#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 2.67 0.52 0.11 0.04 -1.26 -5.13 135.00 131.96 1nqt s PRO 7 Ca 0.00 -1.21 -0.16 0.00 0.04 0.00 0.00 61.00 59.67 1nqt s PRO 7 Cb 0.00 -2.40 -0.08 0.00 0.04 0.00 0.00 34.50 32.06 1nqt s PRO 7 CO 0.00 0.37 0.99 0.54 0.04 0.00 0.00 177.00 178.94 1nqt s ASN 8 N -3.79 6.57 0.26 6.66 4.22 -1.26 -4.88 114.94 122.72 1nqt s ASN 8 Ca 0.33 1.57 -0.09 0.00 -2.14 0.00 0.00 52.86 52.54 1nqt s ASN 8 Cb -0.07 -2.51 0.42 0.00 1.28 0.00 0.00 41.25 40.37 1nqt s ASN 8 CO 0.23 -0.62 1.58 2.19 -2.04 0.00 0.00 177.10 178.44 1nqt h PHE 9 N 0.85 -0.44 -0.01 1.54 -5.15 -1.98 -1.47 116.94 110.28 1nqt h PHE 9 Ca -0.47 0.08 0.03 0.00 -0.20 0.00 0.00 57.97 57.41 1nqt h PHE 9 Cb 1.19 0.34 -0.06 0.00 0.22 0.00 0.00 35.95 37.64 1nqt h PHE 9 CO 0.64 -0.39 -0.50 0.35 -2.00 0.00 0.00 178.31 176.41 1nqt h PHE 10 N 0.00 -1.45 -0.58 6.09 3.57 -1.91 -0.75 116.94 121.92 1nqt h PHE 10 Ca 0.44 0.05 0.12 0.00 3.53 0.00 0.00 57.97 62.11 1nqt h PHE 10 Cb 0.69 0.63 -0.11 0.00 2.79 0.00 0.00 35.95 39.96 1nqt h PHE 10 CO -0.68 -0.55 -0.11 0.87 -2.23 0.00 0.00 178.31 175.61 1nqt h LYS 11 N -0.64 0.02 0.06 1.11 1.79 -1.67 0.89 116.57 118.14 1nqt h LYS 11 Ca 0.03 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1nqt h LYS 11 Cb 0.70 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 1nqt h LYS 11 CO -0.35 0.02 -0.11 0.52 -1.08 0.00 0.00 179.45 178.45 1nqt h MET 12 N 0.02 -0.17 -0.74 3.15 2.86 -0.77 -0.06 114.93 119.21 1nqt h MET 12 Ca 0.28 0.01 0.17 0.00 -2.06 0.00 0.00 59.70 58.10 1nqt h MET 12 Cb 0.44 0.04 -0.12 0.00 0.06 0.00 0.00 31.60 32.02 1nqt h MET 12 CO -0.57 -0.12 0.06 0.28 1.06 0.00 0.00 176.91 177.62 1nqt h VAL 13 N -0.18 0.39 -0.62 -2.22 2.07 -0.73 1.28 116.25 116.24 1nqt h VAL 13 Ca -0.01 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.50 1nqt h VAL 13 Cb 0.17 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1nqt h VAL 13 CO -0.04 0.03 0.37 -0.08 0.02 0.00 0.00 177.57 177.86 1nqt h GLU 14 N 0.14 0.69 0.05 1.57 4.81 -0.70 0.06 114.58 121.20 1nqt h GLU 14 Ca 0.41 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 1nqt h GLU 14 Cb 0.73 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1nqt h GLU 14 CO -0.62 0.46 -0.09 0.78 -0.73 0.00 0.00 179.01 178.81 1nqt h GLY 15 N 0.71 -1.03 -0.56 1.92 0.00 0.34 0.13 103.07 104.58 1nqt h GLY 15 Ca 0.26 0.46 0.07 0.00 0.00 0.00 0.00 47.33 48.11 1nqt h GLY 15 CO -0.12 -0.37 -0.27 0.69 0.00 0.00 0.00 176.54 176.46 1nqt n PHE 16 N -2.88 -0.11 -0.18 5.60 0.99 0.12 0.10 117.46 121.10 1nqt n PHE 16 Ca -0.02 0.70 -0.05 0.00 -0.00 0.00 0.00 57.45 58.08 1nqt n PHE 16 Cb 0.07 -0.63 0.04 0.00 -1.00 0.00 0.00 39.48 37.97 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 0.62 -0.74 1.38 3.57 -0.42 -1.83 116.94 119.52 1nqt h PHE 17 Ca 0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1nqt h PHE 17 Cb 0.28 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1nqt h PHE 17 CO -0.54 0.36 0.28 -0.44 -2.23 0.00 0.00 178.31 175.74 1nqt h ASP 18 N 0.66 1.04 0.19 0.41 3.32 0.35 -0.19 116.42 122.20 1nqt h ASP 18 Ca 0.22 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.10 1nqt h ASP 18 Cb 0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 1nqt h ASP 18 CO -0.09 0.94 -0.30 0.03 -1.72 0.00 0.00 179.24 178.10 1nqt h ARG 19 N 1.08 -0.54 -0.70 3.56 3.08 0.08 -1.80 114.38 119.14 1nqt h ARG 19 Ca 0.25 0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.26 1nqt h ARG 19 Cb 0.24 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 1nqt h ARG 19 CO -0.02 -0.36 0.15 0.78 -1.07 0.00 0.00 179.97 179.45 1nqt h GLY 20 N -0.56 1.22 0.46 0.04 0.00 -1.36 -2.11 103.07 100.76 1nqt h GLY 20 Ca 0.01 -0.79 0.13 0.00 0.00 0.00 0.00 47.33 46.69 1nqt h GLY 20 CO -0.13 0.73 0.62 0.00 0.00 0.00 0.00 176.54 177.76 1nqt h ALA 21 N 1.08 1.61 0.05 3.60 0.00 -0.71 0.13 119.26 125.02 1nqt h ALA 21 Ca 0.22 0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.92 1nqt h ALA 21 Cb 0.40 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1nqt h ALA 21 CO 0.01 0.13 -0.93 1.03 0.00 0.00 0.00 179.25 179.49 1nqt h SER 22 N 0.90 0.73 0.07 0.00 0.87 -1.04 -2.30 113.55 112.78 1nqt h SER 22 Ca 0.49 -0.80 -0.00 0.00 -1.23 0.00 0.00 61.79 60.25 1nqt h SER 22 Cb 0.58 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1nqt h SER 22 CO -0.26 1.44 -0.01 0.40 -0.53 0.00 0.00 176.83 177.87 1nqt h ILE 23 N 0.10 0.19 0.00 2.23 2.04 -0.60 -3.22 117.51 118.25 1nqt h ILE 23 Ca -0.13 -0.06 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 1nqt h ILE 23 Cb 1.63 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.74 1nqt h ILE 23 CO 0.18 0.01 -1.10 0.52 0.00 0.00 0.00 178.15 177.76 1nqt n VAL 24 N -3.34 1.48 0.00 1.67 0.31 0.36 -4.68 118.33 114.13 1nqt n VAL 24 Ca -0.03 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1nqt n VAL 24 Cb 0.09 -2.24 0.00 0.00 -0.91 0.00 0.00 33.84 30.78 1nqt n VAL 24 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1nqt n GLU 25 N -4.48 0.00 -0.03 5.55 2.13 -0.87 -0.82 120.64 122.12 1nqt n GLU 25 Ca -0.21 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.60 1nqt n GLU 25 Cb 0.51 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.21 1nqt n GLU 25 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1nqt h ASP 26 N 0.00 -0.25 0.00 4.31 3.32 -1.85 0.29 116.42 122.24 1nqt h ASP 26 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1nqt h ASP 26 Cb 0.00 0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1nqt h ASP 26 CO 0.00 -0.04 0.00 0.29 -1.72 0.00 0.00 179.24 177.77 1nqt n LYS 27 N -3.14 0.36 -0.09 3.56 4.76 0.00 -0.43 118.16 123.18 1nqt n LYS 27 Ca -0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.56 1nqt n LYS 27 Cb 0.04 -1.40 0.24 0.00 -1.84 0.00 0.00 35.03 32.07 1nqt n LYS 27 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1nqt n LEU 28 N -0.90 2.81 0.02 -0.35 7.94 0.99 -4.28 117.00 123.22 1nqt n LEU 28 Ca 0.07 -1.10 0.00 0.00 -1.11 0.00 0.00 56.01 53.87 1nqt n LEU 28 Cb 0.03 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 43.86 1nqt n LEU 28 CO 0.05 0.55 -0.32 0.52 -1.11 0.00 0.00 177.39 177.08 1nqt n VAL 29 N 1.12 0.32 0.00 1.96 0.31 0.43 -4.71 118.33 117.76 1nqt n VAL 29 Ca 0.17 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1nqt n VAL 29 Cb 0.53 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 1nqt n VAL 29 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1nqt n GLU 30 N -3.11 0.00 -0.55 5.55 0.28 -1.00 -2.68 120.64 119.13 1nqt n GLU 30 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.92 1nqt n GLU 30 Cb 0.32 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 33.11 1nqt n GLU 30 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1nqt n ASP 31 N 0.00 2.98 0.00 -1.84 