.31 179.02 1nqt h THR 149 N -0.26 0.96 0.80 4.41 2.02 0.25 -0.52 112.91 120.57 1nqt h THR 149 Ca -0.15 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 1nqt h THR 149 Cb 1.67 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1nqt h THR 149 CO 0.17 0.15 -0.49 0.24 0.37 0.00 0.00 175.52 175.95 1nqt h MET 150 N 0.81 -1.16 -0.89 6.66 2.86 -1.32 -0.03 114.93 121.87 1nqt h MET 150 Ca 0.36 0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 58.07 1nqt h MET 150 Cb 0.26 0.26 -0.04 0.00 0.06 0.00 0.00 31.60 32.14 1nqt h MET 150 CO -0.21 -0.78 0.48 0.93 1.06 0.00 0.00 176.91 178.40 1nqt h GLU 151 N -1.21 1.24 -0.81 1.72 4.39 -1.56 0.18 114.58 118.54 1nqt h GLU 151 Ca -0.11 -0.15 0.09 0.00 0.34 0.00 0.00 59.36 59.54 1nqt h GLU 151 Cb 0.97 -0.24 -0.07 0.00 -0.10 0.00 0.00 28.75 29.31 1nqt h GLU 151 CO 0.11 0.91 0.46 1.25 -1.16 0.00 0.00 179.01 180.57 1nqt h LEU 152 N 1.24 0.66 0.15 1.33 5.85 -0.94 -2.76 115.31 120.84 1nqt h LEU 152 Ca 0.31 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.07 1nqt h LEU 152 Cb 0.03 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1nqt h LEU 152 CO -0.05 0.38 -0.07 0.00 -0.34 0.00 0.00 178.44 178.36 1nqt h ALA 153 N 1.44 -0.20 0.00 1.25 0.00 -0.21 0.78 119.26 122.32 1nqt h ALA 153 Ca 0.39 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1nqt h ALA 153 Cb 0.34 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1nqt h ALA 153 CO -0.24 -0.31 0.42 0.87 0.00 0.00 0.00 179.25 179.99 1nqt h LYS 154 N -0.82 0.00 0.00 0.00 1.57 -0.51 0.07 116.57 116.89 1nqt h LYS 154 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1nqt h LYS 154 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1nqt h LYS 154 CO 0.03 0.00 -0.00 1.63 -0.57 0.00 0.00 179.45 180.54 1nqt n LYS 155 N -2.25 2.53 -1.10 3.15 4.76 -1.06 -5.03 118.16 119.17 1nqt n LYS 155 Ca -0.01 -1.45 0.00 0.00 -2.87 0.00 0.00 58.31 53.98 1nqt n LYS 155 Cb 0.44 -0.97 0.00 0.00 -1.84 0.00 0.00 35.03 32.66 1nqt n LYS 155 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nqt n GLY 156 N -0.50 0.80 1.93 0.72 0.00 0.01 -4.99 105.19 103.17 1nqt n GLY 156 Ca 0.01 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.88 2.21 -3.15 1.61 3.72 0.27 -4.78 117.46 114.45 1nqt n PHE 157 Ca 0.00 -2.09 0.06 0.00 -0.05 0.00 0.00 57.45 55.36 1nqt n PHE 157 Cb 0.22 -0.31 -0.00 0.00 -0.94 0.00 0.00 39.48 38.44 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 -4.27 -0.05 0.06 4.37 -1.16 -1.22 -4.64 121.20 114.30 1nqt s ILE 158 Ca 0.46 0.00 -0.26 0.00 -0.51 0.00 0.00 60.65 60.34 1nqt s ILE 158 Cb 0.39 -0.18 0.07 0.00 0.61 0.00 0.00 42.46 43.36 1nqt s ILE 158 CO 0.01 0.00 0.66 -0.83 -2.81 0.00 0.00 174.94 171.97 1nqt s GLY 159 N 2.99 -0.58 0.00 1.50 0.00 -0.62 -4.49 107.32 106.11 1nqt s GLY 159 Ca 0.27 0.87 0.24 0.00 0.00 0.00 0.00 44.72 46.09 1nqt s GLY 159 CO -0.20 0.48 1.84 -1.55 0.00 0.00 0.00 173.10 173.67 1nqt n PRO 160 N 0.12 0.89 0.00 2.90 -0.04 -1.26 -1.76 135.00 135.85 1nqt n PRO 160 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1nqt n PRO 160 Cb 0.62 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1nqt n PRO 160 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nqt n GLY 161 N 0.71 0.76 0.04 0.55 0.00 -1.26 -4.83 105.19 101.16 1nqt n GLY 161 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.58 0.45 -3.15 -0.61 5.41 -1.11 -3.94 119.36 115.83 1nqt n ILE 162 Ca 0.00 -0.23 0.05 0.00 1.00 0.00 0.00 62.75 63.57 1nqt n ILE 162 Cb 0.01 -0.81 -0.01 0.00 -0.71 0.00 0.00 39.64 38.12 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 -4.18 -0.58 -0.49 4.38 -1.08 -0.72 -2.16 116.67 111.85 1nqt s ASP 163 Ca -0.06 0.17 -0.17 0.00 -0.52 0.00 0.00 52.55 51.97 1nqt s ASP 163 Cb 0.02 1.41 0.07 0.00 -1.46 0.00 0.00 42.92 42.96 1nqt s ASP 163 CO 0.23 -0.11 0.48 -0.69 0.52 0.00 0.00 175.17 175.60 1nqt s VAL 164 N 2.94 5.11 0.91 1.11 1.01 0.18 -1.59 120.40 130.07 1nqt s VAL 164 Ca 0.16 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 61.11 1nqt s VAL 164 Cb -0.06 -4.19 0.23 0.00 0.00 0.00 0.00 36.38 32.36 1nqt s VAL 164 CO -0.19 -0.66 0.72 -2.65 0.00 0.00 0.00 175.10 172.32 1nqt n PRO 165 N 5.54 -2.94 -3.65 2.72 -0.02 -1.11 -3.07 135.00 132.48 1nqt n PRO 165 Ca -0.10 -1.17 -0.04 0.00 -2.02 0.00 0.00 63.50 60.16 1nqt n PRO 165 Cb 0.44 -1.20 -0.01 0.00 -0.02 0.00 0.00 33.50 32.71 1nqt n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nqt s ALA 166 N -2.75 -1.84 0.67 3.55 0.00 -0.84 -2.41 121.76 118.13 1nqt s ALA 166 Ca 0.49 0.61 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1nqt s ALA 166 Cb -0.06 0.46 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 1nqt s ALA 166 CO 0.39 -0.90 1.05 -2.14 0.00 0.00 0.00 175.76 174.15 1nqt s PRO 167 N -3.01 3.20 0.15 0.00 0.02 -1.26 0.85 135.00 134.96 1nqt s PRO 167 Ca 0.10 0.87 0.00 0.00 0.02 0.00 0.00 61.00 61.99 1nqt s PRO 167 Cb -0.00 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 1nqt s PRO 167 CO -0.03 -0.89 0.04 0.34 -0.33 0.00 0.00 177.00 176.13 1nqt s ASP 168 N -3.95 0.69 0.00 2.53 -1.08 -1.19 -4.57 116.67 109.09 1nqt s ASP 168 Ca 0.57 -1.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.40 1nqt s ASP 168 Cb -0.13 0.22 0.00 0.00 -1.46 0.00 0.00 42.92 41.55 1nqt s ASP 168 CO 0.55 -0.67 0.00 0.23 0.52 0.00 0.00 175.17 175.80 1nqt n MET 169 N -0.16 0.00 0.00 4.34 2.81 -1.26 0.68 117.12 123.53 1nqt n MET 169 Ca -0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.83 1nqt n MET 169 Cb 0.64 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.67 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 0.99 0.97 -4.41 7.83 3.41 -1.26 -5.08 113.62 116.07 1nqt n SER 170 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1nqt n SER 170 Cb 0.00 0.19 -0.10 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.39 2.17 0.00 6.66 -4.23 0.21 -4.73 115.64 115.33 1nqt s THR 171 Ca 0.00 -2.28 0.00 0.00 -1.18 0.00 0.00 61.69 58.23 1nqt s THR 171 Cb 0.00 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.67 1nqt s THR 171 CO 0.00 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 1nqt n GLY 172 N -0.42 6.47 0.17 3.99 0.00 -1.26 -3.78 105.19 110.36 1nqt n GLY 172 Ca -0.07 -1.72 -0.18 0.00 0.00 0.00 0.00 46.02 44.05 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 0.54 -0.20 1.61 4.11 -1.97 -2.77 114.58 115.91 1nqt h GLU 173 Ca 0.00 -0.55 0.02 0.00 0.07 0.00 0.00 59.36 58.91 1nqt h GLU 173 Cb 0.00 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1nqt h GLU 173 CO 0.00 1.17 -0.24 0.00 0.07 0.00 0.00 179.01 180.02 1nqt h ARG 174 N 0.13 -0.15 -0.51 1.06 3.08 -1.97 0.17 114.38 116.19 1nqt h ARG 174 Ca -0.08 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.07 1nqt h ARG 174 Cb 1.40 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.38 1nqt h ARG 174 CO 0.14 -0.10 -0.36 0.93 -1.07 0.00 0.00 179.97 179.51 1nqt h GLU 175 N -0.15 -0.21 -0.30 0.04 5.08 -1.96 -0.76 114.58 116.32 1nqt h GLU 175 Ca 0.03 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1nqt h GLU 175 Cb 0.24 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.46 1nqt h GLU 175 CO -0.27 -0.14 -0.46 0.52 -1.00 0.00 0.00 179.01 177.66 1nqt h MET 176 N -0.22 -0.40 -0.94 2.33 2.86 -1.05 -0.58 114.93 116.94 1nqt h MET 176 Ca 0.19 0.03 0.19 0.00 -2.06 0.00 0.00 59.70 58.05 1nqt h MET 176 Cb 0.56 0.09 -0.18 0.00 0.06 0.00 0.00 31.60 32.13 1nqt h MET 176 CO -0.63 -0.27 -0.22 0.45 1.06 0.00 0.00 176.91 177.31 1nqt n SER 177 N -5.42 -0.32 0.13 1.22 2.88 0.51 0.10 113.62 112.72 1nqt n SER 177 Ca -0.03 1.61 -0.14 0.00 -1.33 0.00 0.00 58.87 58.98 1nqt n SER 177 Cb 0.36 -0.49 -0.08 0.00 -0.75 0.00 0.00 64.21 63.25 1nqt n SER 177 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 1nqt h TRP 178 N 0.00 -0.24 -0.50 0.66 6.55 -0.56 0.27 115.95 122.14 1nqt h TRP 178 Ca 0.46 -0.01 0.10 0.00 0.95 0.00 0.00 58.89 60.39 1nqt h TRP 178 Cb 0.72 0.08 -0.09 0.00 -0.86 0.00 0.00 29.16 29.01 1nqt h TRP 178 CO -0.70 -0.14 -0.06 0.82 -1.05 0.00 0.00 178.44 177.30 1nqt h ILE 179 N -0.26 0.55 0.70 1.49 2.04 0.11 2.12 117.51 124.24 1nqt h ILE 179 Ca -0.03 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1nqt h ILE 179 Cb 0.20 0.49 0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1nqt h ILE 179 CO 0.04 0.01 -0.33 0.00 0.00 0.00 0.00 178.15 177.87 1nqt h ALA 180 N 1.47 -0.94 -0.18 1.87 0.00 -0.11 -2.33 119.26 119.06 1nqt h ALA 180 Ca 0.25 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1nqt h ALA 180 Cb 0.38 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1nqt h ALA 180 CO -0.47 -1.01 0.03 0.22 0.00 0.00 0.00 179.25 178.02 1nqt h ASP 181 N -0.97 0.22 0.11 0.00 1.82 0.18 -0.84 116.42 116.94 1nqt h ASP 181 Ca -0.10 -0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.52 1nqt h ASP 181 Cb 0.73 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.68 1nqt h ASP 181 CO 0.16 0.24 -0.05 0.74 -1.61 0.00 0.00 179.24 178.72 1nqt h THR 182 N 0.25 1.02 0.21 2.25 2.02 0.35 -2.68 112.91 116.33 1nqt h THR 182 Ca 0.06 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 1nqt h THR 182 Cb 0.13 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 1nqt h THR 182 CO -0.00 0.12 -0.36 0.22 0.37 0.00 0.00 175.52 175.87 1nqt h TYR 183 N -0.37 -1.02 -0.69 3.16 3.20 -1.05 -2.54 116.97 117.66 1nqt h TYR 183 Ca -0.01 0.02 0.20 0.00 3.14 0.00 0.00 58.73 62.07 1nqt h TYR 183 Cb 0.31 0.42 -0.03 0.00 1.54 0.00 0.00 36.73 38.96 1nqt h TYR 183 CO 0.00 -0.44 0.66 0.00 -1.64 0.00 0.00 178.16 176.74 1nqt h ALA 184 N -1.01 2.49 -0.45 1.82 0.00 -1.20 -1.19 119.26 119.73 1nqt h ALA 184 Ca -0.02 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.64 1nqt h ALA 184 Cb 0.56 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.27 1nqt h ALA 184 CO -0.12 -1.01 0.04 -1.13 0.00 0.00 0.00 179.25 177.02 1nqt n SER 185 N -3.77 2.75 0.00 0.00 3.41 -0.98 -3.62 113.62 111.41 1nqt n SER 185 Ca 0.14 -3.72 0.00 0.00 -0.26 0.00 0.00 58.87 55.03 1nqt n SER 185 Cb 0.91 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1nqt n SER 185 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1nqt n THR 186 N -1.09 0.00 -0.20 6.66 -1.04 -0.53 -4.93 114.28 113.15 1nqt n THR 186 Ca 0.37 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.39 1nqt n THR 186 Cb 1.13 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 69.75 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 0.55 -0.81 12.58 1.08 -1.81 -1.68 117.51 127.42 1nqt h ILE 187 Ca 0.00 -0.06 -0.44 0.00 -0.39 0.00 0.00 64.86 63.97 1nqt h ILE 187 Cb 0.00 0.36 -0.17 0.00 -3.07 0.00 0.00 36.82 33.95 1nqt h ILE 187 CO 0.00 0.03 0.43 0.61 -0.69 0.00 0.00 178.15 178.54 1nqt n GLY 188 N -1.34 4.34 0.24 5.37 0.00 -0.71 -4.50 105.19 108.59 1nqt n GLY 188 Ca 0.09 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 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 2.29 0.98 -0.00 1.61 6.17 -1.36 -3.28 115.15 121.55 1nqt h HIS 189 Ca 0.36 -0.34 0.00 0.00 0.71 0.00 0.00 60.37 61.10 1nqt h HIS 189 Cb 0.80 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 30.55 1nqt h HIS 189 CO 1.18 1.14 -0.42 0.66 0.71 0.00 0.00 177.93 181.20 1nqt n TYR 190 N -4.00 0.00 -2.51 5.26 4.02 -1.26 -4.84 117.16 113.83 1nqt n TYR 190 Ca -0.04 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.42 1nqt n TYR 190 Cb 0.61 -0.26 -0.02 0.00 -0.02 0.00 0.00 39.34 39.64 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 -2.95 6.89 0.00 7.72 3.68 -1.24 -4.87 116.67 125.90 1nqt s ASP 191 Ca 0.13 1.36 0.14 0.00 2.13 0.00 0.00 52.55 56.30 1nqt s ASP 191 Cb 0.18 -2.54 0.81 0.00 -1.45 0.00 0.00 42.92 39.92 1nqt s ASP 191 CO 0.66 -0.87 1.23 0.00 0.13 0.00 0.00 175.17 176.33 1nqt n ILE 192 N 5.72 0.00 -1.52 4.11 3.06 -1.26 -1.35 119.36 128.12 1nqt n ILE 192 Ca 0.13 0.00 0.05 0.00 -2.50 0.00 0.00 62.75 60.44 1nqt n ILE 192 Cb 0.46 -0.71 0.08 0.00 0.54 0.00 0.00 39.64 40.01 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 -0.94 1.29 0.12 9.51 3.02 -1.26 -4.83 115.26 122.17 1nqt n ASN 193 Ca 0.10 -2.62 0.20 0.00 -0.03 0.00 0.00 54.58 52.23 1nqt n ASN 193 Cb 0.05 -0.33 0.75 0.00 -0.61 0.00 0.00 39.78 39.64 1nqt n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nqt h ALA 194 N 0.05 2.01 -0.01 5.41 0.00 -1.51 0.23 119.26 125.44 1nqt h ALA 194 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nqt h ALA 194 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1nqt h ALA 194 CO 0.00 -0.61 0.00 0.72 0.00 0.00 0.00 179.25 179.36 1nqt n HIS 195 N -3.60 0.01 1.10 0.00 8.25 -1.26 -2.83 115.22 116.89 1nqt n HIS 195 Ca 0.06 -0.01 0.12 0.00 -0.26 0.00 0.00 57.72 57.64 1nqt n HIS 195 Cb 0.59 0.00 0.31 0.00 1.12 0.00 0.00 29.99 32.01 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 -0.53 3.35 -0.04 -1.41 0.00 0.81 -4.20 120.51 118.50 1nqt n ALA 196 Ca 0.21 -0.37 0.22 0.00 0.00 0.00 0.00 53.44 53.51 1nqt n ALA 196 Cb 0.20 -1.13 0.70 0.00 0.00 0.00 0.00 19.45 19.22 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 -4.99 0.08 0.51 0.00 0.11 -1.26 -2.73 120.40 112.13 1nqt s VAL 198 Ca -0.05 -0.69 0.04 0.00 -2.93 0.00 0.00 61.98 58.35 1nqt s VAL 198 Cb 0.20 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 34.66 1nqt s VAL 198 CO 0.73 -0.38 0.22 0.42 -3.33 0.00 0.00 175.10 172.77 1nqt s THR 199 N -1.32 1.55 -0.53 5.04 -4.23 -1.01 -4.76 115.64 110.38 1nqt s THR 199 Ca -0.14 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 58.64 1nqt s THR 199 Cb -0.08 -2.26 0.00 0.00 1.34 0.00 0.00 72.50 71.51 1nqt s THR 199 CO 0.01 0.00 0.24 0.61 -0.54 0.00 0.00 174.62 174.94 1nqt n GLY 200 N -1.51 0.28 3.85 3.99 0.00 -1.26 -4.43 105.19 106.11 1nqt n GLY 200 Ca -0.08 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 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 -5.00 2.81 0.61 1.61 -2.85 -1.26 -4.29 119.74 111.37 1nqt s LYS 201 Ca 0.12 -1.20 -0.19 0.00 -1.00 0.00 0.00 55.97 53.69 1nqt s LYS 201 Cb -0.05 -2.52 -0.03 0.00 -2.06 0.00 0.00 37.83 33.17 1nqt s LYS 201 CO 0.15 0.19 1.31 -2.14 0.10 0.00 0.00 175.35 174.96 1nqt s PRO 202 N -3.96 2.79 0.38 1.78 0.02 -1.26 -3.57 135.00 131.19 1nqt s PRO 202 Ca 0.38 2.10 0.06 0.00 0.02 0.00 0.00 61.00 63.57 1nqt s PRO 202 Cb -0.07 -1.99 0.79 0.00 0.02 0.00 0.00 34.50 33.25 1nqt s PRO 202 CO 0.26 -1.42 2.01 0.82 -0.33 0.00 0.00 177.00 178.34 1nqt h ILE 203 N 0.88 1.07 -0.81 2.83 1.08 -1.92 0.18 117.51 120.82 1nqt h ILE 203 Ca -0.51 -0.23 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1nqt h ILE 203 Cb 1.32 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 35.37 1nqt h ILE 203 CO 0.55 0.12 0.46 0.77 -0.69 0.00 0.00 178.15 179.37 1nqt h SER 204 N 0.68 1.00 -0.49 1.72 4.64 -1.90 -1.75 113.55 117.45 1nqt h SER 204 Ca 0.23 -0.09 -0.27 0.00 -0.47 0.00 0.00 61.79 61.20 1nqt h SER 204 Cb 0.09 -0.25 -0.15 0.00 -0.31 0.00 0.00 62.40 61.78 1nqt h SER 204 CO -0.06 0.80 0.35 0.00 -0.87 0.00 0.00 176.83 177.04 1nqt n GLN 205 N -4.43 1.66 -1.64 4.77 1.13 0.38 -4.83 117.38 114.42 1nqt n GLN 205 Ca 0.08 -1.50 0.00 0.00 -1.94 0.00 0.00 57.00 53.64 1nqt n GLN 205 Cb 0.08 -1.59 0.00 0.00 0.11 0.00 0.00 30.24 28.84 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 -0.16 0.46 3.93 1.08 0.00 -0.66 -4.67 105.19 105.17 1nqt n GLY 206 Ca 0.30 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.93 1.74 -0.11 -0.02 0.00 0.20 -4.79 107.32 101.41 1nqt s GLY 207 Ca 0.00 -1.10 0.01 0.00 0.00 0.00 0.00 44.72 43.63 1nqt s GLY 207 CO 0.00 -0.40 -0.15 -1.50 0.00 0.00 0.00 173.10 171.05 1nqt s ILE 208 N -3.79 2.93 0.22 0.90 2.07 -1.26 -4.64 121.20 117.64 1nqt s ILE 208 Ca 0.71 -0.72 -0.32 0.00 -1.41 0.00 0.00 60.65 58.92 1nqt s ILE 208 Cb -0.05 -2.21 -0.12 0.00 0.13 0.00 0.00 42.46 40.21 1nqt s ILE 208 CO 0.52 0.54 1.68 -1.00 -1.91 0.00 0.00 174.94 174.77 1nqt s HIS 209 N 0.17 2.89 0.00 3.50 3.76 -1.26 -3.37 115.29 120.98 1nqt s HIS 209 Ca -0.08 0.46 0.00 0.00 -0.15 0.00 0.00 55.06 55.29 1nqt s HIS 209 Cb -0.15 -4.10 0.00 0.00 1.11 0.00 0.00 32.58 29.44 1nqt s HIS 209 CO 0.05 -4.07 0.00 0.41 -0.85 0.00 0.00 174.74 170.28 1nqt n GLY 210 N 3.59 1.24 0.10 -2.22 0.00 -1.26 -4.11 105.19 102.53 1nqt n GLY 210 Ca 0.14 -0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1nqt n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nqt h ARG 211 N 0.00 0.17 0.00 1.61 2.43 -1.98 -3.21 114.38 113.41 1nqt h ARG 211 Ca 0.00 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1nqt h ARG 211 Cb 0.02 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1nqt h ARG 211 CO 0.00 1.12 0.00 -0.89 -1.51 0.00 0.00 179.97 178.69 1nqt n ILE 212 N -4.35 0.00 0.08 1.20 5.41 -1.26 -1.42 119.36 119.01 1nqt n ILE 212 Ca -0.12 1.41 0.01 0.00 1.00 0.00 0.00 62.75 65.05 1nqt n ILE 212 Cb 0.66 -2.06 0.04 0.00 -0.71 0.00 0.00 39.64 37.57 1nqt n ILE 212 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1nqt n SER 213 N -2.37 0.00 -0.23 4.38 3.41 -1.26 -3.87 113.62 113.69 1nqt n SER 213 Ca 0.00 0.43 0.01 0.00 -0.26 0.00 0.00 58.87 59.05 1nqt n SER 213 Cb 0.00 -0.44 0.13 0.00 -0.26 0.00 0.00 64.21 63.64 1nqt n SER 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nqt h ALA 214 N 2.08 0.89 -0.06 7.33 0.00 -1.24 0.21 119.26 128.46 1nqt h ALA 214 Ca 0.00 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1nqt h ALA 214 Cb 0.03 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.86 1nqt h ALA 214 CO 0.00 -0.15 -0.66 1.15 0.00 0.00 0.00 179.25 179.58 1nqt h THR 215 N 0.47 1.36 0.18 0.00 2.02 -1.74 -2.63 112.91 112.56 1nqt h THR 215 Ca 0.34 -1.99 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 1nqt h THR 215 Cb 0.42 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 69.12 1nqt h THR 215 CO -0.31 0.60 -0.27 1.23 0.37 0.00 0.00 175.52 177.14 1nqt h GLY 216 N 0.17 -1.08 -0.01 2.16 0.00 -1.68 -1.83 103.07 100.80 1nqt h GLY 216 Ca -0.06 0.51 0.26 0.00 0.00 0.00 0.00 47.33 48.03 1nqt h GLY 216 CO 0.13 -0.34 0.68 3.21 0.00 0.00 0.00 176.54 180.22 1nqt h ARG 217 N -0.47 0.27 0.13 4.80 3.08 -0.72 0.81 114.38 122.28 1nqt h ARG 217 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1nqt h ARG 217 Cb 0.43 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1nqt h ARG 217 CO -0.08 0.18 -0.13 0.78 -1.07 0.00 0.00 179.97 179.65 1nqt h GLY 218 N 0.28 -0.27 -0.21 0.04 0.00 -1.01 -0.10 103.07 101.79 1nqt h GLY 218 Ca 0.53 0.15 0.05 0.00 0.00 0.00 0.00 47.33 48.06 1nqt h GLY 218 CO -0.18 -0.13 -0.48 -2.08 0.00 0.00 0.00 176.54 173.67 1nqt h VAL 219 N -0.29 0.07 -0.55 4.60 2.07 -0.05 0.13 116.25 122.24 1nqt h VAL 219 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1nqt h VAL 219 Cb 0.28 0.07 -0.09 0.00 -1.52 0.00 0.00 31.29 30.03 1nqt h VAL 219 CO -0.04 0.00 -0.53 0.15 0.02 0.00 0.00 177.57 177.18 1nqt h PHE 220 N -0.44 -1.64 0.00 1.57 3.04 -1.14 0.75 116.94 119.08 1nqt h PHE 220 Ca 0.09 0.09 0.00 0.00 3.98 0.00 0.00 57.97 62.13 1nqt h PHE 220 Cb 0.62 0.79 0.00 0.00 2.56 0.00 0.00 35.95 39.92 1nqt h PHE 220 CO -0.60 -0.42 0.00 0.45 -2.02 0.00 0.00 178.31 175.72 1nqt h HIS 221 N -0.25 0.00 -0.01 0.41 3.86 -0.45 0.90 115.15 119.61 1nqt h HIS 221 Ca 0.09 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.23 1nqt h HIS 221 Cb 0.50 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.97 1nqt h HIS 221 CO -0.81 0.00 -0.27 0.78 0.86 0.00 0.00 177.93 178.48 1nqt h GLY 222 N 1.43 0.23 0.53 2.45 0.00 0.32 -2.99 103.07 105.04 1nqt h GLY 222 Ca 0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1nqt h GLY 222 CO 0.00 0.33 -0.26 -2.22 0.00 0.00 0.00 176.54 174.40 1nqt h ILE 223 N -0.42 0.00 0.00 2.60 2.04 -0.36 -3.29 117.51 118.07 1nqt h ILE 223 Ca -0.03 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1nqt h ILE 223 Cb 1.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1nqt h ILE 223 CO 0.05 0.00 0.00 1.21 0.00 0.00 0.00 178.15 179.41 1nqt n GLU 224 N -4.66 0.00 -0.55 2.37 0.00 0.26 -0.27 120.64 117.79 1nqt n GLU 224 Ca -0.09 0.55 0.44 0.00 0.00 0.00 0.00 57.16 58.06 1nqt n GLU 224 Cb 0.28 -0.85 0.71 0.00 0.00 0.00 0.00 31.44 31.58 1nqt n GLU 224 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1nqt n ASN 225 N -2.25 0.12 0.00 4.31 3.02 -1.13 -0.65 115.26 118.68 1nqt n ASN 225 Ca 0.00 1.18 -0.21 0.00 -0.03 0.00 0.00 54.58 55.52 1nqt n ASN 225 Cb 0.00 -0.58 -0.14 0.00 -0.61 0.00 0.00 39.78 38.45 1nqt n ASN 225 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1nqt n PHE 226 N -4.31 1.24 -0.03 3.10 3.01 0.63 -3.95 117.46 117.14 1nqt n PHE 226 Ca 0.41 0.26 -0.09 0.00 1.01 0.00 0.00 57.45 59.04 1nqt n PHE 226 Cb 1.69 -1.16 -0.02 0.00 -0.01 0.00 0.00 39.48 39.97 1nqt n PHE 226 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1nqt h ILE 227 N 0.07 0.40 0.00 4.37 2.04 0.12 -1.32 117.51 123.19 1nqt h ILE 227 Ca -0.43 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1nqt h ILE 227 Cb 2.03 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1nqt h ILE 227 CO 0.09 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.83 1nqt n ASN 228 N -5.37 0.00 -4.72 1.72 4.13 -0.28 -4.60 115.26 106.14 1nqt n ASN 228 Ca -0.02 0.01 -0.40 0.00 1.68 0.00 0.00 54.58 55.85 1nqt n ASN 228 Cb 0.29 -0.19 -0.05 0.00 -1.54 0.00 0.00 39.78 38.29 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1nqt s GLU 229 N -2.39 4.43 -0.00 3.52 2.56 -0.50 -4.95 118.70 121.38 1nqt s GLU 229 Ca 0.10 0.88 -0.25 0.00 0.00 0.00 0.00 54.97 55.71 1nqt s GLU 229 Cb 0.06 -3.45 -0.18 0.00 2.00 0.00 0.00 34.13 32.56 1nqt s GLU 229 CO 0.13 0.05 1.27 0.00 -0.56 0.00 0.00 175.26 176.15 1nqt h ALA 230 N 6.78 -0.19 -1.17 6.30 0.00 -1.86 -2.66 119.26 126.45 1nqt h ALA 230 Ca -0.41 -0.19 0.33 0.00 0.00 0.00 0.00 54.91 54.64 1nqt h ALA 230 Cb 1.20 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1nqt h ALA 230 CO 0.75 -0.41 0.79 1.03 0.00 0.00 0.00 179.25 181.41 1nqt h SER 231 N -0.58 0.23 0.27 0.00 0.87 -1.95 0.55 113.55 112.94 1nqt h SER 231 Ca -0.02 0.06 -0.27 0.00 -1.23 0.00 0.00 61.79 60.32 1nqt h SER 231 Cb 0.45 0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.38 1nqt h SER 231 CO 0.03 0.01 -1.97 -1.22 -0.53 0.00 0.00 176.83 173.15 1nqt n TYR 232 N -4.44 0.47 0.40 2.24 4.02 -1.24 -3.98 117.16 114.63 1nqt n TYR 232 Ca 0.28 0.16 -0.02 0.00 -0.01 0.00 0.00 57.90 58.31 1nqt n TYR 232 Cb 1.14 -1.02 0.08 0.00 -0.02 0.00 0.00 39.34 39.52 1nqt n TYR 232 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1nqt n MET 233 N -2.81 1.75 0.00 -0.72 2.81 0.09 -2.74 117.12 115.50 1nqt n MET 233 Ca -0.21 -0.89 0.00 0.00 -1.81 0.00 0.00 57.70 54.79 1nqt n MET 233 Cb 1.01 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 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 0.10 0.02 -0.36 7.83 7.64 -0.65 -0.48 113.62 127.72 1nqt n SER 234 Ca 0.13 -0.27 0.11 0.00 1.01 0.00 0.00 58.87 59.85 1nqt n SER 234 Cb 0.68 0.07 0.06 0.00 -1.01 0.00 0.00 64.21 64.02 1nqt n SER 234 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1nqt n ILE 235 N -0.07 0.00 -0.02 0.44 2.08 -1.11 -3.86 119.36 116.81 1nqt n ILE 235 Ca 0.00 -0.19 -0.03 0.00 0.56 0.00 0.00 62.75 63.10 1nqt n ILE 235 Cb 0.05 1.02 -0.03 0.00 -0.75 0.00 0.00 39.64 39.93 1nqt n ILE 235 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1nqt n LEU 236 N -0.42 0.85 -0.36 1.39 4.77 -1.19 -4.97 117.00 117.08 1nqt n LEU 236 Ca 0.09 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1nqt n LEU 236 Cb 0.42 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1nqt n LEU 236 CO 0.30 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1nqt n GLY 237 N 2.87 0.67 0.00 -0.72 0.00 -1.24 -5.10 105.19 101.68 1nqt n GLY 237 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.36 4.00 -3.53 1.61 2.00 0.37 -4.85 117.12 116.37 1nqt n MET 238 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 57.70 57.46 1nqt n MET 238 Cb 0.22 0.00 0.04 0.00 0.00 0.00 0.00 33.22 33.49 1nqt n MET 238 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1nqt n THR 239 N 0.00 -6.93 0.00 2.03 5.66 -1.26 -4.76 114.28 109.02 1nqt n THR 239 Ca 0.00 -0.94 0.00 0.00 -3.05 0.00 0.00 64.05 60.06 1nqt n THR 239 Cb 0.00 -5.04 0.00 0.00 -1.55 0.00 0.00 70.33 63.74 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 -3.65 1.69 -1.10 1.09 -0.02 -1.26 -5.07 135.00 126.69 1nqt n PRO 240 Ca -0.09 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1nqt n PRO 240 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 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 0.00 -0.62 2.02 -1.23 0.00 -1.26 -4.85 105.19 99.25 1nqt n GLY 241 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.06 -2.48 0.89 1.61 7.35 -1.26 -4.93 117.46 118.58 1nqt n PHE 242 Ca -0.02 0.12 0.12 0.00 -0.76 0.00 0.00 57.45 56.92 1nqt n PHE 242 Cb 0.41 0.76 0.27 0.00 0.35 0.00 0.00 39.48 41.27 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 -1.27 -1.32 5.18 7.13 0.00 -1.26 -4.96 105.19 108.70 1nqt n GLY 243 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.66 0.00 -3.64 1.61 -0.08 -1.26 -4.46 116.55 107.06 1nqt n ASP 244 Ca 0.05 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.23 1nqt n ASP 244 Cb 0.36 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.75 1nqt n ASP 244 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1nqt s LYS 245 N 0.00 0.64 -0.05 -0.67 -2.85 -1.26 -4.12 119.74 111.43 1nqt s LYS 245 Ca 0.00 0.85 -0.01 0.00 -1.00 0.00 0.00 55.97 55.81 1nqt s LYS 245 Cb 0.00 0.26 0.03 0.00 -2.06 0.00 0.00 37.83 36.06 1nqt s LYS 245 CO 0.00 -0.09 0.02 0.95 0.10 0.00 0.00 175.35 176.33 1nqt s THR 246 N 0.67 0.13 0.53 3.79 -4.23 -1.26 -0.91 115.64 114.35 1nqt s THR 246 Ca -0.02 0.24 0.02 0.00 -1.18 0.00 0.00 61.69 60.75 1nqt s THR 246 Cb -0.05 -0.31 0.02 0.00 1.34 0.00 0.00 72.50 73.50 1nqt s THR 246 CO -0.07 0.20 0.21 2.22 -0.54 0.00 0.00 174.62 176.63 1nqt n PHE 247 N 4.94 0.28 -3.76 3.99 -1.74 -0.92 0.45 117.46 120.70 1nqt n PHE 247 Ca -0.11 -2.40 -0.13 0.00 -0.56 0.00 0.00 57.45 54.25 1nqt n PHE 247 Cb 0.50 -0.39 -0.11 0.00 1.52 0.00 0.00 39.48 41.00 1nqt n PHE 247 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1nqt s VAL 248 N -2.77 -0.00 -0.08 1.97 1.01 0.26 -1.79 120.40 119.01 1nqt s VAL 248 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1nqt s VAL 248 Cb -0.01 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.93 1nqt s VAL 248 CO 0.10 0.00 -0.17 0.54 0.00 0.00 0.00 175.10 175.57 1nqt s VAL 249 N 0.19 1.49 -0.39 2.92 0.11 -1.18 0.70 120.40 124.23 1nqt s VAL 249 Ca -0.00 -0.69 -0.06 0.00 -2.93 0.00 0.00 61.98 58.30 1nqt s VAL 249 Cb -0.02 -1.32 0.08 0.00 -1.53 0.00 0.00 36.38 33.59 1nqt s VAL 249 CO 0.00 0.43 0.20 -1.58 -3.33 0.00 0.00 175.10 170.82 1nqt s GLN 250 N 0.53 2.43 0.00 1.54 -0.44 0.33 -2.31 119.66 121.74 1nqt s GLN 250 Ca -0.16 -1.51 0.00 0.00 -2.50 0.00 0.00 55.36 51.19 1nqt s GLN 250 Cb -0.17 -3.63 0.00 0.00 -1.64 0.00 0.00 33.01 27.58 1nqt s GLN 250 CO 0.06 -0.92 0.00 0.41 0.50 0.00 0.00 175.29 175.34 1nqt n GLY 251 N 4.79 2.22 2.60 2.59 0.00 -0.92 -0.83 105.19 115.63 1nqt n GLY 251 Ca -0.09 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 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 0.10 2.67 -3.98 1.61 -0.00 -1.26 -3.93 117.46 112.66 1nqt n PHE 252 Ca 0.00 -2.69 -0.27 0.00 -0.00 0.00 0.00 57.45 54.50 1nqt n PHE 252 Cb 0.00 -1.52 -0.17 0.00 -0.00 0.00 0.00 39.48 37.79 1nqt n PHE 252 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1nqt s GLY 253 N -0.51 0.83 0.00 7.13 0.00 -1.26 -4.79 107.32 108.72 1nqt s GLY 253 Ca 0.45 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.63 1nqt s GLY 253 CO -0.09 0.73 0.00 -2.01 0.00 0.00 0.00 173.10 171.73 1nqt n ASN 254 N 4.82 0.00 -0.07 1.64 5.15 -1.26 -1.61 115.26 123.93 1nqt n ASN 254 Ca -0.14 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.83 1nqt n ASN 254 Cb 0.50 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.74 1nqt n ASN 254 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 1nqt n VAL 255 N 0.00 -0.11 0.00 3.44 3.14 -1.26 0.46 118.33 124.00 1nqt n VAL 255 Ca 0.00 0.41 0.00 0.00 -2.96 0.00 0.00 64.34 61.79 1nqt n VAL 255 Cb 0.00 -0.52 0.00 0.00 -1.06 0.00 0.00 33.84 32.26 1nqt n VAL 255 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1nqt n GLY 256 N -1.06 -2.85 0.04 7.55 0.00 -0.63 -0.08 105.19 108.16 1nqt n GLY 256 Ca 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 46.02 46.30 1nqt n GLY 256 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1nqt n LEU 257 N -2.15 -0.10 -0.18 0.99 7.94 0.17 0.19 117.00 123.87 1nqt n LEU 257 Ca 0.00 0.62 -0.01 0.00 -1.11 0.00 0.00 56.01 55.51 1nqt n LEU 257 Cb 0.00 -0.25 0.08 0.00 0.53 0.00 0.00 43.42 43.79 1nqt n LEU 257 CO 0.00 -0.37 0.88 0.45 -1.11 0.00 0.00 177.39 177.24 1nqt h HIS 258 N 0.00 0.07 -0.56 1.96 3.86 -1.32 0.41 115.15 119.57 1nqt h HIS 258 Ca 0.02 0.04 0.16 0.00 -1.16 0.00 0.00 60.37 59.43 1nqt h HIS 258 Cb 0.04 0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 1nqt h HIS 258 CO -0.52 -0.08 0.41 0.77 0.86 0.00 0.00 177.93 179.37 1nqt h SER 259 N 0.18 0.00 0.11 2.45 0.02 0.57 0.44 113.55 117.32 1nqt h SER 259 Ca 0.28 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.02 1nqt h SER 259 Cb 0.42 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.99 1nqt h SER 259 CO -0.41 0.00 -0.89 -0.03 -1.14 0.00 0.00 176.83 174.36 1nqt h MET 260 N 0.00 0.41 -0.37 3.45 1.85 0.24 -2.38 114.93 118.13 1nqt h MET 260 Ca 0.27 -0.59 0.03 0.00 -0.61 0.00 0.00 59.70 58.80 1nqt h MET 260 Cb 1.08 0.20 -0.03 0.00 0.43 0.00 0.00 31.60 33.27 1nqt h MET 260 CO -0.00 1.25 0.17 -0.09 -0.40 0.00 0.00 176.91 177.83 1nqt h ARG 261 N -0.14 0.34 0.23 0.39 2.43 0.37 -0.77 114.38 117.22 1nqt h ARG 261 Ca -0.14 -0.02 -0.32 0.00 -0.81 0.00 0.00 59.98 58.69 1nqt h ARG 261 Cb 1.65 -0.08 0.03 0.00 -0.42 0.00 0.00 29.97 31.15 1nqt h ARG 261 CO 0.17 0.22 -1.44 1.88 -1.51 0.00 0.00 179.97 179.29 1nqt h TYR 262 N 0.35 0.87 -0.72 2.20 0.05 -0.98 -1.84 116.97 116.90 1nqt h TYR 262 Ca 0.16 -0.63 0.01 0.00 0.05 0.00 0.00 58.73 58.32 1nqt h TYR 262 Cb 0.10 -0.03 -0.04 0.00 1.01 0.00 0.00 36.73 37.77 1nqt h TYR 262 CO -0.12 1.55 0.47 1.25 -1.05 0.00 0.00 178.16 180.26 1nqt h LEU 263 N 0.05 0.83 -0.15 3.88 5.85 -1.40 -2.60 115.31 121.76 1nqt h LEU 263 Ca -0.26 -0.03 -0.23 0.00 0.84 0.00 0.00 57.88 58.20 1nqt h LEU 263 Cb 2.07 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.90 1nqt h LEU 263 CO 0.24 0.61 -0.96 -0.74 -0.34 0.00 0.00 178.44 177.24 1nqt h HIS 264 N 0.97 0.64 0.00 1.25 2.76 -1.20 -3.18 115.15 116.39 1nqt h HIS 264 Ca 0.26 -0.35 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 1nqt h HIS 264 Cb -0.10 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 28.79 1nqt h HIS 264 CO 0.00 1.18 0.03 -0.09 -1.30 0.00 0.00 177.93 177.74 1nqt h ARG 265 N 0.24 0.00 -1.47 5.26 2.43 -0.93 -3.05 114.38 116.86 1nqt h ARG 265 Ca -0.09 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.54 1nqt h ARG 265 Cb 1.60 0.00 -0.42 0.00 -0.42 0.00 0.00 29.97 30.74 1nqt h ARG 265 CO 0.17 0.00 -0.82 1.19 -1.51 0.00 0.00 179.97 179.00 1nqt n PHE 266 N -2.31 2.99 0.00 2.20 3.72 -1.16 -5.04 117.46 117.86 1nqt n PHE 266 Ca -0.02 -3.11 0.00 0.00 -0.05 0.00 0.00 57.45 54.28 1nqt n PHE 266 Cb 0.06 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 1nqt n PHE 266 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nqt n GLY 267 N -0.38 1.93 1.88 1.37 0.00 -1.15 -5.03 105.19 103.80 1nqt n GLY 267 Ca 0.33 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 1nqt n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 268 N 0.00 -2.37 -3.99 4.61 0.00 -1.24 -4.88 120.51 112.64 1nqt n ALA 268 Ca 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1nqt n ALA 268 Cb 0.00 -0.82 -0.16 0.00 0.00 0.00 0.00 19.45 18.47 1nqt n ALA 268 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nqt s LYS 269 N -0.58 2.08 0.20 0.00 1.02 -0.09 -4.41 119.74 117.96 1nqt s LYS 269 Ca 0.33 -0.66 -0.31 0.00 0.02 0.00 0.00 55.97 55.35 1nqt s LYS 269 Cb -0.31 -2.20 -0.10 0.00 -0.52 0.00 0.00 37.83 34.70 1nqt s LYS 269 CO 0.38 -0.33 1.55 0.00 -0.92 0.00 0.00 175.35 176.02 1nqt n ILE 271 N 3.45 0.00 -3.62 0.00 3.06 -0.74 -1.98 119.36 119.53 1nqt n ILE 271 Ca 0.12 -0.36 -0.13 0.00 -2.50 0.00 0.00 62.75 59.88 1nqt n ILE 271 Cb 0.39 0.88 -0.05 0.00 0.54 0.00 0.00 39.64 41.39 1nqt n ILE 271 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1nqt s ALA 272 N -1.15 -1.11 -0.02 1.51 0.00 -1.26 -1.91 121.76 117.82 1nqt s ALA 272 Ca 0.00 0.33 -0.18 0.00 0.00 0.00 0.00 51.96 52.10 1nqt s ALA 272 Cb 0.00 0.45 0.03 0.00 0.00 0.00 0.00 23.12 23.61 1nqt s ALA 272 CO 0.00 -0.52 0.39 0.08 0.00 0.00 0.00 175.76 175.70 1nqt s VAL 273 N -2.80 0.05 -0.29 0.00 1.01 -1.25 -3.10 120.40 114.01 1nqt s VAL 273 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1nqt s VAL 273 Cb -0.00 -0.71 0.19 0.00 0.00 0.00 0.00 36.38 35.86 1nqt s VAL 273 CO -0.05 -0.21 0.69 -0.83 0.00 0.00 0.00 175.10 174.70 1nqt s GLY 274 N -1.34 -1.08 0.00 4.51 0.00 -0.98 -1.50 107.32 106.93 1nqt s GLY 274 Ca -0.13 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.14 1nqt s GLY 274 CO 0.05 3.67 0.00 1.18 0.00 0.00 0.00 173.10 178.00 1nqt n GLU 275 N 5.39 1.86 -1.49 2.90 1.02 -1.26 -2.17 120.64 126.90 1nqt n GLU 275 Ca 0.03 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.81 1nqt n GLU 275 Cb 0.54 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 32.03 1nqt n GLU 275 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1nqt n SER 276 N 0.00 7.61 0.00 1.62 3.41 -1.26 -3.90 113.62 121.10 1nqt n SER 276 Ca 0.00 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.81 1nqt n SER 276 Cb 0.00 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 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 -0.83 0.00 0.00 4.04 8.00 -1.26 -5.15 116.55 121.35 1nqt n ASP 277 Ca 0.60 -0.48 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1nqt n ASP 277 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 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 0.00 -0.38 0.00 0.44 0.00 -1.25 -5.02 105.19 98.97 1nqt n GLY 278 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1nqt n GLY 278 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nqt n SER 279 N 0.00 0.00 -3.78 1.61 7.64 -1.26 -4.22 113.62 113.60 1nqt n SER 279 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.78 1nqt n SER 279 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1nqt n SER 279 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1nqt s ILE 280 N -2.00 0.05 -0.15 0.44 1.01 -0.56 -4.12 121.20 115.87 1nqt s ILE 280 Ca 0.00 -0.92 -0.29 0.00 0.00 0.00 0.00 60.65 59.44 1nqt s ILE 280 Cb 0.00 -1.54 0.11 0.00 0.01 0.00 0.00 42.46 41.03 1nqt s ILE 280 CO 0.00 -0.24 0.89 0.86 0.00 0.00 0.00 174.94 176.45 1nqt s TRP 281 N -3.88 -0.50 0.00 3.97 -0.11 -0.99 -3.84 118.94 113.60 1nqt s TRP 281 Ca 0.10 0.94 0.00 0.00 1.22 0.00 0.00 56.10 58.36 1nqt s TRP 281 Cb 0.01 0.41 0.00 0.00 -1.50 0.00 0.00 33.47 32.39 1nqt s TRP 281 CO -0.05 -0.40 0.00 -1.71 -4.62 0.00 0.00 176.95 170.17 1nqt n ASN 282 N 1.13 0.00 -2.23 5.86 2.85 -0.80 -1.12 115.26 120.95 1nqt n ASN 282 Ca -0.13 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.34 1nqt n ASN 282 Cb 0.57 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.59 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 -0.20 135.00 134.71 1nqt n PRO 283 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1nqt n PRO 283 Cb 0.00 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1nqt n PRO 283 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nqt n ASP 284 N 2.11 1.36 0.00 2.55 2.03 -1.26 -5.14 116.55 118.19 1nqt n ASP 284 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1nqt n ASP 284 Cb 0.00 0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 1nqt n ASP 284 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1nqt