3.85 -1.26 -1.31 116.55 118.97 1nqt n ASP 31 Ca 0.00 -2.05 0.00 0.00 -0.71 0.00 0.00 54.79 52.03 1nqt n ASP 31 Cb 0.00 -0.79 0.00 0.00 -1.35 0.00 0.00 41.12 38.98 1nqt n ASP 31 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 1nqt n LEU 32 N 2.84 0.00 -0.13 -2.12 0.00 -1.26 -4.99 117.00 111.34 1nqt n LEU 32 Ca 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 56.01 56.26 1nqt n LEU 32 Cb 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.89 1nqt n LEU 32 CO 0.22 0.07 0.01 -2.11 0.00 0.00 0.00 177.39 175.58 1nqt n ARG 33 N 0.00 0.00 -0.32 1.96 -4.01 -0.68 -4.95 116.66 108.66 1nqt n ARG 33 Ca 0.00 -0.01 0.04 0.00 -1.04 0.00 0.00 57.85 56.85 1nqt n ARG 33 Cb 0.09 0.12 0.18 0.00 -3.04 0.00 0.00 32.46 29.81 1nqt n ARG 33 CO 0.00 0.00 0.00 -2.37 -3.04 0.00 0.00 177.63 172.22 1nqt n THR 34 N 0.00 0.96 0.09 8.89 5.66 -0.43 -3.89 114.28 125.56 1nqt n THR 34 Ca -0.00 -0.58 0.10 0.00 -3.05 0.00 0.00 64.05 60.52 1nqt n THR 34 Cb 0.07 -0.13 0.21 0.00 -1.55 0.00 0.00 70.33 68.93 1nqt n THR 34 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 1nqt n ARG 35 N 0.39 2.43 0.00 1.09 3.00 -1.26 -4.28 116.66 118.04 1nqt n ARG 35 Ca 0.13 -2.22 0.00 0.00 -0.00 0.00 0.00 57.85 55.75 1nqt n ARG 35 Cb 0.53 -1.45 0.00 0.00 0.00 0.00 0.00 32.46 31.54 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 1.27 0.45 -0.22 -0.14 0.28 -1.25 -5.12 120.64 115.91 1nqt n GLU 36 Ca 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 1nqt n GLU 36 Cb 0.55 -0.90 0.00 0.00 1.43 0.00 0.00 31.44 32.52 1nqt n GLU 36 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1nqt n SER 37 N -2.21 0.00 -4.56 -1.84 2.88 -1.25 -4.96 113.62 101.68 1nqt n SER 37 Ca 0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 1nqt n SER 37 Cb 0.40 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.75 1nqt n SER 37 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1nqt s GLU 38 N 0.00 3.71 -0.02 -1.46 8.01 -1.26 -4.62 118.70 123.06 1nqt s GLU 38 Ca 0.00 -0.44 0.00 0.00 0.01 0.00 0.00 54.97 54.54 1nqt s GLU 38 Cb 0.00 -3.74 0.00 0.00 -4.31 0.00 0.00 34.13 26.08 1nqt s GLU 38 CO 0.00 -0.35 0.00 0.39 0.01 0.00 0.00 175.26 175.31 1nqt n GLU 39 N 5.15 -1.85 -0.97 1.61 1.02 -1.26 -2.48 120.64 121.87 1nqt n GLU 39 Ca -0.12 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1nqt n GLU 39 Cb 0.51 -2.86 0.00 0.00 -0.02 0.00 0.00 31.44 29.06 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 -0.12 -1.63 -0.18 3.49 -0.06 -1.26 -4.75 117.38 112.86 1nqt n GLN 40 Ca -0.00 0.41 0.02 0.00 -2.00 0.00 0.00 57.00 55.42 1nqt n GLN 40 Cb 0.03 -4.73 0.09 0.00 -4.06 0.00 0.00 30.24 21.57 1nqt n GLN 40 CO 0.00 0.00 0.00 0.36 -0.20 0.00 0.00 177.06 177.22 1nqt n LYS 41 N 0.34 1.79 0.00 3.69 2.85 -1.04 -2.87 118.16 122.92 1nqt n LYS 41 Ca 0.00 -0.67 0.14 0.00 -1.05 0.00 0.00 58.31 56.72 1nqt n LYS 41 Cb 0.41 -1.59 0.49 0.00 -0.65 0.00 0.00 35.03 33.68 1nqt n LYS 41 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1nqt n ARG 42 N 0.11 1.06 0.00 -1.58 5.12 -1.26 -1.81 116.66 118.31 1nqt n ARG 42 Ca 0.06 -0.57 0.12 0.00 -1.93 0.00 0.00 57.85 55.54 1nqt n ARG 42 Cb 0.41 -1.49 0.25 0.00 -1.16 0.00 0.00 32.46 30.48 1nqt n ARG 42 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1nqt n ASN 43 N -0.48 1.25 -0.77 0.55 5.15 -1.14 -3.11 115.26 116.72 1nqt n ASN 43 Ca 0.15 -1.02 0.13 0.00 -0.60 0.00 0.00 54.58 53.24 1nqt n ASN 43 Cb 0.33 0.26 0.26 0.00 -0.53 0.00 0.00 39.78 40.10 1nqt n ASN 43 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1nqt n ARG 44 N -0.57 2.07 -1.28 1.20 1.74 -0.75 -3.67 116.66 115.39 1nqt n ARG 44 Ca 0.11 -1.55 -0.26 0.00 -0.77 0.00 0.00 57.85 55.37 1nqt n ARG 44 Cb 0.38 -1.47 0.13 0.00 -1.02 0.00 0.00 32.46 30.48 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1nqt n VAL 45 N 0.89 3.26 0.82 1.55 3.14 -1.18 -3.79 118.33 123.01 1nqt n VAL 45 Ca 0.16 -2.64 0.12 0.00 -2.96 0.00 0.00 64.34 59.02 1nqt n VAL 45 Cb 0.50 -0.80 0.13 0.00 -1.06 0.00 0.00 33.84 32.61 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 -1.02 2.33 0.24 1.45 1.85 -1.24 -3.99 116.66 116.28 1nqt n ARG 46 Ca 0.57 -2.00 0.11 0.00 -1.00 0.00 0.00 57.85 55.53 1nqt n ARG 46 Cb 1.11 -1.47 0.56 0.00 -1.05 0.00 0.00 32.46 31.62 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 4.59 0.00 0.20 2.89 0.00 -1.87 -2.54 103.07 106.33 1nqt h GLY 47 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 1nqt h GLY 47 CO 0.00 0.00 -0.04 -2.22 0.00 0.00 0.00 176.54 174.28 1nqt h ILE 48 N 0.00 0.61 -0.14 2.60 1.08 -1.90 0.22 117.51 119.99 1nqt h ILE 48 Ca -0.00 -0.02 -0.04 0.00 -0.39 0.00 0.00 64.86 64.40 1nqt h ILE 48 Cb 0.59 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1nqt h ILE 48 CO 0.02 0.01 -0.12 -0.07 -0.69 0.00 0.00 178.15 177.31 1nqt h LEU 49 N 0.06 0.20 -1.72 1.44 4.07 -1.75 0.45 115.31 118.06 1nqt h LEU 49 Ca 0.22 -0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.12 1nqt h LEU 49 Cb 0.33 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.02 1nqt h LEU 49 CO -0.41 0.35 -0.13 -0.09 -1.08 0.00 0.00 178.44 177.08 1nqt h ARG 50 N 0.21 0.00 0.13 1.13 2.43 -0.60 -1.17 114.38 116.50 1nqt h ARG 50 Ca 0.04 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.87 1nqt h ARG 50 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1nqt h ARG 50 CO 0.02 0.13 -1.79 0.82 -1.51 0.00 0.00 179.97 177.64 1nqt h ILE 51 N 0.00 0.85 -0.80 1.20 2.04 0.20 -3.37 117.51 117.63 1nqt h ILE 51 Ca -0.00 -2.53 -0.04 0.00 1.00 0.00 0.00 64.86 63.29 1nqt h ILE 51 Cb 0.45 2.62 -0.04 0.00 -0.74 0.00 0.00 36.82 39.11 1nqt h ILE 51 CO 0.02 0.82 0.35 0.40 0.00 0.00 0.00 178.15 179.74 1nqt h ILE 52 N 0.07 1.26 -0.18 -0.67 2.04 -0.13 -3.31 117.51 116.60 1nqt h ILE 52 Ca -0.34 -0.77 0.04 0.00 1.00 0.00 0.00 64.86 64.78 1nqt h ILE 52 Cb 2.05 0.26 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 1nqt h ILE 52 CO 0.13 0.32 -0.50 0.50 0.00 0.00 0.00 178.15 178.60 1nqt h LYS 53 N 1.16 -0.50 -6.20 2.37 3.64 -1.40 -3.43 116.57 112.20 1nqt h LYS 53 Ca 0.27 0.03 -0.55 0.00 -1.27 0.00 0.00 60.65 59.13 1nqt h LYS 53 Cb 0.17 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 1nqt h LYS 53 CO -0.03 -0.34 0.11 -1.25 -2.27 0.00 0.00 179.45 175.68 1nqt s PRO 54 N -5.78 4.45 -0.03 1.90 0.04 -1.25 -4.99 135.00 129.35 1nqt s PRO 54 Ca -0.15 0.97 -0.37 0.00 0.04 0.00 0.00 61.00 61.48 1nqt s PRO 54 Cb 0.08 -3.38 -0.16 0.00 0.04 0.00 0.00 34.50 31.09 1nqt s PRO 54 CO 0.63 0.25 1.53 0.00 0.04 0.00 0.00 177.00 179.45 1nqt h ASN 56 N 5.86 0.66 -4.61 0.00 2.35 -1.36 -3.46 115.58 115.03 1nqt h ASN 56 Ca -0.47 -0.29 -0.24 0.00 -0.55 0.00 0.00 56.30 54.75 1nqt h ASN 56 Cb 1.32 -0.19 -0.23 0.00 0.05 0.00 0.00 38.32 39.27 1nqt h ASN 56 CO 0.86 0.98 -0.72 -1.00 -1.65 0.00 0.00 177.43 175.89 1nqt s HIS 57 N -4.30 0.44 -0.24 1.19 3.76 -1.15 -5.06 115.29 109.93 1nqt s HIS 57 Ca -0.08 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.39 1nqt s HIS 57 Cb 0.12 -0.28 0.13 0.00 1.11 0.00 0.00 32.58 33.66 1nqt s HIS 57 CO 0.83 -0.10 0.44 0.54 -0.85 0.00 0.00 174.74 175.60 1nqt s VAL 58 N -1.09 -0.70 -0.22 -0.90 0.11 -1.26 -1.58 120.40 114.76 1nqt s VAL 58 Ca -0.09 0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 58.86 1nqt s VAL 58 Cb -0.08 -0.81 -0.05 0.00 -1.53 0.00 0.00 36.38 33.91 1nqt s VAL 58 CO -0.00 -0.04 0.19 -0.22 -3.33 0.00 0.00 175.10 171.69 1nqt s LEU 59 N 2.63 4.15 -0.08 2.54 2.96 -0.75 -4.98 118.68 125.15 1nqt s LEU 59 Ca 0.09 0.20 0.03 0.00 -0.22 0.00 0.00 54.13 54.23 1nqt s LEU 59 Cb -0.14 -2.16 -0.02 0.00 0.50 0.00 0.00 46.19 44.37 1nqt s LEU 59 CO -0.16 0.07 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.34 1nqt s SER 60 N 0.88 3.80 -0.00 3.68 0.01 -1.26 -1.59 113.70 119.21 1nqt s SER 60 Ca 0.09 -0.32 -0.06 0.00 1.31 0.00 0.00 55.95 56.97 1nqt s SER 60 Cb -0.13 -1.13 0.00 0.00 0.21 0.00 0.00 66.02 64.97 1nqt s SER 60 CO 0.03 0.26 0.12 -0.76 0.41 0.00 0.00 173.24 173.30 1nqt s LEU 61 N -0.20 1.60 -0.09 2.44 1.02 -0.03 -5.00 118.68 118.43 1nqt s LEU 61 Ca -0.00 -0.18 0.02 0.00 0.02 0.00 0.00 54.13 53.98 1nqt s LEU 61 Cb -0.13 0.61 -0.02 0.00 0.02 0.00 0.00 46.19 46.67 1nqt s LEU 61 CO 0.03 -0.33 -0.15 -0.44 0.02 0.00 0.00 176.35 175.48 1nqt s SER 62 N -1.24 3.88 -0.26 2.29 0.01 -1.25 -0.98 113.70 116.14 1nqt s SER 62 Ca -0.13 -0.31 -0.10 0.00 1.31 0.00 0.00 55.95 56.72 1nqt s SER 62 Cb -0.07 -1.23 0.11 0.00 0.21 0.00 0.00 66.02 65.04 1nqt s SER 62 CO 0.01 0.24 0.57 0.72 0.41 0.00 0.00 173.24 175.19 1nqt s PHE 63 N -0.12 -1.09 1.01 2.43 -0.12 0.51 -4.92 117.98 115.68 1nqt s PHE 63 Ca -0.02 1.99 -0.12 0.00 -0.05 0.00 0.00 56.93 58.73 1nqt s PHE 63 Cb -0.14 0.59 0.19 0.00 -0.63 0.00 0.00 43.02 43.04 1nqt s PHE 63 CO 0.04 -0.57 1.08 -1.25 -0.05 0.00 0.00 175.22 174.46 1nqt s PRO 64 N 2.55 0.33 -0.27 1.99 0.04 -1.26 -1.88 135.00 136.50 1nqt s PRO 64 Ca -0.05 0.89 -0.23 0.00 0.04 0.00 0.00 61.00 61.65 1nqt s PRO 64 Cb -0.11 -1.70 0.08 0.00 0.04 0.00 0.00 34.50 32.82 1nqt s PRO 64 CO -0.17 -2.89 0.77 0.96 0.04 0.00 0.00 177.00 175.71 1nqt s ILE 65 N -2.73 0.00 -0.65 0.56 -4.36 -0.52 -4.87 121.20 108.63 1nqt s ILE 65 Ca 0.66 0.00 -0.20 0.00 -0.26 0.00 0.00 60.65 60.85 1nqt s ILE 65 Cb -0.21 -1.00 0.09 0.00 1.25 0.00 0.00 42.46 42.59 1nqt s ILE 65 CO 0.60 0.00 0.84 -0.60 0.24 0.00 0.00 174.94 176.02 1nqt s ARG 66 N 0.65 3.12 0.82 0.37 3.52 -1.26 -2.13 118.95 124.04 1nqt s ARG 66 Ca -0.02 -1.18 -0.16 0.00 -0.13 0.00 0.00 55.73 54.25 1nqt s ARG 66 Cb -0.05 -4.30 -0.05 0.00 -1.56 0.00 0.00 34.95 28.99 1nqt s ARG 66 CO -0.05 -1.67 0.16 0.54 -0.81 0.00 0.00 175.30 173.47 1nqt n ARG 67 N 6.87 0.04 -0.27 5.12 1.74 -0.03 -4.75 116.66 125.38 1nqt n ARG 67 Ca -0.04 0.05 0.07 0.00 -0.77 0.00 0.00 57.85 57.15 1nqt n ARG 67 Cb 0.44 -1.58 0.21 0.00 -1.02 0.00 0.00 32.46 30.51 1nqt n ARG 67 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1nqt h ASP 68 N -0.79 0.30 -0.71 0.55 5.19 -1.96 -0.61 116.42 118.39 1nqt h ASP 68 Ca -0.44 0.12 0.12 0.00 -0.62 0.00 0.00 57.03 56.20 1nqt h ASP 68 Cb 1.33 0.09 -0.05 0.00 0.18 0.00 0.00 39.33 40.89 1nqt h ASP 68 CO 0.36 0.10 0.47 -2.24 -3.12 0.00 0.00 179.24 174.81 1nqt h ASP 69 N 0.45 0.45 0.00 6.45 3.04 -2.03 -3.45 116.42 121.33 1nqt h ASP 69 Ca 0.44 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.25 1nqt h ASP 69 Cb 0.70 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 38.91 1nqt h ASP 69 CO -0.42 0.26 0.00 0.61 -2.04 0.00 0.00 179.24 177.64 1nqt n GLY 70 N -1.50 1.25 3.71 7.15 0.00 -0.24 -5.13 105.19 110.44 1nqt n GLY 70 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.98 3.20 -0.10 1.61 1.04 -1.26 -4.73 113.70 112.48 1nqt s SER 71 Ca 0.00 1.31 0.02 0.00 0.48 0.00 0.00 55.95 57.77 1nqt s SER 71 Cb 0.00 -1.99 -0.01 0.00 0.10 0.00 0.00 66.02 64.12 1nqt s SER 71 CO 0.00 -2.79 -0.17 0.26 0.98 0.00 0.00 173.24 171.52 1nqt s TRP 72 N -2.99 2.69 0.04 5.02 0.51 -1.26 -0.85 118.94 122.10 1nqt s TRP 72 Ca 0.64 -0.59 0.02 0.00 -2.12 0.00 0.00 56.10 54.05 1nqt s TRP 72 Cb -0.18 -1.74 -0.02 0.00 -0.81 0.00 0.00 33.47 30.72 1nqt s TRP 72 CO 0.57 -0.14 -0.08 -2.00 -0.51 0.00 0.00 176.95 174.78 1nqt s GLU 73 N 0.01 0.53 -0.13 4.98 2.12 -0.90 -4.97 118.70 120.34 1nqt s GLU 73 Ca -0.06 -0.75 -0.06 0.00 0.36 0.00 0.00 54.97 54.46 1nqt s GLU 73 Cb -0.15 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 33.90 1nqt s GLU 73 CO 0.05 0.06 0.10 0.14 -0.54 0.00 0.00 175.26 175.07 1nqt s VAL 74 N -1.34 5.19 0.03 3.70 -7.23 -1.26 -1.44 120.40 118.06 1nqt s VAL 74 Ca -0.09 0.10 0.05 0.00 -1.81 0.00 0.00 61.98 60.22 1nqt s VAL 74 Cb -0.10 -3.27 -0.03 0.00 0.56 0.00 0.00 36.38 33.54 1nqt s VAL 74 CO 0.00 0.58 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.65 1nqt s ILE 75 N -0.68 3.45 0.12 -0.62 1.09 -0.79 -4.89 121.20 118.88 1nqt s ILE 75 Ca 0.13 -0.96 0.10 0.00 -1.10 0.00 0.00 60.65 58.82 1nqt s ILE 75 Cb -0.12 -2.52 -0.04 0.00 -1.06 0.00 0.00 42.46 38.72 1nqt s ILE 75 CO 0.02 0.32 -0.23 -1.83 -0.10 0.00 0.00 174.94 173.12 1nqt s GLU 76 N -1.61 1.59 -0.09 2.79 -1.05 -1.26 -0.37 118.70 118.70 1nqt s GLU 76 Ca 0.18 -1.26 -0.31 0.00 -0.15 0.00 0.00 54.97 53.43 1nqt s GLU 76 Cb -0.11 -2.00 0.12 0.00 -0.44 0.00 0.00 34.13 31.70 1nqt s GLU 76 CO 0.09 0.47 1.00 0.20 0.95 0.00 0.00 175.26 177.97 1nqt s GLY 77 N -2.01 -0.37 0.10 -3.83 0.00 -0.15 -1.65 107.32 99.41 1nqt s GLY 77 Ca 0.15 1.41 -0.01 0.00 0.00 0.00 0.00 44.72 46.28 1nqt s GLY 77 CO 0.07 0.55 0.01 -0.19 0.00 0.00 0.00 173.10 173.54 1nqt s TYR 78 N -2.48 0.76 -0.06 1.90 1.51 0.23 -0.85 117.35 118.37 1nqt s TYR 78 Ca 0.05 -1.14 -0.02 0.00 -1.01 0.00 0.00 57.07 54.95 1nqt s TYR 78 Cb -0.01 -0.47 0.04 0.00 -0.11 0.00 0.00 41.96 41.41 1nqt s TYR 78 CO -0.06 -0.42 0.11 0.50 -1.11 0.00 0.00 175.55 174.57 1nqt s ARG 79 N -3.98 0.02 -0.08 -0.62 6.06 -0.62 0.15 118.95 119.87 1nqt s ARG 79 Ca 0.17 0.38 0.04 0.00 -2.50 0.00 0.00 55.73 53.82 1nqt s ARG 79 Cb 0.07 -0.28 -0.01 0.00 0.06 0.00 0.00 34.95 34.80 1nqt s ARG 79 CO -0.03 -0.23 -0.22 0.00 -2.50 0.00 0.00 175.30 172.32 1nqt s ALA 80 N 1.62 2.28 -0.25 6.12 0.00 0.20 -1.80 121.76 129.92 1nqt s ALA 80 Ca -0.03 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 50.85 1nqt s ALA 80 Cb -0.12 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 1nqt s ALA 80 CO -0.05 0.36 0.11 -0.65 0.00 0.00 0.00 175.76 175.53 1nqt s GLN 81 N 0.05 3.80 -0.09 0.00 -0.21 -0.61 -1.09 119.66 121.51 1nqt s GLN 81 Ca -0.09 -0.40 -0.27 0.00 0.02 0.00 0.00 55.36 54.62 1nqt s GLN 81 Cb -0.15 -3.42 -0.25 0.00 1.00 0.00 0.00 33.01 30.19 1nqt s GLN 81 CO 0.06 -0.11 0.94 1.25 -2.12 0.00 0.00 175.29 175.30 1nqt h HIS 82 N 8.03 0.10 -4.23 0.91 -0.00 0.57 -3.00 115.15 117.52 1nqt h HIS 82 Ca -0.37 -0.06 -0.14 0.00 -0.00 0.00 0.00 60.37 59.80 1nqt h HIS 82 Cb 1.18 -0.01 -0.15 0.00 -0.00 0.00 0.00 27.41 28.43 1nqt h HIS 82 CO 0.68 0.91 -0.68 0.45 -0.00 0.00 0.00 177.93 179.30 1nqt s SER 83 N -6.19 0.51 0.00 3.26 0.15 -1.24 -2.52 113.70 107.67 1nqt s SER 83 Ca -0.17 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 55.44 1nqt s SER 83 Cb -0.01 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1nqt s SER 83 CO 0.71 -0.61 0.07 1.41 1.20 0.00 0.00 173.24 176.02 1nqt n HIS 84 N 0.06 0.00 -0.31 3.44 -0.00 -1.26 -4.17 115.22 112.99 1nqt n HIS 84 Ca -0.12 0.00 0.26 0.00 -0.00 0.00 0.00 57.72 57.85 1nqt n HIS 84 Cb 0.61 0.00 0.43 0.00 -0.00 0.00 0.00 29.99 31.03 1nqt n HIS 84 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.34 177.28 1nqt n GLN 85 N -0.72 -0.02 -3.84 -0.41 7.27 -1.26 -1.87 117.38 116.52 1nqt n GLN 85 Ca 0.00 0.77 -0.30 0.00 0.07 0.00 0.00 57.00 57.53 1nqt n GLN 85 Cb 0.01 -1.53 -0.14 0.00 2.41 0.00 0.00 30.24 30.98 1nqt n GLN 85 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 1nqt s ARG 86 N -4.58 1.28 0.00 3.69 6.06 -1.26 -4.98 118.95 119.16 1nqt s ARG 86 Ca -0.04 -1.80 0.00 0.00 -2.50 0.00 0.00 55.73 51.39 1nqt s ARG 86 Cb 0.19 -2.64 0.00 0.00 0.06 0.00 0.00 34.95 32.56 1nqt s ARG 86 CO 0.51 -1.04 0.00 0.25 -2.50 0.00 0.00 175.30 172.52 1nqt n THR 87 N 4.05 0.00 -2.08 4.11 -2.24 -0.78 -1.06 114.28 116.28 1nqt n THR 87 Ca 0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.39 1nqt n THR 87 Cb 0.38 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 1nqt n THR 87 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1nqt s PRO 88 N 0.00 4.23 0.31 -0.78 0.04 -1.26 -4.68 135.00 132.86 1nqt s PRO 88 Ca 0.00 2.14 -0.28 0.00 0.04 0.00 0.00 61.00 62.90 1nqt s PRO 88 Cb 0.00 -3.64 -0.09 0.00 0.04 0.00 0.00 34.50 30.80 1nqt s PRO 88 CO 0.00 -0.68 1.03 0.00 0.04 0.00 0.00 177.00 177.39 1nqt s LYS 90 N -1.77 1.24 0.00 0.00 2.20 0.13 -0.15 119.74 121.39 1nqt s LYS 90 Ca 0.48 -1.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.02 1nqt s LYS 90 Cb -0.26 -1.45 0.00 0.00 -1.51 0.00 0.00 37.83 34.61 1nqt s LYS 90 CO 0.33 0.35 0.00 0.41 -0.36 0.00 0.00 175.35 176.08 1nqt n GLY 91 N 1.40 3.38 3.66 5.54 0.00 -1.23 0.08 105.19 118.02 1nqt n GLY 91 Ca -0.18 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1nqt n GLY 91 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nqt s GLY 92 N 0.00 1.62 -0.16 -0.02 0.00 -1.26 -2.96 107.32 104.54 1nqt s GLY 92 Ca 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.75 1nqt s GLY 92 CO 0.00 -0.13 -0.19 -0.42 0.00 0.00 0.00 173.10 172.36 1nqt s ILE 93 N -3.17 2.22 -0.17 0.90 1.01 0.36 -0.11 121.20 122.23 1nqt s ILE 93 Ca 0.71 -0.91 -0.02 0.00 0.00 0.00 0.00 60.65 60.43 1nqt s ILE 93 Cb -0.09 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 1nqt s ILE 93 CO 0.55 0.53 -0.09 -0.60 0.00 0.00 0.00 174.94 175.34 1nqt s ARG 94 N 1.01 3.39 -0.53 2.79 3.52 0.26 -3.74 118.95 125.67 1nqt s ARG 94 Ca -0.02 -0.65 -0.16 0.00 -0.13 0.00 0.00 55.73 54.77 1nqt s ARG 94 Cb -0.15 -2.82 0.11 0.00 -1.56 0.00 0.00 34.95 30.54 1nqt s ARG 94 CO -0.06 0.02 0.50 0.71 -0.81 0.00 0.00 175.30 175.67 1nqt s TYR 95 N 0.87 3.22 -0.27 5.12 4.12 -1.26 0.03 117.35 129.18 1nqt s TYR 95 Ca -0.02 -1.17 -0.26 0.00 0.02 0.00 0.00 57.07 55.64 1nqt s TYR 95 Cb -0.15 -3.69 0.14 0.00 -1.52 0.00 0.00 41.96 36.74 1nqt s TYR 95 CO 0.01 -1.00 1.15 0.45 0.02 0.00 0.00 175.55 176.17 1nqt s SER 96 N 3.39 -0.32 0.00 2.29 0.15 0.61 -4.64 113.70 115.17 1nqt s SER 96 Ca 0.04 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.29 1nqt s SER 96 Cb -0.28 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1nqt s SER 96 CO 0.04 -0.13 0.34 0.35 1.20 0.00 0.00 173.24 175.04 1nqt n THR 97 N 1.85 0.00 0.14 6.45 -2.24 -1.10 -2.35 114.28 117.03 1nqt n THR 97 Ca -0.11 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.71 1nqt n THR 97 Cb 0.56 -0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 1nqt n THR 97 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1nqt n ASP 98 N -0.46 2.05 -4.61 3.42 3.85 -1.26 -4.89 116.55 114.65 1nqt n ASP 98 Ca 0.00 -0.24 -0.48 0.00 -0.71 0.00 0.00 54.79 53.35 1nqt n ASP 98 Cb 0.00 1.28 -0.04 0.00 -1.35 0.00 0.00 41.12 41.01 1nqt n ASP 98 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 1nqt n VAL 99 N -1.62 0.66 -4.11 2.12 0.24 -0.99 -4.99 118.33 109.64 1nqt n VAL 99 Ca -0.01 -0.16 -0.15 0.00 -2.04 0.00 0.00 64.34 61.98 1nqt n VAL 99 Cb 0.21 -1.01 -0.12 0.00 -1.47 0.00 0.00 33.84 31.44 1nqt n VAL 99 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1nqt s SER 100 N 0.22 0.92 0.08 -1.34 1.04 -1.26 -4.83 113.70 108.53 1nqt s SER 100 Ca 0.75 -0.45 -0.22 0.00 0.48 0.00 0.00 55.95 56.51 1nqt s SER 100 Cb -0.82 -0.00 -0.08 0.00 0.10 0.00 0.00 66.02 65.22 1nqt s SER 100 CO 0.50 -0.12 1.36 0.58 0.98 0.00 0.00 173.24 176.53 1nqt h VAL 101 N 4.60 0.00 -1.79 5.02 2.07 -1.99 0.66 116.25 124.82 1nqt h VAL 101 Ca -0.35 0.00 0.53 0.00 0.82 0.00 0.00 66.70 67.71 1nqt h VAL 101 Cb 1.20 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.88 1nqt h VAL 101 CO 0.43 0.00 1.26 0.44 0.02 0.00 0.00 177.57 179.72 1nqt h ASP 102 N -0.36 0.05 0.05 0.57 3.45 -1.99 -0.01 116.42 118.17 1nqt h ASP 102 Ca 0.02 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.51 1nqt h ASP 102 Cb 0.43 0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1nqt h ASP 102 CO -0.30 -0.05 -0.02 -0.08 -1.57 0.00 0.00 179.24 177.22 1nqt h GLU 103 N 0.01 -0.06 -0.82 3.56 4.81 -0.12 -2.74 114.58 119.21 1nqt h GLU 103 Ca 0.89 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 60.31 1nqt h GLU 103 Cb 3.44 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 32.68 1nqt h GLU 103 CO -0.10 -0.04 -0.10 -0.39 -0.73 0.00 0.00 179.01 177.65 1nqt h VAL 104 N -0.11 0.21 -0.22 0.32 -1.51 0.17 0.57 116.25 115.68 1nqt h VAL 104 Ca -0.01 -0.01 0.04 0.00 -1.23 0.00 0.00 66.70 65.49 1nqt h VAL 104 Cb 0.05 0.17 -0.07 0.00 -2.13 0.00 0.00 31.29 29.30 1nqt h VAL 104 CO 0.01 0.01 -0.52 0.11 -1.23 0.00 0.00 177.57 175.95 1nqt h LYS 105 N 0.04 -0.49 -0.58 5.19 1.57 -1.27 0.45 116.57 121.48 1nqt h LYS 105 Ca 0.43 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.34 1nqt h LYS 105 Cb 0.74 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 33.09 1nqt h LYS 105 CO -0.79 -0.32 0.18 0.00 -0.57 0.00 0.00 179.45 177.95 1nqt h ALA 106 N -0.10 0.73 -0.47 3.86 0.00 0.40 -0.19 119.26 123.48 1nqt h ALA 106 Ca 0.06 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1nqt h ALA 106 Cb 0.65 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1nqt h ALA 106 CO -0.48 -0.24 -0.21 -0.07 0.00 0.00 0.00 179.25 178.25 1nqt h LEU 107 N 0.35 0.97 0.00 0.00 3.38 -0.56 -2.16 115.31 117.29 1nqt h LEU 107 Ca 0.30 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1nqt h LEU 107 Cb 0.39 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1nqt h LEU 107 CO -0.33 1.14 -0.01 0.00 0.09 0.00 0.00 178.44 179.33 1nqt h ALA 108 N 0.93 -0.56 -0.50 1.53 0.00 0.74 -0.25 119.26 121.15 1nqt h ALA 108 Ca 0.11 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.22 1nqt h ALA 108 Cb 0.77 0.46 -0.09 0.00 0.00 0.00 0.00 17.79 18.93 1nqt h ALA 108 CO 0.06 -0.57 0.24 0.45 0.00 0.00 0.00 179.25 179.44 1nqt n SER 109 N -2.52 0.15 -0.02 0.00 2.88 -0.16 0.82 113.62 114.76 1nqt n SER 109 Ca -0.00 0.83 -0.13 0.00 -1.33 0.00 0.00 58.87 58.24 1nqt n SER 109 Cb 0.01 -0.39 -0.10 0.00 -0.75 0.00 0.00 64.21 62.97 1nqt n SER 109 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1nqt h LEU 110 N 0.00 -0.01 -0.04 2.46 5.85 -0.43 -3.19 115.31 119.95 1nqt h LEU 110 Ca 0.41 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1nqt h LEU 110 Cb 1.07 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 1nqt h LEU 110 CO -0.39 0.54 -0.07 0.24 -0.34 0.00 0.00 178.44 178.42 1nqt h MET 111 N -0.56 -0.05 -0.23 1.25 2.86 0.17 0.25 114.93 118.62 1nqt h MET 111 Ca -0.00 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1nqt h MET 111 Cb 0.55 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.19 1nqt h MET 111 CO 0.00 -0.03 -0.13 2.41 1.06 0.00 0.00 176.91 180.21 1nqt n THR 112 N -2.98 -0.15 -0.05 2.22 -1.04 -1.02 0.20 114.28 111.45 1nqt n THR 112 Ca -0.01 0.56 -0.12 0.00 -2.04 0.00 0.00 64.05 62.45 1nqt n THR 112 Cb 0.04 -0.70 -0.06 0.00 -1.82 0.00 0.00 70.33 67.79 1nqt n THR 112 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1nqt h TYR 113 N 0.00 0.34 -0.02 -1.42 0.05 -1.32 -2.77 116.97 111.84 1nqt h TYR 113 Ca 0.04 -0.07 0.02 0.00 0.05 0.00 0.00 58.73 58.77 1nqt h TYR 113 Cb 0.10 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 37.71 1nqt h TYR 113 CO -0.24 0.58 -0.46 -0.22 -1.05 0.00 0.00 178.16 176.78 1nqt h LYS 114 N 0.01 -0.54 -0.81 4.88 3.64 0.58 -0.67 116.57 123.66 1nqt h LYS 114 Ca 0.04 0.04 0.15 0.00 -1.27 0.00 0.00 60.65 59.60 1nqt h LYS 114 Cb 0.47 0.12 -0.15 0.00 -0.41 0.00 0.00 32.23 32.26 1nqt h LYS 114 CO 0.02 -0.36 -0.29 0.00 -2.27 0.00 0.00 179.45 176.54 1nqt h ALA 116 N 1.49 1.28 0.03 0.00 0.00 -1.00 0.10 119.26 121.16 1nqt h ALA 116 Ca 0.34 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.36 1nqt h ALA 116 Cb 0.59 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1nqt h ALA 116 CO -0.85 -0.10 -0.46 0.28 0.00 0.00 0.00 179.25 178.12 1nqt h VAL 117 N 0.61 0.00 -0.01 0.00 2.07 0.19 -2.13 116.25 116.98 1nqt h VAL 117 Ca 0.47 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.99 1nqt h VAL 117 Cb 0.67 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1nqt h VAL 117 CO -0.37 0.00 0.00 1.33 0.02 0.00 0.00 177.57 178.55 1nqt n VAL 118 N -5.05 0.03 -3.77 2.57 0.24 -0.81 -4.79 118.33 106.75 1nqt n VAL 118 Ca -0.07 -0.02 -0.24 0.00 -2.04 0.00 0.00 64.34 61.97 1nqt n VAL 118 Cb 0.35 -0.12 0.02 0.00 -1.47 0.00 0.00 33.84 32.61 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 -0.33 -1.64 -4.37 -1.34 8.00 0.03 -4.97 116.55 111.93 1nqt n ASP 119 Ca 0.01 -0.91 -0.36 0.00 0.71 0.00 0.00 54.79 54.23 1nqt n ASP 119 Cb 0.08 -3.64 -0.13 0.00 -0.02 0.00 0.00 41.12 37.41 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 -3.73 3.91 -0.76 2.53 1.01 0.14 -5.01 120.40 118.49 1nqt s VAL 120 Ca 0.09 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 1nqt s VAL 120 Cb -0.03 -2.89 -0.10 0.00 0.00 0.00 0.00 36.38 33.36 1nqt s VAL 120 CO 0.84 0.26 2.44 -0.81 0.00 0.00 0.00 175.10 177.83 1nqt n PRO 121 N 4.87 2.16 -4.28 2.72 -0.04 -1.26 -4.16 135.00 135.01 1nqt n PRO 121 Ca -0.16 -1.35 -0.19 0.00 -0.04 0.00 0.00 63.50 61.76 1nqt n PRO 121 Cb 0.50 -2.32 -0.15 0.00 -0.04 0.00 0.00 33.50 31.48 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 2.61 0.79 0.63 0.54 2.99 -1.26 -4.58 117.98 119.70 1nqt s PHE 122 Ca 0.47 -0.19 -0.14 0.00 0.00 0.00 0.00 56.93 57.07 1nqt s PHE 122 Cb 0.15 -0.59 -0.02 0.00 0.00 0.00 0.00 43.02 42.56 1nqt s PHE 122 CO -0.03 -0.10 1.05 0.20 -0.00 0.00 0.00 175.22 176.34 1nqt s GLY 123 N 0.32 1.91 0.30 4.36 0.00 -0.23 -4.66 107.32 109.32 1nqt s GLY 123 Ca -0.04 0.23 -0.29 0.00 0.00 0.00 0.00 44.72 44.62 1nqt s GLY 123 CO 0.00 0.54 1.14 -0.32 0.00 0.00 0.00 173.10 174.46 1nqt s GLY 124 N -3.27 3.04 0.20 0.20 0.00 -1.26 0.21 107.32 106.44 1nqt s GLY 124 Ca 0.61 0.96 -0.13 0.00 0.00 0.00 0.00 44.72 46.16 1nqt s GLY 124 CO 0.45 1.57 0.42 0.00 0.00 0.00 0.00 173.10 175.53 1nqt s ALA 125 N -1.18 -0.41 -0.28 3.20 0.00 0.11 0.11 121.76 123.31 1nqt s ALA 125 Ca 0.46 -0.64 -0.22 0.00 0.00 0.00 0.00 51.96 51.56 1nqt s ALA 125 Cb -0.33 0.91 0.12 0.00 0.00 0.00 0.00 23.12 23.82 1nqt s ALA 125 CO 0.43 -0.76 0.98 0.21 0.00 0.00 0.00 175.76 176.63 1nqt s LYS 126 N -3.94 0.51 0.16 0.00 2.47 -0.25 -3.81 119.74 114.86 1nqt s LYS 126 Ca 0.15 0.67 0.09 0.00 -1.56 0.00 0.00 55.97 55.32 1nqt s LYS 126 Cb 0.01 0.21 -0.04 0.00 -1.46 0.00 0.00 37.83 36.55 1nqt s LYS 126 CO 0.01 -0.07 -0.19 0.00 0.16 0.00 0.00 175.35 175.26 1nqt s ALA 127 N 0.56 2.01 -0.05 3.13 0.00 0.84 0.60 121.76 128.86 1nqt s ALA 127 Ca -0.00 -1.46 -0.10 0.00 0.00 0.00 0.00 51.96 50.40 1nqt s ALA 127 Cb -0.05 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.89 1nqt s ALA 127 CO -0.09 0.27 0.23 0.20 0.00 0.00 0.00 175.76 176.37 1nqt s GLY 128 N -2.54 -0.11 -0.35 0.00 0.00 0.39 0.93 107.32 105.63 1nqt s GLY 128 Ca 0.15 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.24 1nqt s GLY 128 CO 0.06 0.24 0.14 0.14 0.00 0.00 0.00 173.10 173.68 1nqt s VAL 129 N -0.64 0.99 -0.75 1.40 1.01 0.11 0.74 120.40 123.26 1nqt s VAL 129 Ca -0.07 -1.75 -0.34 0.00 0.00 0.00 0.00 61.98 59.82 1nqt s VAL 129 Cb -0.04 -1.73 -0.18 0.00 0.00 0.00 0.00 36.38 34.43 1nqt s VAL 129 CO 0.02 -0.76 2.48 0.29 0.00 0.00 0.00 175.10 177.13 1nqt n LYS 130 N 4.43 0.26 0.00 2.72 5.02 -0.66 -3.34 118.16 126.59 1nqt n LYS 130 Ca 0.02 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1nqt n LYS 130 Cb 0.40 -1.86 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1nqt n LYS 130 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 1nqt n ILE 131 N 7.31 0.00 -3.95 -0.18 3.06 -1.22 -4.46 119.36 119.92 1nqt n ILE 131 Ca 0.57 0.00 -0.32 0.00 -2.50 0.00 0.00 62.75 60.50 1nqt n ILE 131 Cb 0.10 0.00 -0.14 0.00 0.54 0.00 0.00 39.64 40.15 1nqt n ILE 131 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1nqt s ASN 132 N 0.00 4.87 0.42 9.51 3.84 -1.26 -0.29 114.94 132.03 1nqt s ASN 132 Ca 0.00 -2.21 0.04 0.00 0.21 0.00 0.00 52.86 50.89 1nqt