n GLY 285 N 1.07 3.06 3.14 0.27 0.00 0.72 -5.04 105.19 108.41 1nqt n GLY 285 Ca 0.00 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 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 -2.05 -0.48 0.16 -0.61 1.01 -0.84 -4.80 121.20 113.59 1nqt s ILE 286 Ca 0.00 0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.56 1nqt s ILE 286 Cb 0.00 -0.55 -0.07 0.00 0.01 0.00 0.00 42.46 41.85 1nqt s ILE 286 CO 0.00 0.09 0.98 -0.62 0.00 0.00 0.00 174.94 175.39 1nqt s ASP 287 N 2.39 7.51 0.04 3.58 2.15 -1.26 -4.56 116.67 126.52 1nqt s ASP 287 Ca -0.01 1.89 -0.25 0.00 0.43 0.00 0.00 52.55 54.61 1nqt s ASP 287 Cb -0.12 -2.60 -0.17 0.00 -0.30 0.00 0.00 42.92 39.73 1nqt s ASP 287 CO -0.11 -0.02 1.47 -0.65 -0.17 0.00 0.00 175.17 175.69 1nqt h PRO 288 N 5.05 -0.18 0.00 4.34 0.11 -1.96 -2.17 132.00 137.19 1nqt h PRO 288 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1nqt h PRO 288 Cb 1.21 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1nqt h PRO 288 CO 0.71 0.06 0.00 1.17 -0.21 0.00 0.00 178.00 179.73 1nqt n LYS 289 N -5.07 0.79 -0.09 1.05 3.00 -1.26 0.11 118.16 116.69 1nqt n LYS 289 Ca -0.09 0.00 -0.18 0.00 -0.00 0.00 0.00 58.31 58.04 1nqt n LYS 289 Cb 0.18 -1.20 -0.07 0.00 0.00 0.00 0.00 35.03 33.94 1nqt n LYS 289 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1nqt n GLU 290 N -0.70 0.39 -0.08 1.64 1.02 -1.16 -4.08 120.64 117.67 1nqt n GLU 290 Ca 0.08 0.16 -0.07 0.00 -0.02 0.00 0.00 57.16 57.30 1nqt n GLU 290 Cb 0.04 -1.17 0.10 0.00 -0.02 0.00 0.00 31.44 30.39 1nqt n GLU 290 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1nqt h LEU 291 N -0.53 0.75 0.00 -4.62 5.85 -1.28 -0.43 115.31 115.05 1nqt h LEU 291 Ca -0.44 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.01 1nqt h LEU 291 Cb 1.43 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1nqt h LEU 291 CO -0.24 0.95 0.00 1.21 -0.34 0.00 0.00 178.44 180.02 1nqt n GLU 292 N -4.12 0.00 -0.28 1.25 2.13 0.12 -0.74 120.64 119.00 1nqt n GLU 292 Ca 0.00 0.37 0.15 0.00 0.66 0.00 0.00 57.16 58.34 1nqt n GLU 292 Cb 0.43 -1.31 0.28 0.00 0.27 0.00 0.00 31.44 31.11 1nqt n GLU 292 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1nqt n ASP 293 N -1.53 -0.02 0.39 4.31 8.00 -1.20 0.50 116.55 127.00 1nqt n ASP 293 Ca 0.00 1.38 -0.19 0.00 0.71 0.00 0.00 54.79 56.69 1nqt n ASP 293 Cb 0.00 -0.53 -0.09 0.00 -0.02 0.00 0.00 41.12 40.47 1nqt n ASP 293 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1nqt h PHE 294 N 0.00 -1.22 -1.11 1.24 3.57 -0.82 0.65 116.94 119.24 1nqt h PHE 294 Ca 0.53 -0.01 0.31 0.00 3.53 0.00 0.00 57.97 62.33 1nqt h PHE 294 Cb 1.17 0.44 -0.08 0.00 2.79 0.00 0.00 35.95 40.27 1nqt h PHE 294 CO -0.34 -0.68 0.75 -0.22 -2.23 0.00 0.00 178.31 175.59 1nqt h LYS 295 N -1.10 0.22 0.00 1.11 1.63 0.22 -2.19 116.57 116.47 1nqt h LYS 295 Ca -0.09 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1nqt h LYS 295 Cb 0.89 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.47 1nqt h LYS 295 CO 0.08 0.14 -0.08 -0.07 -3.45 0.00 0.00 179.45 176.07 1nqt h LEU 296 N 0.22 0.00 -0.83 5.20 -0.00 -0.31 -3.36 115.31 116.23 1nqt h LEU 296 Ca 0.60 -0.49 0.20 0.00 -0.00 0.00 0.00 57.88 58.19 1nqt h LEU 296 Cb 1.86 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 42.40 1nqt h LEU 296 CO -0.20 0.79 0.28 -0.61 -0.00 0.00 0.00 178.44 178.70 1nqt h GLN 297 N -1.00 0.30 -2.78 1.13 4.15 0.86 -3.41 115.11 114.36 1nqt h GLN 297 Ca -0.02 -0.02 -0.14 0.00 0.77 0.00 0.00 58.65 59.24 1nqt h GLN 297 Cb 0.55 -0.07 -0.27 0.00 0.21 0.00 0.00 27.48 27.90 1nqt h GLN 297 CO -0.01 0.20 -0.35 -3.38 -1.93 0.00 0.00 178.83 173.36 1nqt s HIS 298 N -5.96 -0.50 0.00 3.99 -3.43 -0.91 -5.11 115.29 103.38 1nqt s HIS 298 Ca -0.12 1.10 0.00 0.00 -0.80 0.00 0.00 55.06 55.24 1nqt s HIS 298 Cb 0.24 0.19 0.00 0.00 -1.43 0.00 0.00 32.58 31.58 1nqt s HIS 298 CO 0.77 -0.29 0.00 0.41 -2.00 0.00 0.00 174.74 173.62 1nqt n GLY 299 N 4.12 0.39 0.00 -1.38 0.00 -1.26 -4.58 105.19 102.47 1nqt n GLY 299 Ca -0.23 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1nqt n GLY 299 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nqt n SER 300 N 1.75 1.45 -0.54 1.61 2.88 -1.26 -4.84 113.62 114.65 1nqt n SER 300 Ca 0.00 -0.44 0.13 0.00 -1.33 0.00 0.00 58.87 57.23 1nqt n SER 300 Cb 0.00 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 63.92 1nqt n SER 300 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1nqt n ILE 301 N -0.12 0.03 -2.20 2.46 -5.35 -1.26 -4.25 119.36 108.67 1nqt n ILE 301 Ca 0.00 -0.29 -0.43 0.00 -0.27 0.00 0.00 62.75 61.76 1nqt n ILE 301 Cb 0.00 0.59 -0.02 0.00 -1.74 0.00 0.00 39.64 38.46 1nqt n ILE 301 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1nqt s LEU 302 N -1.94 4.24 0.00 7.28 1.43 -1.26 -3.27 118.68 125.16 1nqt s LEU 302 Ca 0.36 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 1nqt s LEU 302 Cb 0.21 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.89 1nqt s LEU 302 CO 0.32 -0.86 0.00 0.61 0.23 0.00 0.00 176.35 176.65 1nqt n GLY 303 N 3.92 0.94 3.66 -3.19 0.00 -1.26 -5.06 105.19 104.19 1nqt n GLY 303 Ca 0.16 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 2.63 1.09 1.61 5.36 -1.20 -5.03 117.98 120.44 1nqt s PHE 304 Ca 0.00 0.80 -0.13 0.00 -0.96 0.00 0.00 56.93 56.64 1nqt s PHE 304 Cb 0.00 -3.61 0.20 0.00 -0.34 0.00 0.00 43.02 39.27 1nqt s PHE 304 CO 0.00 -2.25 0.79 -2.30 -1.46 0.00 0.00 175.22 170.00 1nqt n PRO 305 N 6.73 -1.70 -3.45 10.12 -0.02 -1.26 -3.32 135.00 142.10 1nqt n PRO 305 Ca 0.15 -0.46 -0.25 0.00 -2.02 0.00 0.00 63.50 60.92 1nqt n PRO 305 Cb 0.44 -2.09 0.03 0.00 -0.02 0.00 0.00 33.50 31.86 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 -3.96 -5.04 -3.62 -0.52 5.02 -1.26 -4.93 118.16 103.85 1nqt n LYS 306 Ca 0.05 0.69 -0.07 0.00 -2.02 0.00 0.00 58.31 56.95 1nqt n LYS 306 Cb 0.55 -5.54 -0.06 0.00 -0.02 0.00 0.00 35.03 29.96 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 -3.16 -2.03 -0.18 7.82 0.00 -1.21 -4.92 121.76 118.08 1nqt s ALA 307 Ca 0.47 1.75 -0.00 0.00 0.00 0.00 0.00 51.96 54.18 1nqt s ALA 307 Cb -0.23 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.62 1nqt s ALA 307 CO 0.58 -0.23 -0.15 0.21 0.00 0.00 0.00 175.76 176.17 1nqt s LYS 308 N -0.43 3.15 -0.34 0.00 2.47 -0.28 -4.80 119.74 119.50 1nqt s LYS 308 Ca 0.03 -0.76 -0.36 0.00 -1.56 0.00 0.00 55.97 53.33 1nqt s LYS 308 Cb -0.03 -2.69 -0.12 0.00 -1.46 0.00 0.00 37.83 33.53 1nqt s LYS 308 CO -0.06 -0.14 2.17 -2.30 0.16 0.00 0.00 175.35 175.18 1nqt n PRO 309 N 4.50 1.07 -2.17 4.03 -0.02 -1.26 -2.35 135.00 138.81 1nqt n PRO 309 Ca -0.20 0.30 -0.26 0.00 -2.02 0.00 0.00 63.50 61.32 1nqt n PRO 309 Cb 0.51 -2.43 0.07 0.00 -0.02 0.00 0.00 33.50 31.62 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 7.14 2.94 -0.29 6.00 5.04 -1.26 -4.94 117.35 131.98 1nqt s TYR 310 Ca 1.09 0.50 -0.00 0.00 -2.44 0.00 0.00 57.07 56.22 1nqt s TYR 310 Cb -0.88 -3.20 0.05 0.00 0.35 0.00 0.00 41.96 38.29 1nqt s TYR 310 CO 0.50 -1.41 -0.03 -2.00 -1.34 0.00 0.00 175.55 171.26 1nqt s GLU 311 N -5.27 2.35 0.00 4.97 -6.30 -1.26 -4.25 118.70 108.94 1nqt s GLU 311 Ca 0.60 -1.31 0.00 0.00 -2.50 0.00 0.00 54.97 51.76 1nqt s GLU 311 Cb -0.11 -3.09 0.00 0.00 0.00 0.00 0.00 34.13 30.93 1nqt s GLU 311 CO 0.45 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.53 1nqt n GLY 312 N 4.56 1.59 3.15 -1.50 0.00 -1.26 -4.97 105.19 106.76 1nqt n GLY 312 Ca -0.13 -0.70 0.04 0.00 0.00 0.00 0.00 46.02 45.24 1nqt n GLY 312 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nqt s SER 313 N -4.00 -1.42 0.16 1.61 1.04 -1.26 -4.83 113.70 105.01 1nqt s SER 313 Ca 0.00 0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1nqt s SER 313 Cb 0.00 1.90 0.00 0.00 0.10 0.00 0.00 66.02 68.02 1nqt s SER 313 CO 0.00 -0.26 0.43 2.30 0.98 0.00 0.00 173.24 176.70 1nqt n ILE 314 N 5.37 0.00 -0.40 -1.02 -0.00 -1.26 -3.22 119.36 118.82 1nqt n ILE 314 Ca 0.06 0.43 0.39 0.00 -0.00 0.00 0.00 62.75 63.63 1nqt n ILE 314 Cb 0.55 -1.06 0.66 0.00 -0.00 0.00 0.00 39.64 39.79 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 0.00 0.00 0.00 7.28 4.07 -1.96 0.33 115.31 125.04 1nqt h LEU 315 Ca 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.75 1nqt h LEU 315 Cb 0.87 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.57 1nqt h LEU 315 CO 0.00 0.00 -1.99 -0.62 -1.08 0.00 0.00 178.44 174.75 1nqt n GLU 316 N -3.69 0.66 -1.43 1.13 4.71 -1.20 -4.62 120.64 116.21 1nqt n GLU 316 Ca 0.31 0.02 -0.54 0.00 -0.01 0.00 0.00 57.16 56.94 1nqt n GLU 316 Cb 1.61 -1.61 -0.06 0.00 -1.01 0.00 0.00 31.44 30.37 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 -2.52 -3.32 -2.03 0.62 0.00 0.12 -3.91 120.51 109.46 1nqt n ALA 317 Ca -0.18 0.53 -0.42 0.00 0.00 0.00 0.00 53.44 53.36 1nqt n ALA 317 Cb 0.91 -1.66 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 1nqt n ALA 317 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nqt s ASP 318 N -0.32 6.61 0.35 0.00 3.68 -1.26 -4.60 116.67 121.12 1nqt s ASP 318 Ca 0.80 2.11 -0.15 0.00 2.13 0.00 0.00 52.55 57.43 1nqt s ASP 318 Cb -1.12 -2.53 0.06 0.00 -1.45 0.00 0.00 42.92 37.87 1nqt s ASP 318 CO 0.55 -1.00 0.80 0.00 0.13 0.00 0.00 175.17 175.66 1nqt n ASP 320 N -1.47 1.78 -4.06 0.00 10.43 0.17 -3.51 116.55 119.90 1nqt n ASP 320 Ca -0.07 -0.02 -0.32 0.00 2.57 0.00 0.00 54.79 56.95 1nqt n ASP 320 Cb 0.57 -0.37 -0.15 0.00 1.84 0.00 0.00 41.12 43.00 1nqt n ASP 320 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1nqt s ILE 321 N -2.53 2.01 -0.33 0.53 1.01 -0.78 -1.97 121.20 119.15 1nqt s ILE 321 Ca -0.28 -1.39 -0.11 0.00 0.00 0.00 0.00 60.65 58.87 1nqt s ILE 321 Cb 0.08 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.47 1nqt s ILE 321 CO 0.67 0.09 0.18 -0.22 0.00 0.00 0.00 174.94 175.66 1nqt s LEU 322 N 1.20 4.31 -0.31 2.97 1.98 0.24 0.89 118.68 129.96 1nqt s LEU 322 Ca -0.05 -0.58 -0.02 0.00 -2.89 0.00 0.00 54.13 50.59 1nqt s LEU 322 Cb -0.18 -2.04 0.06 0.00 0.66 0.00 0.00 46.19 44.69 1nqt s LEU 322 CO -0.07 -0.24 0.03 0.27 -1.89 0.00 0.00 176.35 174.45 1nqt s ILE 323 N 1.63 3.06 -0.99 6.68 -4.36 0.22 -1.16 121.20 126.28 1nqt s ILE 323 Ca 0.05 -1.45 -0.21 0.00 -0.26 0.00 0.00 60.65 58.77 1nqt s ILE 323 Cb -0.17 -2.80 0.08 0.00 1.25 0.00 0.00 42.46 40.81 1nqt s ILE 323 CO 0.07 -0.18 1.33 -2.84 0.24 0.00 0.00 174.94 173.56 1nqt s PRO 324 N 1.25 3.59 -0.86 0.37 0.02 -1.19 -0.51 135.00 137.67 1nqt s PRO 324 Ca -0.03 -1.36 0.01 0.00 0.02 0.00 0.00 61.00 59.64 1nqt s PRO 324 Cb -0.20 -5.19 0.34 0.00 0.02 0.00 0.00 34.50 29.46 1nqt s PRO 324 CO -0.01 -2.05 1.61 0.00 -0.33 0.00 0.00 177.00 176.22 1nqt n ALA 325 N 8.02 5.76 -2.24 -1.55 0.00 -0.01 -2.42 120.51 128.06 1nqt n ALA 325 Ca 0.30 -4.54 0.00 0.00 0.00 0.00 0.00 53.44 49.20 1nqt n ALA 325 Cb 0.50 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1nqt n ALA 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nqt n ALA 326 N -0.21 0.00 -0.75 0.00 0.00 -1.21 -4.33 120.51 114.00 1nqt n ALA 326 Ca 0.44 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.55 1nqt n ALA 326 Cb 0.31 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.90 1nqt n ALA 326 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nqt n SER 327 N 0.00 -1.55 -4.76 0.00 3.41 -1.26 -4.69 113.62 104.77 1nqt n SER 327 Ca 0.00 0.32 -0.34 0.00 -0.26 0.00 0.00 58.87 58.58 1nqt n SER 327 Cb 0.00 -1.26 0.03 0.00 -0.26 0.00 0.00 64.21 62.73 1nqt n SER 327 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1nqt s GLU 328 N -3.87 2.95 -0.06 4.33 8.01 -1.26 -4.35 118.70 124.45 1nqt s GLU 328 Ca 0.59 1.59 -0.03 0.00 0.01 0.00 0.00 54.97 57.13 1nqt s GLU 328 Cb -0.21 -1.95 0.00 0.00 -4.31 0.00 0.00 34.13 27.66 1nqt s GLU 328 CO 0.65 -1.17 0.05 1.63 0.01 0.00 0.00 175.26 176.43 1nqt n LYS 329 N -1.92 -0.62 0.00 1.61 5.02 -0.52 -4.92 118.16 116.81 1nqt n LYS 329 Ca 0.12 0.97 0.00 0.00 -2.02 0.00 0.00 58.31 57.37 1nqt n LYS 329 Cb 0.51 