s ASN 132 Cb 0.00 -1.69 0.20 0.00 -0.55 0.00 0.00 41.25 39.21 1nqt s ASN 132 CO 0.00 -0.41 0.95 -0.65 -2.79 0.00 0.00 177.10 174.20 1nqt h PRO 133 N 7.62 0.00 0.00 0.43 0.11 -1.92 0.50 132.00 138.73 1nqt h PRO 133 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1nqt h PRO 133 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1nqt h PRO 133 CO 0.58 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.24 1nqt h LYS 134 N 0.00 0.00 -0.38 1.05 1.57 -1.97 -3.13 116.57 113.71 1nqt h LYS 134 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1nqt h LYS 134 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1nqt h LYS 134 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 1nqt n ASN 135 N -2.38 3.19 -4.13 0.86 4.13 0.17 -4.96 115.26 112.14 1nqt n ASN 135 Ca 0.05 -1.92 -0.22 0.00 1.68 0.00 0.00 54.58 54.17 1nqt n ASN 135 Cb 0.43 -0.25 -0.15 0.00 -1.54 0.00 0.00 39.78 38.27 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 -1.21 1.30 0.65 3.10 2.02 -1.18 -5.08 117.35 116.95 1nqt s TYR 136 Ca 0.33 -0.28 -0.14 0.00 -0.37 0.00 0.00 57.07 56.61 1nqt s TYR 136 Cb 0.19 -0.81 -0.01 0.00 -0.40 0.00 0.00 41.96 40.93 1nqt s TYR 136 CO 0.25 -0.00 1.08 -0.08 -1.57 0.00 0.00 175.55 175.23 1nqt s THR 137 N -0.50 3.57 0.41 -0.71 -1.32 -1.26 -4.73 115.64 111.10 1nqt s THR 137 Ca 0.05 0.68 0.20 0.00 -1.21 0.00 0.00 61.69 61.40 1nqt s THR 137 Cb -0.06 -3.22 0.41 0.00 -1.51 0.00 0.00 72.50 68.11 1nqt s THR 137 CO 0.00 -0.50 1.77 0.44 -2.21 0.00 0.00 174.62 174.12 1nqt h ASP 138 N -0.06 0.40 0.10 8.08 5.19 -1.99 0.27 116.42 128.41 1nqt h ASP 138 Ca -0.46 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1nqt h ASP 138 Cb 1.23 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1nqt h ASP 138 CO 0.55 0.07 -0.05 -1.13 -3.12 0.00 0.00 179.24 175.57 1nqt h ASN 139 N 0.35 -0.11 -1.00 6.45 -0.73 -2.00 -2.90 115.58 115.64 1nqt h ASN 139 Ca 0.59 0.00 0.39 0.00 1.87 0.00 0.00 56.30 59.16 1nqt h ASN 139 Cb 1.58 0.03 -0.15 0.00 0.27 0.00 0.00 38.32 40.05 1nqt h ASN 139 CO -0.27 -0.06 0.57 -0.62 -0.37 0.00 0.00 177.43 176.68 1nqt n GLU 140 N -2.47 -0.05 0.18 6.67 1.02 -0.31 -0.06 120.64 125.62 1nqt n GLU 140 Ca -0.02 1.22 -0.15 0.00 -0.02 0.00 0.00 57.16 58.20 1nqt n GLU 140 Cb 0.05 -2.25 -0.08 0.00 -0.02 0.00 0.00 31.44 29.15 1nqt n GLU 140 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1nqt h LEU 141 N 0.00 -0.33 0.00 -4.62 3.38 -0.51 0.63 115.31 113.85 1nqt h LEU 141 Ca 0.78 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.74 1nqt h LEU 141 Cb 2.18 0.09 0.00 0.00 0.09 0.00 0.00 40.66 43.01 1nqt h LEU 141 CO -0.63 -0.22 0.00 1.21 0.09 0.00 0.00 178.44 178.89 1nqt n GLU 142 N -5.25 0.00 -0.22 1.13 2.13 0.91 0.51 120.64 119.85 1nqt n GLU 142 Ca -0.10 0.45 0.19 0.00 0.66 0.00 0.00 57.16 58.36 1nqt n GLU 142 Cb 0.18 -1.16 0.31 0.00 0.27 0.00 0.00 31.44 31.05 1nqt n GLU 142 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1nqt n LYS 143 N -1.36 -0.02 -0.05 5.31 4.81 -0.86 0.27 118.16 126.27 1nqt n LYS 143 Ca 0.00 0.58 -0.13 0.00 -0.87 0.00 0.00 58.31 57.90 1nqt n LYS 143 Cb 0.00 -1.15 -0.11 0.00 0.02 0.00 0.00 35.03 33.79 1nqt n LYS 143 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1nqt h ILE 144 N 0.00 1.52 -0.53 3.15 1.08 0.16 -3.17 117.51 119.72 1nqt h ILE 144 Ca 0.41 -1.92 0.02 0.00 -0.39 0.00 0.00 64.86 62.98 1nqt h ILE 144 Cb 1.32 2.76 -0.03 0.00 -3.07 0.00 0.00 36.82 37.79 1nqt h ILE 144 CO -0.22 0.47 0.32 0.71 -0.69 0.00 0.00 178.15 178.75 1nqt h THR 145 N -0.89 1.07 0.18 -0.27 1.35 0.90 -2.77 112.91 112.48 1nqt h THR 145 Ca -0.00 -0.22 -0.01 0.00 -0.55 0.00 0.00 66.41 65.63 1nqt h THR 145 Cb 0.79 0.37 -0.01 0.00 -1.73 0.00 0.00 68.15 67.58 1nqt h THR 145 CO 0.00 0.12 -0.16 0.03 -0.25 0.00 0.00 175.52 175.26 1nqt h ARG 146 N 0.64 -0.32 0.00 4.72 3.08 -1.29 -0.14 114.38 121.07 1nqt h ARG 146 Ca 0.21 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1nqt h ARG 146 Cb 0.00 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1nqt h ARG 146 CO -0.09 -0.21 0.15 0.54 -1.07 0.00 0.00 179.97 179.30 1nqt n ARG 147 N -3.26 0.00 -0.03 0.04 1.74 -1.20 0.04 116.66 114.00 1nqt n ARG 147 Ca -0.04 0.25 -0.21 0.00 -0.77 0.00 0.00 57.85 57.08 1nqt n ARG 147 Cb 0.15 -1.65 -0.13 0.00 -1.02 0.00 0.00 32.46 29.80 1nqt n ARG 147 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nqt n PHE 148 N -1.22 1.05 0.24 -1.55 7.35 -0.67 -3.30 117.46 119.38 1nqt n PHE 148 Ca 0.00 0.26 0.08 0.00 -0.76 0.00 0.00 57.45 57.03 1nqt n PHE 148 Cb 0.15 -1.13 0.60 0.00 0.35 0.00 0.00 39.48 39.45 1nqt n PHE 148 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1nqt h THR 149 N -0.15 0.95 0.10 -2.13 2.02 0.14 0.13 112.91 113.97 1nqt h THR 149 Ca -0.44 -0.46 -0.00 0.00 0.77 0.00 0.00 66.41 66.28 1nqt h THR 149 Cb 1.89 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.55 1nqt h THR 149 CO 0.00 0.13 -0.05 0.24 0.37 0.00 0.00 175.52 176.21 1nqt h MET 150 N 0.00 -0.13 0.00 6.66 2.86 -1.28 -2.67 114.93 120.37 1nqt h MET 150 Ca -0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1nqt h MET 150 Cb 0.25 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1nqt h MET 150 CO 0.02 -0.09 0.01 0.39 1.06 0.00 0.00 176.91 178.30 1nqt n GLU 151 N -3.32 0.12 0.12 1.72 -0.58 -1.17 0.15 120.64 117.68 1nqt n GLU 151 Ca -0.02 0.61 -0.21 0.00 -0.42 0.00 0.00 57.16 57.13 1nqt n GLU 151 Cb 0.05 -1.90 -0.15 0.00 -0.57 0.00 0.00 31.44 28.87 1nqt n GLU 151 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1nqt h LEU 152 N 0.00 0.63 0.24 -4.62 5.85 -0.79 -3.34 115.31 113.27 1nqt h LEU 152 Ca 0.00 -0.70 -0.01 0.00 0.84 0.00 0.00 57.88 58.01 1nqt h LEU 152 Cb 0.02 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1nqt h LEU 152 CO 0.00 1.56 -0.11 0.00 -0.34 0.00 0.00 178.44 179.54 1nqt h ALA 153 N 0.35 -0.32 -0.39 1.25 0.00 0.07 0.48 119.26 120.70 1nqt h ALA 153 Ca -0.22 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.62 1nqt h ALA 153 Cb 2.08 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.98 1nqt h ALA 153 CO 0.23 -0.36 0.77 0.87 0.00 0.00 0.00 179.25 180.76 1nqt h LYS 154 N -0.96 0.00 -0.21 0.00 1.57 -1.29 0.56 116.57 116.24 1nqt h LYS 154 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1nqt h LYS 154 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1nqt h LYS 154 CO 0.05 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.56 1nqt n LYS 155 N -3.09 2.70 -2.72 3.15 4.76 -1.20 -5.01 118.16 116.75 1nqt n LYS 155 Ca 0.08 -2.26 -0.08 0.00 -2.87 0.00 0.00 58.31 53.17 1nqt n LYS 155 Cb 0.91 -1.43 0.04 0.00 -1.84 0.00 0.00 35.03 32.72 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 -0.25 0.10 0.00 0.72 0.00 0.19 -4.96 105.19 101.00 1nqt n GLY 156 Ca 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.64 