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.12 1nqt n LYS 329 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1nqt n GLN 330 N 1.13 4.90 -3.81 1.97 -0.06 -0.54 -4.92 117.38 116.06 1nqt n GLN 330 Ca -0.01 -0.05 -0.29 0.00 -2.00 0.00 0.00 57.00 54.65 1nqt n GLN 330 Cb 0.48 -0.47 -0.16 0.00 -4.06 0.00 0.00 30.24 26.03 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 -1.43 2.25 0.35 1.69 1.02 -0.22 -5.00 118.68 117.33 1nqt s LEU 331 Ca 0.00 -1.35 0.09 0.00 0.02 0.00 0.00 54.13 52.89 1nqt s LEU 331 Cb 0.00 -0.93 -0.06 0.00 0.02 0.00 0.00 46.19 45.22 1nqt s LEU 331 CO 0.00 -0.34 -0.02 0.42 0.02 0.00 0.00 176.35 176.43 1nqt s THR 332 N 1.57 2.46 0.17 5.49 -4.23 -1.26 -1.06 115.64 118.78 1nqt s THR 332 Ca 0.03 -2.05 -0.05 0.00 -1.18 0.00 0.00 61.69 58.44 1nqt s THR 332 Cb -0.18 -2.75 0.28 0.00 1.34 0.00 0.00 72.50 71.19 1nqt s THR 332 CO -0.15 -0.19 0.96 1.17 -0.54 0.00 0.00 174.62 175.87 1nqt n LYS 333 N -0.90 -0.06 0.00 3.99 4.81 -1.26 -0.39 118.16 124.35 1nqt n LYS 333 Ca -0.04 0.96 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1nqt n LYS 333 Cb 0.63 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 34.25 1nqt n LYS 333 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1nqt n SER 334 N -5.00 0.00 0.18 3.14 2.88 -1.26 -3.26 113.62 110.30 1nqt n SER 334 Ca 0.10 0.53 0.14 0.00 -1.33 0.00 0.00 58.87 58.30 1nqt n SER 334 Cb 0.30 -0.03 0.58 0.00 -0.75 0.00 0.00 64.21 64.32 1nqt n SER 334 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1nqt h ASN 335 N 0.00 0.00 -0.69 -3.46 -0.00 -1.83 -3.36 115.58 106.24 1nqt h ASN 335 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 56.30 56.36 1nqt h ASN 335 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 38.32 38.24 1nqt h ASN 335 CO 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 177.43 177.02 1nqt n ALA 336 N -1.86 -0.44 -0.26 4.14 0.00 0.48 -1.08 120.51 121.48 1nqt n ALA 336 Ca 0.01 0.59 0.05 0.00 0.00 0.00 0.00 53.44 54.09 1nqt n ALA 336 Cb 0.21 0.03 0.18 0.00 0.00 0.00 0.00 19.45 19.88 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 0.53 -1.05 0.00 0.11 -1.75 -3.02 132.00 126.81 1nqt h PRO 337 Ca 0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1nqt h PRO 337 Cb 0.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1nqt h PRO 337 CO -0.65 0.35 0.00 0.54 -0.21 0.00 0.00 178.00 178.03 1nqt n ARG 338 N -4.92 0.56 -3.72 1.05 1.74 -0.24 -4.75 116.66 106.37 1nqt n ARG 338 Ca 0.14 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.85 1nqt n ARG 338 Cb 0.38 -1.25 -0.12 0.00 -1.02 0.00 0.00 32.46 30.45 1nqt n ARG 338 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1nqt s VAL 339 N -0.20 4.43 -0.95 1.55 -7.23 -1.14 -4.60 120.40 112.26 1nqt s VAL 339 Ca 0.00 -0.23 0.26 0.00 -1.81 0.00 0.00 61.98 60.20 1nqt s VAL 339 Cb 0.00 -3.13 0.22 0.00 0.56 0.00 0.00 36.38 34.03 1nqt s VAL 339 CO 0.00 0.26 1.81 0.29 -0.31 0.00 0.00 175.10 177.15 1nqt n LYS 340 N 4.94 0.04 -2.54 4.82 4.76 -1.25 -4.83 118.16 124.10 1nqt n LYS 340 Ca -0.15 0.09 -0.34 0.00 -2.87 0.00 0.00 58.31 55.04 1nqt n LYS 340 Cb 0.51 -1.55 -0.04 0.00 -1.84 0.00 0.00 35.03 32.11 1nqt n LYS 340 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1nqt s ALA 341 N -3.02 2.89 -0.19 7.82 0.00 -1.23 -4.51 121.76 123.52 1nqt s ALA 341 Ca 0.12 0.54 0.22 0.00 0.00 0.00 0.00 51.96 52.84 1nqt s ALA 341 Cb 0.16 -3.23 -0.30 0.00 0.00 0.00 0.00 23.12 19.74 1nqt s ALA 341 CO 0.48 -0.29 0.57 1.63 0.00 0.00 0.00 175.76 178.15 1nqt n LYS 342 N -1.03 0.55 -4.19 0.00 4.76 -1.00 -4.91 118.16 112.34 1nqt n LYS 342 Ca 0.09 -0.16 -0.27 0.00 -2.87 0.00 0.00 58.31 55.10 1nqt n LYS 342 Cb 0.53 -1.53 -0.17 0.00 -1.84 0.00 0.00 35.03 32.02 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 -3.43 1.27 -0.25 -0.18 1.01 -0.83 -1.34 121.20 117.44 1nqt s ILE 343 Ca -0.05 -0.48 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 1nqt s ILE 343 Cb 0.14 -1.21 0.02 0.00 0.01 0.00 0.00 42.46 41.42 1nqt s ILE 343 CO 0.90 0.40 -0.05 -0.63 0.00 0.00 0.00 174.94 175.56 1nqt s ILE 344 N 1.29 3.01 -0.44 2.92 1.01 0.74 -0.59 121.20 129.14 1nqt s ILE 344 Ca -0.02 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.54 1nqt s ILE 344 Cb -0.14 -2.52 0.07 0.00 0.01 0.00 0.00 42.46 39.88 1nqt s ILE 344 CO -0.05 0.20 0.32 0.00 0.00 0.00 0.00 174.94 175.40 1nqt s ALA 345 N 1.35 3.42 -1.13 9.38 0.00 -0.31 -0.42 121.76 134.05 1nqt s ALA 345 Ca 0.01 -2.07 -0.23 0.00 0.00 0.00 0.00 51.96 49.66 1nqt s ALA 345 Cb -0.17 -2.85 -0.09 0.00 0.00 0.00 0.00 23.12 20.02 1nqt s ALA 345 CO -0.04 -1.65 1.95 -1.21 0.00 0.00 0.00 175.76 174.81 1nqt s GLU 346 N 1.55 2.42 -0.03 0.00 2.02 -0.44 -3.18 118.70 121.03 1nqt s GLU 346 Ca 0.03 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 54.05 1nqt s GLU 346 Cb -0.23 -5.20 0.03 0.00 0.10 0.00 0.00 34.13 28.84 1nqt s GLU 346 CO 0.05 -3.98 1.53 0.41 0.02 0.00 0.00 175.26 173.29 1nqt n GLY 347 N 6.00 2.43 3.61 -1.39 0.00 -1.02 -4.05 105.19 110.77 1nqt n GLY 347 Ca 0.44 -0.10 -0.06 0.00 0.00 0.00 0.00 46.02 46.30 1nqt n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 348 N -0.21 -2.03 0.13 4.61 0.00 -1.16 -4.24 121.76 118.85 1nqt s ALA 348 Ca 0.04 1.71 -0.31 0.00 0.00 0.00 0.00 51.96 53.39 1nqt s ALA 348 Cb 0.03 -0.94 -0.08 0.00 0.00 0.00 0.00 23.12 22.13 1nqt s ALA 348 CO 0.00 -0.33 1.41 -0.80 0.00 0.00 0.00 175.76 176.05 1nqt s ASN 349 N -1.27 6.79 -1.49 0.00 0.01 -1.26 -3.89 114.94 113.84 1nqt s ASN 349 Ca 0.05 2.38 -0.05 0.00 -0.71 0.00 0.00 52.86 54.52 1nqt s ASN 349 Cb -0.01 -2.59 0.04 0.00 0.41 0.00 0.00 41.25 39.11 1nqt s ASN 349 CO -0.04 -0.68 0.52 0.61 -1.51 0.00 0.00 177.10 176.01 1nqt n GLY 350 N 3.48 -0.29 0.20 0.66 0.00 -1.26 -4.62 105.19 103.37 1nqt n GLY 350 Ca 0.12 0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.38 1nqt n GLY 350 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nqt n PRO 351 N -4.42 1.27 -3.90 1.61 -0.04 -1.25 -1.44 135.00 126.82 1nqt n PRO 351 Ca -0.20 -0.40 -0.15 0.00 -0.04 0.00 0.00 63.50 62.71 1nqt n PRO 351 Cb 0.63 -1.32 -0.15 0.00 -0.04 0.00 0.00 33.50 32.62 1nqt n PRO 351 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1nqt s THR 352 N -1.92 0.10 0.66 0.52 -4.23 -1.26 -1.05 115.64 108.45 1nqt s THR 352 Ca 0.29 0.05 -0.11 0.00 -1.18 0.00 0.00 61.69 60.74 1nqt s THR 352 Cb 0.14 -0.16 -0.02 0.00 1.34 0.00 0.00 72.50 73.81 1nqt s THR 352 CO 0.23 0.09 1.05 0.28 -0.54 0.00 0.00 174.62 175.73 1nqt s THR 353 N 0.59 4.27 -2.00 3.99 -1.32 -0.22 -4.89 115.64 116.05 1nqt s THR 353 Ca -0.05 0.74 0.10 0.00 -1.21 0.00 0.00 61.69 61.26 1nqt s THR 353 Cb -0.08 -3.67 0.27 0.00 -1.51 0.00 0.00 72.50 67.51 1nqt s THR 353 CO -0.01 -0.96 1.16 -2.65 -2.21 0.00 0.00 174.62 169.94 1nqt n PRO 354 N -2.90 0.73 -0.13 7.08 -0.02 -1.26 -0.98 135.00 137.51 1nqt n PRO 354 Ca 0.06 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.26 1nqt n PRO 354 Cb 0.55 -1.21 -0.10 0.00 -0.02 0.00 0.00 33.50 32.72 1nqt n PRO 354 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1nqt n GLU 355 N -0.71 0.57 -0.27 -0.52 -0.58 -1.26 -4.11 120.64 113.76 1nqt n GLU 355 Ca 0.07 0.25 0.06 0.00 -0.42 0.00 0.00 57.16 57.13 1nqt n GLU 355 Cb 0.03 -1.45 0.30 0.00 -0.57 0.00 0.00 31.44 29.75 1nqt n GLU 355 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nqt h ALA 356 N -0.96 1.63 0.40 0.62 0.00 -1.58 -2.17 119.26 117.20 1nqt h ALA 356 Ca -0.67 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1nqt h ALA 356 Cb 1.59 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 1nqt h ALA 356 CO -0.41 0.22 -0.49 -0.44 0.00 0.00 0.00 179.25 178.13 1nqt h ASP 357 N 0.89 -1.37 -0.60 0.00 3.32 -1.25 -0.72 116.42 116.69 1nqt h ASP 357 Ca 0.39 0.12 0.05 0.00 0.02 0.00 0.00 57.03 57.61 1nqt h ASP 357 Cb 0.33 0.47 -0.07 0.00 0.22 0.00 0.00 39.33 40.28 1nqt h ASP 357 CO -0.15 -0.62 -0.35 0.29 -1.72 0.00 0.00 179.24 176.69 1nqt n LYS 358 N -5.37 -0.26 0.00 3.56 5.02 -0.84 -0.63 118.16 119.64 1nqt n LYS 358 Ca -0.11 1.17 0.00 0.00 -2.02 0.00 0.00 58.31 57.35 1nqt n LYS 358 Cb 0.43 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1nqt n LYS 358 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1nqt n ILE 359 N -4.39 0.00 0.01 -0.18 5.41 -1.05 -0.72 119.36 118.44 1nqt n ILE 359 Ca 0.01 1.26 0.19 0.00 1.00 0.00 0.00 62.75 65.21 1nqt n ILE 359 Cb 0.15 -1.91 0.38 0.00 -0.71 0.00 0.00 39.64 37.55 1nqt n ILE 359 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1nqt h PHE 360 N 0.00 0.00 0.22 1.39 0.04 -0.41 2.07 116.94 120.25 1nqt h PHE 360 Ca 0.00 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.45 1nqt h PHE 360 Cb 0.00 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.18 1nqt h PHE 360 CO -0.30 0.00 -1.44 1.25 -0.60 0.00 0.00 178.31 177.22 1nqt h LEU 361 N 0.00 0.72 0.87 1.54 6.46 0.65 0.49 115.31 126.04 1nqt h LEU 361 Ca 0.29 -0.79 -0.04 0.00 -0.12 0.00 0.00 57.88 57.22 1nqt h LEU 361 Cb 2.30 -0.24 0.01 0.00 -0.73 0.00 0.00 40.66 42.01 1nqt h LEU 361 CO -0.00 1.62 -0.42 -0.33 -0.62 0.00 0.00 178.44 178.69 1nqt h GLU 362 N 0.13 -1.12 -1.81 1.25 5.08 0.56 -3.23 114.58 115.42 1nqt h GLU 362 Ca -0.23 0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 1nqt h GLU 362 Cb 2.12 0.26 -0.04 0.00 0.50 0.00 0.00 28.75 31.59 1nqt h GLU 362 CO 0.25 -0.75 0.11 2.89 -1.00 0.00 0.00 179.01 180.51 1nqt n ARG 363 N -5.33 1.21 -2.84 2.33 1.85 -0.79 -4.90 116.66 108.19 1nqt n ARG 363 Ca -0.14 -0.42 -0.07 0.00 -1.00 0.00 0.00 57.85 56.21 1nqt n ARG 363 Cb 0.46 -1.17 0.01 0.00 -1.05 0.00 0.00 32.46 30.71 1nqt n ARG 363 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1nqt n ASN 364 N 1.13 -5.34 -3.84 2.89 3.02 -1.21 -4.98 115.26 106.93 1nqt n ASN 364 Ca 0.08 0.24 -0.19 0.00 -0.03 0.00 0.00 54.58 54.68 1nqt n ASN 364 Cb 0.53 -1.33 -0.16 0.00 -0.61 0.00 0.00 39.78 38.21 1nqt n ASN 364 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1nqt s ILE 365 N -0.92 0.33 -0.46 2.41 -1.09 0.17 -4.93 121.20 116.70 1nqt s ILE 365 Ca 0.07 0.01 -0.17 0.00 -2.23 0.00 0.00 60.65 58.32 1nqt s ILE 365 Cb -0.01 -0.40 0.05 0.00 -1.58 0.00 0.00 42.46 40.52 1nqt s ILE 365 CO 0.16 0.18 0.48 -0.32 -1.23 0.00 0.00 174.94 174.21 1nqt s MET 366 N 1.05 3.07 -0.42 2.79 -2.45 -0.45 -4.54 119.30 118.34 1nqt s MET 366 Ca -0.09 -0.98 -0.16 0.00 -1.25 0.00 0.00 55.69 53.21 1nqt s MET 366 Cb -0.14 -4.06 0.03 0.00 1.25 0.00 0.00 34.83 31.91 1nqt s MET 366 CO -0.01 -1.01 0.37 0.08 1.05 0.00 0.00 175.02 175.49 1nqt s VAL 367 N 2.13 5.18 -0.58 10.11 1.01 -1.26 -0.18 120.40 136.81 1nqt s VAL 367 Ca 0.10 -0.57 -0.20 0.00 0.00 0.00 0.00 61.98 61.32 1nqt s VAL 367 Cb -0.20 -4.00 0.08 0.00 0.00 0.00 0.00 36.38 32.26 1nqt s VAL 367 CO 0.11 -0.39 0.76 -0.63 0.00 0.00 0.00 175.10 174.96 1nqt s ILE 368 N 1.88 4.68 0.27 2.22 1.01 0.44 -4.34 121.20 127.36 1nqt s ILE 368 Ca 0.08 -0.59 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 1nqt s ILE 368 Cb -0.19 -4.48 -0.07 0.00 0.01 0.00 0.00 42.46 37.73 1nqt s ILE 368 CO 0.11 -1.11 -0.10 -2.65 0.00 0.00 0.00 174.94 171.20 1nqt n PRO 369 N 6.70 0.00 -0.05 2.79 -0.02 -1.26 -1.32 135.00 141.84 1nqt n PRO 369 Ca -0.06 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.28 1nqt n PRO 369 Cb 0.44 -0.48 -0.12 0.00 -0.02 0.00 0.00 33.50 33.33 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 -0.06 -0.00 0.00 2.55 -0.00 -1.85 0.12 116.42 117.18 1nqt h ASP 370 Ca -0.20 -0.79 0.00 0.00 -0.00 0.00 0.00 57.03 56.05 1nqt h ASP 370 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.02 1nqt h ASP 370 CO 0.19 0.79 0.40 -0.11 -0.00 0.00 0.00 179.24 180.51 1nqt n LEU 371 N -4.71 0.03 0.00 0.15 7.94 -1.26 -1.49 117.00 117.66 1nqt n LEU 371 Ca -0.09 0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.99 1nqt n LEU 371 Cb 0.39 -0.15 0.00 0.00 0.53 0.00 0.00 43.42 44.18 1nqt n LEU 371 CO 0.33 -0.19 -0.13 0.00 -1.11 0.00 0.00 177.39 176.29 1nqt n TYR 372 N -1.27 0.00 -0.15 1.96 4.19 -1.21 -4.57 117.16 116.11 1nqt n TYR 372 Ca -0.00 0.00 -0.03 0.00 3.31 0.00 0.00 57.90 61.18 1nqt n TYR 372 Cb 0.40 0.35 0.18 0.00 0.49 0.00 0.00 39.34 40.76 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 0.00 0.82 -3.86 2.98 5.85 -0.41 -2.94 115.31 117.75 1nqt h LEU 373 Ca 0.00 -0.13 -0.50 0.00 0.84 0.00 0.00 57.88 58.09 1nqt h LEU 373 Cb 0.26 -0.21 -0.27 0.00 0.37 0.00 0.00 40.66 40.81 1nqt h LEU 373 CO 0.00 0.77 0.49 -0.46 -0.34 0.00 0.00 178.44 178.90 1nqt n ASN 374 N -4.28 4.62 -1.75 1.25 2.04 -0.56 -3.22 115.26 113.36 1nqt n ASN 374 Ca 0.05 -3.70 0.00 0.00 -0.44 0.00 0.00 54.58 50.48 1nqt n ASN 374 Cb 0.21 -0.81 0.32 0.00 -2.53 0.00 0.00 39.78 36.97 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 -1.06 4.12 0.03 -2.53 0.00 -1.11 -4.38 120.51 115.58 1nqt n ALA 375 Ca 0.55 -2.27 -0.20 0.00 0.00 0.00 0.00 53.44 51.52 1nqt n ALA 375 Cb 1.24 -1.10 -0.10 0.00 0.00 0.00 0.00 19.45 19.50 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 2.83 0.80 0.65 0.00 0.00 -1.79 -2.52 103.07 103.04 1nqt h GLY 376 Ca 0.14 -1.