0.00 -3.62 1.61 3.72 0.15 -4.88 117.46 111.80 1nqt n PHE 157 Ca -0.11 -0.21 -0.05 0.00 -0.05 0.00 0.00 57.45 57.03 1nqt n PHE 157 Cb 0.57 -0.02 -0.07 0.00 -0.94 0.00 0.00 39.48 39.02 1nqt n PHE 157 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1nqt s ILE 158 N -0.41 -0.81 -0.30 4.37 2.07 -1.24 -4.74 121.20 120.14 1nqt s ILE 158 Ca 0.00 0.08 -0.20 0.00 -1.41 0.00 0.00 60.65 59.12 1nqt s ILE 158 Cb 0.00 -0.83 0.21 0.00 0.13 0.00 0.00 42.46 41.97 1nqt s ILE 158 CO 0.00 0.03 1.36 -0.83 -1.91 0.00 0.00 174.94 173.59 1nqt s GLY 159 N 2.74 0.58 0.57 1.50 0.00 -0.39 -4.56 107.32 107.76 1nqt s GLY 159 Ca -0.02 3.79 0.33 0.00 0.00 0.00 0.00 44.72 48.82 1nqt s GLY 159 CO -0.16 2.45 1.76 -0.56 0.00 0.00 0.00 173.10 176.59 1nqt h PRO 160 N 4.24 0.00 -0.20 2.90 0.13 -1.80 0.14 132.00 137.40 1nqt h PRO 160 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1nqt h PRO 160 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1nqt h PRO 160 CO 0.22 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.40 1nqt n GLY 161 N -1.68 3.65 1.37 1.56 0.00 -1.26 -4.74 105.19 104.09 1nqt n GLY 161 Ca 0.20 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.36 0.43 -3.15 -0.61 -0.00 0.33 -4.21 119.36 111.79 1nqt n ILE 162 Ca 0.14 0.14 0.04 0.00 -0.00 0.00 0.00 62.75 63.08 1nqt n ILE 162 Cb 0.62 -1.18 -0.01 0.00 -0.00 0.00 0.00 39.64 39.07 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 -5.35 -1.37 -0.47 4.38 -1.08 -0.30 -0.89 116.67 111.59 1nqt s ASP 163 Ca 0.00 0.66 -0.13 0.00 -0.52 0.00 0.00 52.55 52.56 1nqt s ASP 163 Cb 0.00 2.07 0.09 0.00 -1.46 0.00 0.00 42.92 43.63 1nqt s ASP 163 CO 0.00 -0.26 0.38 -0.69 0.52 0.00 0.00 175.17 175.12 1nqt s VAL 164 N 2.86 4.84 0.29 1.11 1.01 0.78 -1.26 120.40 130.04 1nqt s VAL 164 Ca 0.17 -1.34 -0.05 0.00 0.00 0.00 0.00 61.98 60.76 1nqt s VAL 164 Cb -0.13 -3.99 0.08 0.00 0.00 0.00 0.00 36.38 32.33 1nqt s VAL 164 CO -0.22 -0.65 0.17 -2.65 0.00 0.00 0.00 175.10 171.76 1nqt n PRO 165 N 5.10 -2.52 -3.75 2.72 -0.02 -1.15 -3.52 135.00 131.86 1nqt n PRO 165 Ca -0.12 -0.29 -0.02 0.00 -2.02 0.00 0.00 63.50 61.06 1nqt n PRO 165 Cb 0.42 -0.37 -0.00 0.00 -0.02 0.00 0.00 33.50 33.52 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 -2.08 -1.86 0.43 3.55 0.00 -1.16 -2.02 121.76 118.63 1nqt s ALA 166 Ca 0.13 0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 1nqt s ALA 166 Cb -0.02 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.66 1nqt s ALA 166 CO 0.11 -1.06 0.69 -1.25 0.00 0.00 0.00 175.76 174.25 1nqt s PRO 167 N -2.75 3.38 0.10 0.00 0.04 -1.26 -0.49 135.00 134.03 1nqt s PRO 167 Ca 0.16 -0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.05 1nqt s PRO 167 Cb 0.00 -2.51 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 1nqt s PRO 167 CO 0.01 -0.12 0.00 -3.47 0.04 0.00 0.00 177.00 173.46 1nqt n ASP 168 N -2.08 2.20 -0.18 6.66 2.03 -1.24 -4.61 116.55 119.34 1nqt n ASP 168 Ca -0.01 -1.44 -0.07 0.00 0.52 0.00 0.00 54.79 53.79 1nqt n ASP 168 Cb 0.56 0.08 0.08 0.00 -0.72 0.00 0.00 41.12 41.12 1nqt n ASP 168 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1nqt h MET 169 N 0.00 0.97 0.00 -0.67 2.86 -1.99 -2.72 114.93 113.38 1nqt h MET 169 Ca -0.08 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1nqt h MET 169 Cb 0.25 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1nqt h MET 169 CO 0.14 0.96 0.00 -1.13 1.06 0.00 0.00 176.91 177.93 1nqt n SER 170 N -4.19 0.00 -3.80 1.22 3.41 -1.26 -4.81 113.62 104.19 1nqt n SER 170 Ca 0.03 -1.34 -0.11 0.00 -0.26 0.00 0.00 58.87 57.18 1nqt n SER 170 Cb 0.33 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.20 1nqt n SER 170 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nqt s THR 171 N -2.00 0.09 0.03 6.66 -4.23 -1.03 -4.38 115.64 110.78 1nqt s THR 171 Ca 0.21 -0.71 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 1nqt s THR 171 Cb 0.09 -0.82 -0.00 0.00 1.34 0.00 0.00 72.50 73.11 1nqt s THR 171 CO 0.16 -0.39 0.01 0.61 -0.54 0.00 0.00 174.62 174.47 1nqt n GLY 172 N 0.83 4.06 0.30 3.99 0.00 -1.26 -3.62 105.19 109.49 1nqt n GLY 172 Ca -0.20 -1.99 0.01 0.00 0.00 0.00 0.00 46.02 43.85 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 0.59 -0.94 1.61 4.11 -1.97 -2.58 114.58 115.41 1nqt h GLU 173 Ca -0.03 -0.08 0.05 0.00 0.07 0.00 0.00 59.36 59.38 1nqt h GLU 173 Cb 0.10 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 1nqt h GLU 173 CO 0.04 0.49 0.61 0.07 0.07 0.00 0.00 179.01 180.30 1nqt h ARG 174 N 0.59 1.08 -0.01 1.06 0.11 -1.97 0.78 114.38 116.03 1nqt h ARG 174 Ca 0.15 -0.07 -0.13 0.00 0.10 0.00 0.00 59.98 60.03 1nqt h ARG 174 Cb 0.12 -0.24 0.01 0.00 1.11 0.00 0.00 29.97 30.97 1nqt h ARG 174 CO -0.01 0.72 -0.49 0.93 0.10 0.00 0.00 179.97 181.21 1nqt h GLU 175 N 1.12 0.35 0.06 0.08 5.08 -1.87 -2.80 114.58 116.60 1nqt h GLU 175 Ca 0.39 -0.36 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1nqt h GLU 175 Cb 0.12 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1nqt h GLU 175 CO -0.14 1.04 -0.44 0.52 -1.00 0.00 0.00 179.01 178.99 1nqt h MET 176 N -0.19 -0.61 -0.95 2.33 2.86 -1.13 0.31 114.93 117.55 1nqt h MET 176 Ca -0.06 0.04 0.29 0.00 -2.06 0.00 0.00 59.70 57.92 1nqt h MET 176 Cb 1.20 0.14 -0.16 0.00 0.06 0.00 0.00 31.60 32.84 1nqt h MET 176 CO 0.10 -0.41 0.29 1.03 1.06 0.00 0.00 176.91 178.98 1nqt h SER 177 N -0.64 0.02 0.14 1.22 0.87 0.54 0.51 113.55 116.22 1nqt h SER 177 Ca 0.03 0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.81 1nqt h SER 177 Cb 0.68 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1nqt h SER 177 CO -0.29 -0.25 -0.07 -0.50 -0.53 0.00 0.00 176.83 175.19 1nqt h TRP 178 N 0.14 -0.17 -0.32 2.24 6.55 -0.88 -1.03 115.95 122.47 1nqt h TRP 178 Ca 0.65 -0.00 0.03 0.00 0.95 0.00 0.00 58.89 60.52 1nqt h TRP 178 Cb 1.44 0.06 -0.05 0.00 -0.86 0.00 0.00 29.16 29.74 1nqt h TRP 178 CO -0.23 0.17 -0.31 0.82 -1.05 0.00 0.00 178.44 177.83 1nqt h ILE 179 N -0.53 0.00 -0.04 1.49 2.04 0.33 0.43 117.51 121.22 1nqt h ILE 179 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1nqt h ILE 179 Cb 0.42 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1nqt h ILE 179 CO 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 178.15 178.15 1nqt h ALA 180 N -0.48 -0.11 -2.05 1.87 0.00 -0.17 -1.79 119.26 116.53 1nqt h ALA 180 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1nqt h ALA 180 Cb 0.30 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1nqt h ALA 180 CO -0.38 -0.13 0.00 -3.47 0.00 0.00 0.00 179.25 175.27 1nqt n ASP 181 N -3.04 0.00 -0.14 0.00 -0.08 -0.40 -1.55 116.55 111.35 1nqt n ASP 181 Ca 0.00 0.66 -0.01 0.00 -1.51 0.00 0.00 54.79 53.93 1nqt n ASP 181 Cb 0.01 -0.16 0.01 0.00 2.34 0.00 0.00 41.12 43.33 1nqt n ASP 181 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1nqt