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.10 1nqt h GLY 376 CO 0.57 1.21 -0.36 -1.33 0.00 0.00 0.00 176.54 176.63 1nqt h GLY 377 N 0.42 -0.86 -0.39 4.60 0.00 -1.76 -2.18 103.07 102.90 1nqt h GLY 377 Ca -0.12 0.41 0.08 0.00 0.00 0.00 0.00 47.33 47.70 1nqt h GLY 377 CO 0.20 -0.31 -0.44 -2.08 0.00 0.00 0.00 176.54 173.92 1nqt h VAL 378 N -0.77 0.10 -0.96 4.60 2.07 -1.84 0.13 116.25 119.58 1nqt h VAL 378 Ca -0.03 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.74 1nqt h VAL 378 Cb 0.68 0.10 -0.13 0.00 -1.52 0.00 0.00 31.29 30.41 1nqt h VAL 378 CO -0.05 0.00 0.49 0.74 0.02 0.00 0.00 177.57 178.78 1nqt h THR 379 N -0.28 0.44 0.05 2.57 2.02 -1.18 0.38 112.91 116.90 1nqt h THR 379 Ca 0.15 -0.15 -0.23 0.00 0.77 0.00 0.00 66.41 66.96 1nqt h THR 379 Cb 0.57 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1nqt h THR 379 CO -0.63 0.08 -1.04 0.58 0.37 0.00 0.00 175.52 174.88 1nqt h VAL 380 N 0.43 1.53 -0.04 3.16 2.07 -0.62 -3.13 116.25 119.65 1nqt h VAL 380 Ca 0.63 -2.91 -0.03 0.00 0.82 0.00 0.00 66.70 65.21 1nqt h VAL 380 Cb 1.28 2.71 -0.01 0.00 -1.52 0.00 0.00 31.29 33.75 1nqt h VAL 380 CO -0.54 0.85 -0.10 0.77 0.02 0.00 0.00 177.57 178.57 1nqt h SER 381 N 0.09 0.05 0.72 0.57 4.64 0.23 0.15 113.55 120.00 1nqt h SER 381 Ca -0.07 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.21 1nqt h SER 381 Cb 1.73 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.81 1nqt h SER 381 CO 0.16 0.16 -0.38 0.22 -0.87 0.00 0.00 176.83 176.12 1nqt h TYR 382 N 0.05 -0.98 -0.37 4.77 -0.00 -1.10 -0.94 116.97 118.40 1nqt h TYR 382 Ca 0.01 -0.02 0.08 0.00 -0.00 0.00 0.00 58.73 58.80 1nqt h TYR 382 Cb 0.22 0.33 -0.08 0.00 -0.00 0.00 0.00 36.73 37.20 1nqt h TYR 382 CO 0.00 -0.59 -0.15 0.74 -0.00 0.00 0.00 178.16 178.16 1nqt h PHE 383 N -1.01 -0.35 -0.08 -3.82 0.05 -1.24 -1.12 116.94 109.37 1nqt h PHE 383 Ca -0.10 0.04 0.01 0.00 3.82 0.00 0.00 57.97 61.74 1nqt h PHE 383 Cb 0.79 0.21 -0.03 0.00 2.00 0.00 0.00 35.95 38.92 1nqt h PHE 383 CO -0.05 -0.22 -0.21 1.49 -0.18 0.00 0.00 178.31 179.14 1nqt h GLU 384 N -0.08 -0.20 0.00 1.51 4.81 -0.50 0.69 114.58 120.82 1nqt h GLU 384 Ca 0.18 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1nqt h GLU 384 Cb 0.35 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1nqt h GLU 384 CO -0.42 -0.13 0.00 1.87 -0.73 0.00 0.00 179.01 179.60 1nqt n TRP 385 N -3.66 0.00 -0.24 0.92 -0.00 -0.38 0.37 117.44 114.45 1nqt n TRP 385 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.50 57.42 1nqt n TRP 385 Cb 0.14 -0.25 -0.06 0.00 -0.00 0.00 0.00 31.31 31.14 1nqt n TRP 385 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1nqt n LEU 386 N -2.25 -0.61 -0.23 5.87 4.77 -0.51 -0.05 117.00 123.99 1nqt n LEU 386 Ca 0.00 1.38 -0.03 0.00 -0.03 0.00 0.00 56.01 57.33 1nqt n LEU 386 Cb 0.00 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1nqt n LEU 386 CO 0.00 -1.01 0.31 1.17 -1.33 0.00 0.00 177.39 176.53 1nqt n LYS 387 N -4.31 -0.20 -0.14 3.23 4.81 0.23 0.28 118.16 122.07 1nqt n LYS 387 Ca 0.01 0.89 -0.04 0.00 -0.87 0.00 0.00 58.31 58.30 1nqt n LYS 387 Cb 0.15 -1.31 0.03 0.00 0.02 0.00 0.00 35.03 33.92 1nqt n LYS 387 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1nqt h ASN 388 N 0.00 -0.35 -0.34 3.14 4.21 0.29 0.07 115.58 122.60 1nqt h ASN 388 Ca 0.15 0.12 -0.02 0.00 1.21 0.00 0.00 56.30 57.77 1nqt h ASN 388 Cb 0.29 0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.72 1nqt h ASN 388 CO -0.56 -0.12 0.17 -0.07 -1.29 0.00 0.00 177.43 175.55 1nqt h LEU 389 N 0.03 0.48 0.00 1.61 3.38 0.49 -2.69 115.31 118.61 1nqt h LEU 389 Ca 0.21 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1nqt h LEU 389 Cb 0.32 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1nqt h LEU 389 CO -0.43 0.43 -0.16 0.78 0.09 0.00 0.00 178.44 179.15 1nqt h ASN 390 N 0.54 0.00 -3.85 -0.43 2.35 0.91 -3.48 115.58 111.61 1nqt h ASN 390 Ca 0.14 -0.03 -0.39 0.00 -0.55 0.00 0.00 56.30 55.47 1nqt h ASN 390 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1nqt h ASN 390 CO -0.02 0.02 -0.53 1.41 -1.65 0.00 0.00 177.43 176.66 1nqt n HIS 391 N -2.51 -1.47 -3.66 1.19 8.25 -0.36 -4.98 115.22 111.68 1nqt n HIS 391 Ca 0.04 0.22 -0.15 0.00 -0.26 0.00 0.00 57.72 57.58 1nqt n HIS 391 Cb 0.47 -3.90 -0.08 0.00 1.12 0.00 0.00 29.99 27.60 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 -3.02 0.01 0.32 1.59 1.01 -1.25 -5.09 120.40 113.97 1nqt s VAL 392 Ca 0.14 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 1nqt s VAL 392 Cb -0.06 -0.81 -0.10 0.00 0.00 0.00 0.00 36.38 35.41 1nqt s VAL 392 CO 0.17 -0.04 1.26 -0.94 0.00 0.00 0.00 175.10 175.55 1nqt s SER 393 N -0.33 6.87 0.04 3.32 1.04 -1.26 -4.87 113.70 118.50 1nqt s SER 393 Ca -0.05 2.60 -0.33 0.00 0.48 0.00 0.00 55.95 58.65 1nqt s SER 393 Cb -0.03 -2.64 -0.12 0.00 0.10 0.00 0.00 66.02 63.32 1nqt s SER 393 CO 0.04 -0.46 1.77 -1.22 0.98 0.00 0.00 173.24 174.35 1nqt n TYR 394 N 0.87 2.37 0.00 5.02 4.02 -1.26 -2.13 117.16 126.04 1nqt n TYR 394 Ca -0.00 0.05 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1nqt n TYR 394 Cb 0.42 -2.64 0.00 0.00 -0.02 0.00 0.00 39.34 37.11 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 4.03 3.41 0.63 2.72 0.00 -1.26 -4.21 105.19 110.51 1nqt n GLY 395 Ca 0.20 0.00 0.47 0.00 0.00 0.00 0.00 46.02 46.68 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 2.58 0.02 0.01 1.61 1.12 -1.81 0.62 114.38 118.54 1nqt h ARG 396 Ca 0.00 -0.00 -0.35 0.00 -1.11 0.00 0.00 59.98 58.52 1nqt h ARG 396 Cb 0.00 -0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 29.90 1nqt h ARG 396 CO 0.00 0.01 -2.19 1.28 -3.11 0.00 0.00 179.97 175.96 1nqt n LEU 397 N -4.15 0.98 0.03 3.80 4.77 -1.26 -4.69 117.00 116.48 1nqt n LEU 397 Ca 0.40 0.10 0.02 0.00 -0.03 0.00 0.00 56.01 56.50 1nqt n LEU 397 Cb 1.75 0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 42.79 1nqt n LEU 397 CO 0.39 0.58 -0.32 0.35 -1.33 0.00 0.00 177.39 177.06 1nqt n THR 398 N -2.98 1.04 -0.34 -5.08 -2.24 0.11 -4.39 114.28 100.40 1nqt n THR 398 Ca -0.31 -0.67 0.06 0.00 -2.27 0.00 0.00 64.05 60.86 1nqt n THR 398 Cb 1.09 -0.62 0.22 0.00 -2.10 0.00 0.00 70.33 68.92 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 1.06 0.07 4.78 0.05 -1.55 0.95 116.94 122.30 1nqt h PHE 399 Ca -0.15 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.67 1nqt h PHE 399 Cb 1.49 -0.33 0.00 0.00 2.00 0.00 0.00 35.95 39.11 1nqt h PHE 399 CO 0.00 0.42 -0.04 -0.22 -0.18 0.00 0.00 178.31 178.29 1nqt h LYS 400 N 0.93 -0.10 -0.10 1.51 1.63 -1.85 -1.58 116.57 117.02 1nqt h LYS 400 Ca 0.47 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.31 1nqt h LYS 400 Cb 0.45 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.04 1nqt h LYS 400 CO -0.26 0.39 -0.51 -0.92 -3.45 0.00 0.00 179.45 174.69 1nqt h TYR 401 N -0.64 -1.51 -0.16 1.91 3.20 -1.64 -1.35 116.97 116.79 1nqt h TYR 401 Ca -0.01 0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1nqt h TYR 401 Cb 0.53 0.67 -0.05 0.00 1.54 0.00 0.00 36.73 39.43 1nqt h TYR 401 CO 0.10 -0.54 -0.36 0.93 -1.64 0.00 0.00 178.16 176.65 1nqt h GLU 402 N -0.58 -0.32 -0.86 1.82 4.39 -0.86 -0.51 114.58 117.66 1nqt h GLU 402 Ca 0.04 0.02 0.14 0.00 0.34 0.00 0.00 59.36 59.90 1nqt h GLU 402 Cb 0.68 0.07 -0.14 0.00 -0.10 0.00 0.00 28.75 29.26 1nqt h GLU 402 CO -0.41 -0.21 -0.31 -2.13 -1.16 0.00 0.00 179.01 174.79 1nqt n ARG 403 N -4.42 -0.18 0.05 2.33 0.63 -0.59 -0.49 116.66 114.00 1nqt n ARG 403 Ca -0.03 1.32 -0.03 0.00 -0.92 0.00 0.00 57.85 58.19 1nqt n ARG 403 Cb 0.23 -1.96 -0.02 0.00 0.45 0.00 0.00 32.46 31.17 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 -0.21 -0.53 6.15 3.45 -0.11 -2.33 116.42 122.85 1nqt h ASP 404 Ca 0.32 0.02 0.22 0.00 0.43 0.00 0.00 57.03 58.01 1nqt h ASP 404 Cb 0.53 0.07 -0.10 0.00 -0.56 0.00 0.00 39.33 39.27 1nqt h ASP 404 CO -0.86 -0.11 0.27 -1.20 -1.57 0.00 0.00 179.24 175.77 1nqt n SER 405 N -2.72 0.17 -0.06 6.45 7.64 0.36 0.10 113.62 125.55 1nqt n SER 405 Ca -0.02 0.88 -0.13 0.00 1.01 0.00 0.00 58.87 60.61 1nqt n SER 405 Cb 0.07 -0.42 -0.07 0.00 -1.01 0.00 0.00 64.21 62.78 1nqt n SER 405 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1nqt h ASN 406 N 0.00 0.45 1.04 6.43 -0.26 -0.53 -1.69 115.58 121.01 1nqt h ASN 406 Ca 0.44 -0.49 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 1nqt h ASN 406 Cb 1.15 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 1nqt h ASN 406 CO -0.41 0.85 0.00 1.88 -1.06 0.00 0.00 177.43 178.69 1nqt h TYR 407 N 0.05 0.00 0.09 1.19 0.99 0.11 -2.19 116.97 117.22 1nqt h TYR 407 Ca 0.02 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1nqt h TYR 407 Cb 0.74 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.47 1nqt h TYR 407 CO 0.09 0.00 -0.04 0.45 -0.00 0.00 0.00 178.16 178.65 1nqt h HIS 408 N 0.00 -0.11 -0.37 4.88 3.86 -1.33 -1.74 115.15 120.34 1nqt h HIS 408 Ca 0.00 -0.00 0.11 0.00 -1.16 0.00 0.00 60.37 59.31 1nqt h HIS 408 Cb 0.52 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 1nqt h HIS 408 CO 0.00 0.23 0.44 1.25 0.86 0.00 0.00 177.93 180.71 1nqt h LEU 409 N -0.99 0.00 0.00 2.43 6.46 -1.17 0.31 115.31 122.35 1nqt h LEU 409 Ca -0.01 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.70 1nqt h LEU 409 Cb 0.39 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1nqt h LEU 409 CO 0.02 0.00 -0.30 -0.07 -0.62 0.00 0.00 178.44 177.47 1nqt h LEU 410 N 0.00 0.00 -1.90 2.25 3.38 -1.43 -3.15 115.31 114.46 1nqt h LEU 410 Ca 0.18 -0.76 0.18 0.00 0.09 0.00 0.00 57.88 57.56 1nqt h LEU 410 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1nqt h LEU 410 CO -0.00 1.06 0.57 0.24 0.09 0.00 0.00 178.44 180.40 1nqt h MET 411 N -1.00 0.00 0.00 1.13 2.86 0.13 0.50 114.93 118.55 1nqt h MET 411 Ca -0.08 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 1nqt h MET 411 Cb 0.96 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1nqt h MET 411 CO -0.05 0.00 -0.17 0.77 1.06 0.00 0.00 176.91 178.53 1nqt h SER 412 N 0.00 0.14 -0.01 1.22 0.02 -0.61 -1.22 113.55 113.08 1nqt h SER 412 Ca 0.29 -0.80 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1nqt h SER 412 Cb 1.43 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.92 1nqt h SER 412 CO -0.00 0.93 -0.06 0.58 -1.14 0.00 0.00 176.83 177.14 1nqt h VAL 413 N -0.63 0.00 -0.88 2.27 2.07 -0.11 -0.27 116.25 118.70 1nqt h VAL 413 Ca -0.02 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.64 1nqt h VAL 413 Cb 0.95 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.58 1nqt h VAL 413 CO 0.03 0.00 -0.33 1.67 0.02 0.00 0.00 177.57 178.97 1nqt n GLN 414 N -2.88 -0.19 0.33 1.57 7.27 0.38 -1.21 117.38 122.66 1nqt n GLN 414 Ca -0.01 1.36 -0.17 0.00 0.07 0.00 0.00 57.00 58.25 1nqt n GLN 414 Cb 0.04 -2.02 -0.09 0.00 2.41 0.00 0.00 30.24 30.58 1nqt n GLN 414 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 1nqt h GLU 415 N 0.00 -0.87 -0.91 3.69 4.81 -0.61 -0.98 114.58 119.71 1nqt h GLU 415 Ca 0.33 0.06 0.16 0.00 -0.13 0.00 0.00 59.36 59.78 1nqt h GLU 415 Cb 0.55 0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.05 1nqt h GLU 415 CO -0.88 -0.58 0.58 0.66 -0.73 0.00 0.00 179.01 178.06 1nqt h SER 416 N -0.91 0.62 0.16 1.04 4.64 0.41 0.04 113.55 119.56 1nqt h SER 416 Ca -0.07 0.05 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 1nqt h SER 416 Cb 0.74 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1nqt h SER 416 CO 0.06 0.29 -0.68 -0.07 -0.87 0.00 0.00 176.83 175.56 1nqt h LEU 417 N 0.64 0.55 0.00 5.97 4.07 -0.97 -2.54 115.31 123.04 1nqt h LEU 417 Ca 0.47 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1nqt h LEU 417 Cb 0.83 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1nqt h LEU 417 CO -0.22 1.08 0.00 -0.62 -1.08 0.00 0.00 178.44 177.59 1nqt n GLU 418 N -3.88 0.64 0.06 1.13 1.02 -0.08 -1.98 120.64 117.55 1nqt n GLU 418 Ca -0.04 0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.24 1nqt n GLU 418 Cb 0.68 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.81 1nqt n GLU 418 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1nqt n ARG 419 N -1.09 0.27 -1.38 3.49 0.63 -0.70 -3.58 116.66 114.31 1nqt n ARG 419 Ca 0.16 0.10 -0.34 0.00 -0.92 0.00 0.00 57.85 56.85 1nqt n ARG 419 Cb 0.12 -1.69 0.07 0.00 0.45 0.00 0.00 32.46 31.40 1nqt n ARG 419 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1nqt n LYS 420 N -2.10 2.60 0.00 -0.14 5.02 -0.84 -4.76 118.16 117.95 1nqt n LYS 420 Ca 0.04 -3.13 0.00 0.00 -2.02 0.00 0.00 58.31 53.20 1nqt n LYS 420 Cb 0.43 -2.22 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1nqt n LYS 420 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1nqt n PHE 421 N -0.69 0.00 -1.55 2.13 -0.00 -1.24 -5.08 117.46 111.04 1nqt n PHE 421 Ca 0.58 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.74 1nqt n PHE 421 Cb 0.58 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 40.00 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 -0.01 3.82 7.13 0.00 -1.26 -4.77 105.19 110.10 1nqt n GLY 422 Ca 0.00 0.57 -0.06 0.00 0.00 0.00 0.00 46.02 46.53 1nqt n GLY 422 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nqt s LYS 423 N 8.49 1.68 0.00 1.61 1.02 -1.26 -5.04 119.74 126.24 1nqt s LYS 423 Ca 1.02 -0.98 0.00 0.00 0.02 0.00 0.00 55.97 56.02 1nqt s LYS 423 Cb -0.29 0.54 0.00 0.00 -0.52 0.00 0.00 37.83 37.56 1nqt s LYS 423 CO 0.24 -0.78 0.35 1.58 -0.92 0.00 0.00 175.35 175.83 1nqt n HIS 424 N -0.50 0.00 -1.55 3.18 -0.00 -1.26 -4.83 115.22 110.26 1nqt n HIS 424 Ca -0.05 -0.04 -0.00 0.00 0.46 0.00 0.00 57.72 58.08 1nqt n HIS 424 Cb 0.60 -0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.46 1nqt n HIS 424 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1nqt n GLY 425 N -0.04 0.48 0.16 1.57 0.00 -1.26 -5.02 105.19 101.06 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 -0.40 -0.86 -0.02 0.00 -1.95 -3.44 103.07 96.39 1nqt h GLY 426 Ca -0.03 0.15 -0.46 0.00 0.00 0.00 0.00 47.33 46.99 1nqt h GLY 426 CO -0.01 -0.14 0.25 -1.59 0.00 0.00 0.00 176.54 175.04 1nqt s THR 427 N -3.37 2.18 0.00 4.70 2.01 -1.26 -5.02 115.64 114.87 1nqt s THR 427 Ca -0.06 0.06 0.22 0.00 0.31 0.00 0.00 61.69 62.23 1nqt s THR 427 Cb 0.01 -2.68 0.37 0.00 0.01 0.00 0.00 72.50 70.21 1nqt s THR 427 CO 0.17 -0.08 1.14 -0.38 -0.69 0.00 0.00 174.62 174.79 1nqt n ILE 428 N -3.92 0.00 -0.45 1.82 2.08 -1.26 -4.92 119.36 112.70 1nqt n ILE 428 Ca 0.06 -0.86 0.38 0.00 0.56 0.00 0.00 62.75 62.89 1nqt n ILE 428 Cb 0.58 0.93 0.66 0.00 -0.75 0.00 0.00 39.64 41.05 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 0.86 0.07 0.00 0.38 0.11 -1.91 -2.65 132.00 128.86 1nqt h PRO 429 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1nqt h PRO 429 Cb 1.83 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.92 1nqt h PRO 429 CO 0.05 0.05 0.00 0.44 -0.21 0.00 0.00 178.00 178.33 1nqt n ILE 430 N -4.68 0.00 -4.09 4.15 -5.35 -1.26 -4.33 119.36 103.80 1nqt n ILE 430 Ca 0.38 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.54 1nqt n ILE 430 Cb 1.47 -0.04 -0.16 0.00 -1.74 0.00 0.00 39.64 39.16 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 -0.39 1.82 0.70 7.28 0.11 -1.00 -4.94 120.40 123.98 1nqt s VAL 431 Ca 0.00 -0.79 -0.11 0.00 -2.93 0.00 0.00 61.98 58.15 1nqt s VAL 431 Cb 0.00 -1.67 0.01 0.00 -1.53 0.00 0.00 36.38 33.20 1nqt s VAL 431 CO 0.00 0.50 1.07 -2.84 -3.33 0.00 0.00 175.10 170.50 1nqt s PRO 432 N 1.37 2.84 0.01 1.54 0.02 -1.26 -4.99 135.00 134.53 1nqt s PRO 432 Ca 0.05 1.00 -0.30 0.00 0.02 0.00 0.00 61.00 61.76 1nqt s PRO 432 Cb -0.13 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 1nqt s PRO 432 CO -0.12 -1.18 1.14 0.95 -0.33 0.00 0.00 177.00 177.47 1nqt s THR 433 N -3.00 4.32 0.01 0.99 -4.23 -1.26 -4.70 115.64 107.77 1nqt s THR 433 Ca 0.59 1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 62.74 1nqt s THR 433 Cb -0.15 -4.06 0.01 0.00 1.34 0.00 0.00 72.50 69.64 1nqt s THR 433 CO 0.54 0.09 0.10 0.00 -0.54 0.00 0.00 174.62 174.81 1nqt n ALA 434 N 4.31 -0.02 -0.23 3.99 0.00 -1.26 0.41 120.51 127.70 1nqt n ALA 434 Ca 0.09 0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.62 1nqt n ALA 434 Cb 0.47 -0.02 0.27 0.00 0.00 0.00 0.00 19.45 20.18 1nqt n ALA 434 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1nqt h GLU 435 N 0.00 0.92 0.10 0.00 3.07 -1.99 -0.27 114.58 116.40 1nqt h GLU 435 Ca 0.02 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1nqt h GLU 435 Cb 0.03 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 27.74 1nqt h GLU 435 CO -0.06 0.61 -0.05 0.35 -1.40 0.00 0.00 179.01 178.46 1nqt h PHE 436 N 0.95 -0.12 -0.72 4.33 -0.00 0.77 -1.70 116.94 120.44 1nqt h PHE 436 Ca 0.32 -0.00 0.11 0.00 -0.00 0.00 0.00 57.97 58.40 1nqt h PHE 436 Cb 0.08 0.04 -0.08 0.00 -0.00 0.00 0.00 35.95 36.00 1nqt h PHE 436 CO -0.00 0.16 0.34 0.37 -0.00 0.00 0.00 178.31 179.17 1nqt h GLN 437 N -0.40 0.53 -0.62 1.11 4.15 -0.74 0.48 115.11 119.63 1nqt h GLN 437 Ca -0.01 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 1nqt h GLN 437 Cb 0.33 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1nqt h GLN 437 CO 0.02 0.35 0.36 -0.44 -1.93 0.00 0.00 178.83 177.20 1nqt h ASP 438 N 0.55 0.74 0.44 -0.69 3.45 -0.93 0.08 116.42 120.06 1nqt h ASP 438 Ca 0.37 -0.04 -0.02 0.00 0.43 0.00 0.00 57.03 57.77 1nqt h ASP 438 Cb 0.45 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 1nqt h ASP 438 CO -0.31 0.58 -0.21 -0.09 -1.57 0.00 0.00 179.24 177.63 1nqt h ARG 439 N 0.85 -0.57 -0.78 3.56 1.12 -0.02 -2.46 114.38 116.08 1nqt h ARG 439 Ca 0.22 0.04 0.01 0.00 -1.11 0.00 0.00 59.98 59.14 1nqt h ARG 439 Cb -0.02 0.13 -0.04 0.00 -0.01 0.00 0.00 29.97 30.03 1nqt h ARG 439 CO -0.04 -0.28 0.51 0.82 -3.11 0.00 0.00 179.97 177.87 1nqt h ILE 440 N -1.03 1.20 0.14 1.20 2.04 -0.99 -1.65 117.51 118.41 1nqt h ILE 440 Ca -0.06 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1nqt h ILE 440 Cb 0.56 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 1nqt h ILE 440 CO 0.10 0.20 -0.12 -1.28 0.00 0.00 0.00 178.15 177.05 1nqt h SER 441 N 1.05 -0.30 -1.75 1.72 0.87 -1.00 -3.00 113.55 111.15 1nqt h SER 441 Ca 0.28 0.03 -0.72 0.00 -1.23 0.00 0.00 61.79 60.15 1nqt h SER 441 Cb -0.11 0.10 -0.30 0.00 -0.44 0.00 0.00 62.40 61.65 1nqt h SER 441 CO -0.06 -0.18 0.70 0.61 -0.53 0.00 0.00 176.83 177.37 1nqt n GLY 442 N -1.23 5.67 3.71 5.77 0.00 -0.93 -4.99 105.19 113.20 1nqt n GLY 442 Ca -0.08 -2.51 -0.42 0.00 0.00 0.00 0.00 46.02 43.01 1nqt n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 443 N -3.95 3.33 0.21 4.61 0.00 -0.66 -4.91 121.76 120.40 1nqt s ALA 443 Ca 0.53 0.68 -0.06 0.00 0.00 0.00 0.00 51.96 53.11 1nqt s ALA 443 Cb 0.44 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 1nqt s ALA 443 CO -0.31 -0.43 0.27 -1.54 0.00 0.00 0.00 175.76 173.75 1nqt s SER 444 N 1.11 0.06 0.14 0.00 1.04 -1.26 -5.08 113.70 109.70 1nqt s SER 444 Ca 0.55 -1.17 -0.28 0.00 0.48 0.00 0.00 55.95 55.53 1nqt s SER 444 Cb -0.25 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 1nqt s SER 444 CO 0.27 -0.95 1.59 -0.08 0.98 0.00 0.00 173.24 175.04 1nqt h GLU 445 N 2.48 -0.43 -0.66 4.02 4.81 -1.95 -2.32 114.58 120.53 1nqt h GLU 445 Ca -0.32 0.03 0.20 0.00 -0.13 0.00 0.00 59.36 59.14 1nqt h GLU 445 Cb 1.25 0.10 -0.12 0.00 0.63 0.00 0.00 28.75 30.60 1nqt h GLU 445 CO 0.46 -0.29 0.08 1.17 -0.73 0.00 0.00 179.01 179.70 1nqt n LYS 446 N -5.43 -0.05 0.16 1.92 4.81 -1.26 -0.64 118.16 117.68 1nqt n LYS 446 Ca -0.03 0.98 -0.08 0.00 -0.87 0.00 0.00 58.31 58.31 1nqt n LYS 446 Cb 0.35 -1.59 -0.04 0.00 0.02 0.00 0.00 35.03 33.77 1nqt n LYS 446 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1nqt h ASP 447 N 0.00 -0.52 -0.90 3.14 3.32 -1.76 0.47 116.42 120.18 1nqt h ASP 447 Ca 0.43 0.03 0.22 0.00 0.02 0.00 0.00 57.03 57.74 1nqt h ASP 447 Cb 0.95 0.16 -0.16 0.00 0.22 0.00 0.00 39.33 40.50 1nqt h ASP 447 CO -0.60 -0.30 -0.02 0.40 -1.72 0.00 0.00 179.24 177.00 1nqt h ILE 448 N -0.47 0.15 0.00 0.35 1.08 -0.94 0.18 117.51 117.86 1nqt h ILE 448 Ca -0.04 -0.02 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1nqt h ILE 448 Cb 0.38 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 34.23 1nqt h ILE 448 CO 0.02 0.01 0.00 0.52 -0.69 0.00 0.00 178.15 178.01 1nqt n VAL 449 N -5.45 0.00 -0.22 1.67 0.31 -0.86 -0.35 118.33 113.44 1nqt n VAL 449 Ca 0.18 1.37 0.02 0.00 -0.01 0.00 0.00 64.34 65.91 1nqt n VAL 449 Cb 0.60 -2.29 0.06 0.00 -0.91 0.00 0.00 33.84 31.30 1nqt n VAL 449 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1nqt n HIS 450 N -1.77 0.13 0.32 3.52 8.25 0.16 0.16 115.22 125.99 1nqt n HIS 450 Ca 0.00 0.72 -0.18 0.00 -0.26 0.00 0.00 57.72 58.00 1nqt n HIS 450 Cb 0.00 -0.79 -0.09 0.00 1.12 0.00 0.00 29.99 30.23 1nqt n HIS 450 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1nqt h SER 451 N 0.00 -1.27 -1.18 0.41 0.02 -0.51 0.17 113.55 111.19 1nqt h SER 451 Ca 0.25 0.09 0.35 0.00 -0.84 0.00 0.00 61.79 61.64 1nqt h SER 451 Cb 0.40 0.40 -0.10 0.00 0.14 0.00 0.00 62.40 63.24 1nqt h SER 451 CO -0.59 -0.65 0.78 1.23 -1.14 0.00 0.00 176.83 176.45 1nqt h GLY 452 N -1.01 1.08 0.58 -3.77 0.00 0.45 0.71 103.07 101.11 1nqt h GLY 452 Ca -0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1nqt h GLY 452 CO -0.01 -0.22 -0.28 -2.00 0.00 0.00 0.00 176.54 174.03 1nqt h LEU 453 N 0.22 -0.66 -0.36 3.11 6.46 0.60 -2.30 115.31 122.39 1nqt h LEU 453 Ca 0.68 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 58.51 1nqt h LEU 453 Cb 2.05 0.17 -0.06 0.00 -0.73 0.00 0.00 40.66 42.08 1nqt h LEU 453 CO -0.30 -0.39 -0.42 0.00 -0.62 0.00 0.00 178.44 176.72 1nqt h ALA 454 N -1.46 -0.63 -1.15 1.25 0.00 0.12 -0.59 119.26 116.80 1nqt h ALA 454 Ca -0.08 0.01 0.33 0.00 0.00 0.00 0.00 54.91 55.17 1nqt h ALA 454 Cb 0.60 1.05 -0.11 0.00 0.00 0.00 0.00 17.79 19.34 1nqt h ALA 454 CO 0.13 -0.84 0.74 -0.92 0.00 0.00 0.00 179.25 178.36 1nqt h TYR 455 N -0.26 0.59 0.06 0.00 5.03 -1.00 0.83 116.97 122.22 1nqt h TYR 455 Ca 0.06 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.39 1nqt h TYR 455 Cb 0.42 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.54 1nqt h TYR 455 CO -0.73 -0.05 -0.03 1.15 -1.32 0.00 0.00 178.16 177.18 1nqt h THR 456 N 0.26 1.25 -0.76 1.81 2.02 -0.56 -2.17 112.91 114.76 1nqt h THR 456 Ca 0.68 -1.16 0.09 0.00 0.77 0.00 0.00 66.41 66.79 1nqt h THR 456 Cb 1.94 1.99 -0.07 0.00 -1.74 0.00 0.00 68.15 70.27 1nqt h THR 456 CO -0.34 0.28 0.41 0.24 0.37 0.00 0.00 175.52 176.49 1nqt h MET 457 N -0.61 0.69 0.60 6.66 2.86 0.38 -0.13 114.93 125.38 1nqt h MET 457 Ca -0.01 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1nqt h MET 457 Cb 0.53 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.04 1nqt h MET 457 CO 0.01 0.45 -0.29 1.49 1.06 0.00 0.00 176.91 179.64 1nqt h GLU 458 N 0.71 -0.78 0.00 1.72 4.81 -0.97 -0.29 114.58 119.79 1nqt h GLU 458 Ca 0.37 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 1nqt h GLU 458 Cb 0.34 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1nqt h GLU 458 CO -0.25 -0.52 0.20 -0.09 -0.73 0.00 0.00 179.01 177.62 1nqt h ARG 459 N -0.91 0.00 0.12 1.92 2.43 -1.24 0.46 114.38 117.16 1nqt h ARG 459 Ca -0.08 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.73 1nqt h ARG 459 Cb 0.62 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1nqt h ARG 459 CO 0.14 0.00 -1.94 0.43 -1.51 0.00 0.00 179.97 177.09 1nqt n SER 460 N -2.67 2.12 0.01 -3.80 7.64 -0.07 -3.05 113.62 113.80 1nqt n SER 460 Ca -0.02 0.23 -0.10 0.00 1.01 0.00 0.00 58.87 59.99 1nqt n SER 460 Cb 0.24 -0.89 -0.03 0.00 -1.01 0.00 0.00 64.21 62.52 1nqt n SER 460 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nqt h ALA 461 N 0.04 -0.24 -0.28 -0.43 0.00 0.89 0.64 119.26 119.88 1nqt h ALA 461 Ca -0.42 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.59 1nqt h ALA 461 Cb 1.99 0.45 -0.08 0.00 0.00 0.00 0.00 17.79 20.16 1nqt h ALA 461 CO 0.07 -0.71 -0.28 0.00 0.00 0.00 0.00 179.25 178.34 1nqt h ARG 462 N -0.32 -0.26 -0.58 0.00 2.47 -1.44 0.18 114.38 114.43 1nqt h ARG 462 Ca 0.09 0.02 0.12 0.00 -1.26 0.00 0.00 59.98 58.95 1nqt h ARG 462 Cb 0.45 0.06 -0.11 0.00 -1.65 0.00 0.00 29.97 28.72 1nqt h ARG 462 CO -0.28 -0.17 -0.12 1.96 0.56 0.00 0.00 179.97 181.91 1nqt h GLN 463 N -0.27 0.02 0.33 0.04 4.20 -1.25 0.20 115.11 118.38 1nqt h GLN 463 Ca 0.15 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 1nqt h GLN 463 Cb 0.50 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1nqt h GLN 463 CO -0.43 0.01 -0.34 0.82 -0.67 0.00 0.00 178.83 178.21 1nqt h ILE 464 N 0.02 0.00 0.00 2.54 2.04 0.72 0.93 117.51 123.75 1nqt h ILE 464 Ca 0.28 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.14 1nqt h ILE 464 Cb 0.44 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1nqt h ILE 464 CO -0.58 0.00 0.00 0.23 0.00 0.00 0.00 178.15 177.80 1nqt n MET 465 N -4.44 0.00 -0.12 2.37 2.81 0.45 -1.30 117.12 116.89 1nqt n MET 465 Ca -0.08 0.61 -0.03 0.00 -1.81 0.00 0.00 57.70 56.39 1nqt n MET 465 Cb 0.31 -1.11 -0.03 0.00 -0.71 0.00 0.00 33.22 31.68 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 -1.46 -0.13 0.00 0.03 0.63 0.63 0.33 116.66 116.70 1nqt n ARG 466 Ca 0.00 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.71 1nqt n ARG 466 Cb 0.00 -1.15 0.01 0.00 0.45 0.00 0.00 32.46 31.77 1nqt n ARG 466 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1nqt n THR 467 N -3.60 0.00 -0.09 5.15 -1.04 0.31 -0.69 114.28 114.32 1nqt n THR 467 Ca 0.01 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.82 1nqt n THR 467 Cb 0.07 -0.52 -0.06 0.00 -1.82 0.00 0.00 70.33 68.00 1nqt n THR 467 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nqt n ALA 468 N -0.57 1.60 -0.24 2.41 0.00 1.00 -4.38 120.51 120.34 1nqt n ALA 468 Ca 0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 53.44 52.65 1nqt n ALA 468 Cb 0.00 0.20 0.11 0.00 0.00 0.00 0.00 19.45 19.76 1nqt n ALA 468 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1nqt h MET 469 N -0.75 0.67 0.00 0.00 2.86 0.03 -1.37 114.93 116.37 1nqt h MET 469 Ca -0.42 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1nqt h MET 469 Cb 1.32 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.83 1nqt h MET 469 CO -0.25 0.44 0.00 1.17 1.06 0.00 0.00 176.91 179.33 1nqt n LYS 470 N -4.79 0.02 0.00 1.72 4.81 -0.27 -1.19 118.16 118.45 1nqt n LYS 470 Ca 0.09 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1nqt n LYS 470 Cb 0.19 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 33.69 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 -1.58 0.00 -4.01 5.64 4.01 -0.94 -5.01 117.16 115.26 1nqt n TYR 471 Ca 0.02 -0.36 -0.27 0.00 -0.16 0.00 0.00 57.90 57.13 1nqt n TYR 471 Cb 0.10 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.06 1nqt n TYR 471 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1nqt n ASN 472 N -0.36 -0.60 -4.92 7.72 5.15 -0.34 -5.00 115.26 116.92 1nqt n ASN 472 Ca 0.00 -1.03 -0.26 0.00 -0.60 0.00 0.00 54.58 52.70 1nqt n ASN 472 Cb 0.26 -2.91 0.01 0.00 -0.53 0.00 0.00 39.78 36.61 1nqt n ASN 472 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1nqt s LEU 473 N -7.04 3.62 0.00 1.20 1.43 -0.61 -5.02 118.68 112.25 1nqt s LEU 473 Ca 0.10 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1nqt s LEU 473 Cb -0.05 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1nqt s LEU 473 CO 0.90 -0.66 0.00 0.61 0.23 0.00 0.00 176.35 177.43 1nqt n GLY 474 N -2.21 -0.29 0.53 -3.19 0.00 -1.26 -4.56 105.19 94.21 1nqt n GLY 474 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.88 3.17 -3.71 0.99 4.32 -1.26 -4.73 117.00 114.89 1nqt n LEU 475 Ca 0.00 -2.96 -0.42 0.00 -0.02 0.00 0.00 56.01 52.62 1nqt n LEU 475 Cb 0.00 -0.46 -0.00 0.00 -1.62 0.00 0.00 43.42 41.33 1nqt n LEU 475 CO 0.00 0.68 2.44 -0.67 -1.22 0.00 0.00 177.39 178.62 1nqt n ASP 476 N -0.82 5.31 -0.18 -1.43 -0.08 -1.26 -4.33 116.55 113.77 1nqt n ASP 476 Ca 0.18 -2.95 -0.06 0.00 -1.51 0.00 0.00 54.79 50.45 1nqt n ASP 476 Cb 0.75 -1.54 0.11 0.00 2.34 0.00 0.00 41.12 42.77 1nqt n ASP 476 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1nqt h LEU 477 N 8.35 0.91 0.00 -2.67 -0.00 -1.85 -2.38 115.31 117.67 1nqt h LEU 477 Ca 0.54 -0.21 0.00 0.00 -0.00 0.00 0.00 57.88 58.22 1nqt h LEU 477 Cb 0.56 -0.24 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 1nqt h LEU 477 CO 1.73 0.92 0.00 -1.14 -0.00 0.00 0.00 178.44 179.95 1nqt n ARG 478 N -4.22 0.00 0.04 1.13 0.63 -1.26 -0.54 116.66 112.43 1nqt n ARG 478 Ca 0.04 0.27 0.22 0.00 -0.92 0.00 0.00 57.85 57.45 1nqt n ARG 478 Cb 0.28 -1.13 0.68 0.00 0.45 0.00 0.00 32.46 32.74 1nqt n ARG 478 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1nqt h THR 479 N 0.00 0.27 0.20 5.15 1.35 -1.95 1.37 112.91 119.30 1nqt h THR 479 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.85 1nqt h THR 479 Cb 0.00 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 66.93 1nqt h THR 479 CO 0.00 0.00 -0.10 0.00 -0.25 0.00 0.00 175.52 175.17 1nqt h ALA 480 N 1.28 -0.27 0.05 6.62 0.00 -0.83 -1.85 119.26 124.25 1nqt h ALA 480 Ca 0.25 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1nqt h ALA 480 Cb 1.46 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1nqt h ALA 480 CO -0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 179.25 178.58 1nqt h ALA 481 N 0.42 -0.73 -1.21 0.00 0.00 0.44 0.35 119.26 118.52 1nqt h ALA 481 Ca -0.03 -0.02 0.41 0.00 0.00 0.00 0.00 54.91 55.27 1nqt h ALA 481 Cb 0.28 0.39 -0.14 0.00 0.00 0.00 0.00 17.79 18.32 1nqt h ALA 481 CO 0.05 -0.74 0.75 1.88 0.00 0.00 0.00 179.25 181.18 1nqt h TYR 482 N -0.12 0.64 0.57 0.00 0.05 -1.38 0.52 116.97 117.25 1nqt h TYR 482 Ca -0.01 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 1nqt h TYR 482 Cb 0.11 -0.16 0.01 0.00 1.01 0.00 0.00 36.73 37.70 1nqt h TYR 482 CO -0.17 -0.25 -0.27 0.28 -1.05 0.00 0.00 178.16 176.70 1nqt h VAL 483 N 0.11 0.00 -0.91 -2.88 2.07 -0.66 -0.34 116.25 113.64 1nqt h VAL 483 Ca 0.81 -0.11 0.36 0.00 0.82 0.00 0.00 66.70 68.59 1nqt h VAL 483 Cb 2.37 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 31.98 1nqt h VAL 483 CO -0.51 0.00 0.43 -3.20 0.02 0.00 0.00 177.57 174.31 1nqt n ASN 484 N -4.34 0.26 0.12 0.57 5.15 0.16 -0.48 115.26 116.71 1nqt n ASN 484 Ca -0.09 1.51 -0.12 0.00 -0.60 0.00 0.00 54.58 55.28 1nqt n ASN 484 Cb 0.30 -0.71 -0.07 0.00 -0.53 0.00 0.00 39.78 38.76 1nqt n ASN 484 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nqt h ALA 485 N 1.81 -0.36 -0.59 5.20 0.00 -0.67 -2.90 119.26 121.75 1nqt h ALA 485 Ca 0.74 -0.20 0.14 0.00 0.00 0.00 0.00 54.91 55.59 1nqt h ALA 485 Cb 1.93 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.82 1nqt h ALA 485 CO -0.72 -0.45 0.41 0.82 0.00 0.00 0.00 179.25 179.31 1nqt h ILE 486 N -0.85 0.78 0.62 0.00 1.08 0.10 0.85 117.51 120.09 1nqt h ILE 486 Ca -0.04 -0.06 -0.03 0.00 -0.39 0.00 0.00 64.86 64.34 1nqt h ILE 486 Cb 0.51 0.59 0.01 0.00 -3.07 0.00 0.00 36.82 34.86 1nqt h ILE 486 CO 0.06 0.03 -0.30 -0.33 -0.69 0.00 0.00 178.15 176.93 1nqt h GLU 487 N 0.18 -0.80 0.04 2.37 5.08 -1.17 -1.05 114.58 119.23 1nqt h GLU 487 Ca 0.28 0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.70 1nqt h GLU 487 Cb 0.87 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1nqt h GLU 487 CO -0.05 -0.50 -0.20 0.87 -1.00 0.00 0.00 179.01 178.13 1nqt h LYS 488 N -0.93 -0.28 -0.86 2.33 1.57 -0.71 0.54 116.57 118.24 1nqt h LYS 488 Ca -0.08 0.02 0.21 0.00 -1.87 0.00 0.00 60.65 58.92 1nqt h LYS 488 Cb 0.67 0.06 -0.12 0.00 0.08 0.00 0.00 32.23 32.92 1nqt h LYS 488 CO 0.14 -0.18 0.32 0.28 -0.57 0.00 0.00 179.45 179.44 1nqt h VAL 489 N -0.29 0.46 0.00 0.50 2.07 -1.18 -2.02 116.25 115.80 1nqt h VAL 489 Ca -0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1nqt h VAL 489 Cb 0.29 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1nqt h VAL 489 CO -0.11 0.06 0.00 0.33 0.02 0.00 0.00 177.57 177.87 1nqt n PHE 490 N -5.10 0.00 -0.05 1.57 7.35 -0.37 -2.37 117.46 118.50 1nqt n PHE 490 Ca 0.20 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.90 1nqt n PHE 490 Cb 0.61 -0.29 0.02 0.00 0.35 0.00 0.00 39.48 40.17 1nqt n PHE 490 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 1nqt n LYS 491 N -1.49 -0.01 0.45 -4.13 4.81 0.18 0.81 118.16 118.77 1nqt n LYS 491 Ca 0.00 0.21 -0.18 0.00 -0.87 0.00 0.00 58.31 57.47 1nqt n LYS 491 Cb 0.00 -0.31 -0.09 0.00 0.02 0.00 0.00 35.03 34.65 1nqt n LYS 491 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1nqt h VAL 492 N 0.00 0.07 -0.20 3.15 2.07 -1.20 0.58 116.25 120.73 1nqt h VAL 492 Ca 0.06 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1nqt h VAL 492 Cb 0.10 0.08 -0.07 0.00 -1.52 0.00 0.00 31.29 29.88 1nqt h VAL 492 CO -0.14 0.00 -0.37 1.88 0.02 0.00 0.00 177.57 178.97 1nqt h TYR 493 N -1.25 -1.04 -0.85 1.57 0.05 0.78 -2.51 116.97 113.73 1nqt h TYR 493 Ca -0.12 0.05 0.07 0.00 0.05 0.00 0.00 58.73 58.78 1nqt h TYR 493 Cb 0.89 0.48 -0.07 0.00 1.01 0.00 0.00 36.73 39.04 1nqt h TYR 493 CO -0.00 -0.43 0.51 -0.97 -1.05 0.00 0.00 178.16 176.22 1nqt h ASN 494 N -0.40 0.78 -1.17 3.88 -0.73 -1.22 -2.09 115.58 114.63 1nqt h ASN 494 Ca 0.10 0.03 -0.72 0.00 1.87 0.00 0.00 56.30 57.58 1nqt h ASN 494 Cb 0.58 -0.13 -0.12 0.00 0.27 0.00 0.00 38.32 38.92 1nqt h ASN 494 CO -0.42 0.48 2.14 -0.62 -0.37 0.00 0.00 177.43 178.64 1nqt n GLU 495 N -4.66 3.29 0.00 6.67 1.02 0.19 -4.19 120.64 122.96 1nqt n GLU 495 Ca 0.13 -3.35 0.00 0.00 -0.02 0.00 0.00 57.16 53.92 1nqt n GLU 495 Cb 0.21 -3.16 0.00 0.00 -0.02 0.00 0.00 31.44 28.47 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 5.83 0.00 0.00 0.62 0.00 -1.21 -4.86 120.51 120.90 1nqt n ALA 496 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1nqt n ALA 496 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 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 0.00 -1.39 0.00 0.00 0.00 0.18 -4.56 105.19 99.42 1nqt n GLY 497 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.74 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 0.01 1.61 0.24 -1.26 -4.67 118.33 114.26 1nqt n VAL 498 Ca 0.00 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.39 1nqt n VAL 498 Cb 0.00 0.00 0.21 0.00 -1.47 0.00 0.00 33.84 32.58 1nqt n VAL 498 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1nqt n THR 499 N 0.00 0.72 -1.70 3.34 -1.04 -1.26 -3.21 114.28 111.12 1nqt n THR 499 Ca 0.00 -0.86 0.05 0.00 -2.04 0.00 0.00 64.05 61.20 1nqt n THR 499 Cb 0.00 0.75 0.07 0.00 -1.82 0.00 0.00 70.33 69.33 1nqt n THR 499 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1nqt n PHE 500 N 1.18 0.00 0.00 -1.42 0.99 -1.26 -5.31 117.46 111.64 1nqt n PHE 500 Ca 0.17 -0.55 0.00 0.00 -0.00 0.00 0.00 57.45 57.07 1nqt n PHE 500 Cb 0.53 -0.12 0.00 0.00 -1.00 0.00 0.00 39.48 38.89 1nqt n PHE 500 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01