n THR 182 N -1.55 -0.19 0.21 5.18 -1.04 0.14 0.74 114.28 117.76 1nqt n THR 182 Ca 0.00 0.85 -0.14 0.00 -2.04 0.00 0.00 64.05 62.72 1nqt n THR 182 Cb 0.00 -1.12 -0.08 0.00 -1.82 0.00 0.00 70.33 67.31 1nqt n THR 182 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 1nqt h TYR 183 N 0.00 -1.13 -0.23 -1.42 3.20 -0.45 -1.28 116.97 115.67 1nqt h TYR 183 Ca 0.12 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.07 1nqt h TYR 183 Cb 0.21 0.45 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 1nqt h TYR 183 CO -0.32 -0.53 0.40 0.00 -1.64 0.00 0.00 178.16 176.08 1nqt h ALA 184 N -1.04 1.78 0.00 1.82 0.00 0.14 -0.25 119.26 121.71 1nqt h ALA 184 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1nqt h ALA 184 Cb 0.68 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1nqt h ALA 184 CO -0.08 -0.52 -1.18 0.43 0.00 0.00 0.00 179.25 177.90 1nqt n SER 185 N -3.34 0.57 0.00 0.00 7.64 -0.43 -3.36 113.62 114.70 1nqt n SER 185 Ca 0.03 -0.22 0.00 0.00 1.01 0.00 0.00 58.87 59.69 1nqt n SER 185 Cb 0.52 0.99 0.00 0.00 -1.01 0.00 0.00 64.21 64.71 1nqt n SER 185 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1nqt n THR 186 N -2.01 0.00 -0.32 0.44 -1.04 -0.17 -4.72 114.28 106.46 1nqt n THR 186 Ca 0.01 0.00 0.18 0.00 -2.04 0.00 0.00 64.05 62.20 1nqt n THR 186 Cb 0.45 0.00 0.37 0.00 -1.82 0.00 0.00 70.33 69.34 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 0.20 -0.06 12.58 1.08 -1.80 0.02 117.51 129.53 1nqt h ILE 187 Ca 0.00 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1nqt h ILE 187 Cb 0.00 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 33.78 1nqt h ILE 187 CO 0.00 0.03 0.00 0.61 -0.69 0.00 0.00 178.15 178.10 1nqt n GLY 188 N -1.37 -0.42 0.62 5.37 0.00 -0.79 -4.55 105.19 104.06 1nqt n GLY 188 Ca 0.26 -0.27 0.43 0.00 0.00 0.00 0.00 46.02 46.44 1nqt n GLY 188 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1nqt n HIS 189 N -0.30 0.00 0.85 1.61 -0.00 -0.01 0.97 115.22 118.35 1nqt n HIS 189 Ca 0.16 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.98 1nqt n HIS 189 Cb 0.20 -0.40 -0.01 0.00 -0.00 0.00 0.00 29.99 29.78 1nqt n HIS 189 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1nqt n TYR 190 N -3.59 0.00 -2.69 1.57 4.02 -1.26 -4.90 117.16 110.31 1nqt n TYR 190 Ca 0.36 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.82 1nqt n TYR 190 Cb 1.77 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 41.06 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 -2.20 6.44 0.00 7.72 3.68 0.27 -4.89 116.67 127.69 1nqt s ASP 191 Ca 0.16 0.01 0.00 0.00 2.13 0.00 0.00 52.55 54.85 1nqt s ASP 191 Cb 0.15 -2.51 0.00 0.00 -1.45 0.00 0.00 42.92 39.12 1nqt s ASP 191 CO 0.50 -1.33 0.37 0.00 0.13 0.00 0.00 175.17 174.83 1nqt n ILE 192 N 6.53 0.00 -2.19 4.11 3.06 -1.26 -0.22 119.36 129.38 1nqt n ILE 192 Ca 0.07 0.00 0.01 0.00 -2.50 0.00 0.00 62.75 60.33 1nqt n ILE 192 Cb 0.48 -0.89 0.09 0.00 0.54 0.00 0.00 39.64 39.86 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 -0.86 1.72 -0.26 9.51 3.02 -1.26 -4.87 115.26 122.25 1nqt n ASN 193 Ca 0.00 -2.82 0.01 0.00 -0.03 0.00 0.00 54.58 51.73 1nqt n ASN 193 Cb 0.00 -0.41 0.13 0.00 -0.61 0.00 0.00 39.78 38.90 1nqt n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nqt h ALA 194 N 1.33 1.04 0.00 5.41 0.00 -0.90 -0.70 119.26 125.44 1nqt h ALA 194 Ca -0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1nqt h ALA 194 Cb 1.48 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1nqt h ALA 194 CO 0.14 0.09 0.00 0.72 0.00 0.00 0.00 179.25 180.20 1nqt n HIS 195 N -4.76 0.00 0.60 0.00 8.25 -1.26 -0.74 115.22 117.31 1nqt n HIS 195 Ca 0.11 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.65 1nqt n HIS 195 Cb 0.22 -0.15 0.22 0.00 1.12 0.00 0.00 29.99 31.39 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 -1.15 2.43 0.21 -1.41 0.00 -0.27 -4.22 120.51 116.10 1nqt n ALA 196 Ca 0.06 -0.78 0.06 0.00 0.00 0.00 0.00 53.44 52.77 1nqt n ALA 196 Cb 0.05 -0.97 0.44 0.00 0.00 0.00 0.00 19.45 18.98 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 -4.06 0.02 0.45 0.00 0.11 -1.26 -2.93 120.40 112.73 1nqt s VAL 198 Ca -0.02 -0.15 0.07 0.00 -2.93 0.00 0.00 61.98 58.95 1nqt s VAL 198 Cb 0.13 -0.66 -0.00 0.00 -1.53 0.00 0.00 36.38 34.32 1nqt s VAL 198 CO 0.68 -0.08 0.40 0.42 -3.33 0.00 0.00 175.10 173.19 1nqt s THR 199 N -0.43 2.40 0.00 5.04 -4.23 -0.85 -4.63 115.64 112.93 1nqt s THR 199 Ca -0.06 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1nqt s THR 199 Cb -0.03 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.04 1nqt s THR 199 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1nqt n GLY 200 N -1.63 0.80 3.91 3.99 0.00 -1.26 -4.11 105.19 106.89 1nqt n GLY 200 Ca 0.03 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 1nqt n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nqt s LYS 201 N -0.66 3.00 0.52 1.61 -2.85 -1.26 -4.07 119.74 116.03 1nqt s LYS 201 Ca 0.00 0.07 -0.22 0.00 -1.00 0.00 0.00 55.97 54.82 1nqt s LYS 201 Cb 0.00 -2.26 -0.06 0.00 -2.06 0.00 0.00 37.83 33.46 1nqt s LYS 201 CO 0.00 -0.67 1.31 -2.14 0.10 0.00 0.00 175.35 173.95 1nqt s PRO 202 N -5.00 3.32 0.43 1.78 0.02 -1.26 -3.87 135.00 130.42 1nqt s PRO 202 Ca 0.54 2.12 0.10 0.00 0.02 0.00 0.00 61.00 63.77 1nqt s PRO 202 Cb -0.11 -2.31 0.94 0.00 0.02 0.00 0.00 34.50 33.04 1nqt s PRO 202 CO 0.46 -1.01 2.05 0.82 -0.33 0.00 0.00 177.00 178.99 1nqt h ILE 203 N 1.59 1.04 0.00 2.83 1.08 -1.90 0.17 117.51 122.32 1nqt h ILE 203 Ca -0.50 -0.16 -0.04 0.00 -0.39 0.00 0.00 64.86 63.77 1nqt h ILE 203 Cb 1.28 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.56 1nqt h ILE 203 CO 0.58 0.09 -0.18 0.77 -0.69 0.00 0.00 178.15 178.72 1nqt h SER 204 N 0.47 0.00 -0.43 1.72 4.64 -1.92 -2.65 113.55 115.38 1nqt h SER 204 Ca 0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 1nqt h SER 204 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1nqt h SER 204 CO -0.04 0.18 0.01 0.00 -0.87 0.00 0.00 176.83 176.11 1nqt n GLN 205 N -3.60 3.90 -1.56 4.77 1.13 0.41 -4.94 117.38 117.49 1nqt n GLN 205 Ca -0.01 -3.02 0.00 0.00 -1.94 0.00 0.00 57.00 52.03 1nqt n GLN 205 Cb 0.31 -2.07 0.00 0.00 0.11 0.00 0.00 30.24 28.60 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 0.03 0.47 3.97 1.08 0.00 -0.62 -4.73 105.19 105.39 1nqt n GLY 206 Ca 0.25 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.58 1.99 0.14 -0.02 0.00 -0.09 -4.82 107.32 101.93 1nqt s GLY 207 Ca 0.00 -1.81 0.05 0.00 0.00 0.00 0.00 44.72 42.96 1nqt s GLY 207 CO 0.00 -1.64 0.08 -1.50 0.00 0.00 0.00 173.10 170.04 1nqt s ILE 208 N -2.50 4.32 0.13 0.90 2.07 -1.26 -4.64 121.20 120.20 1nqt s ILE 208 Ca 0.53 -1.05 -0.27 0.00 -1.41 0.00 0.00 60.65 58.45 1nqt s ILE 208 Cb -0.06 -3.15 -0.07 0.00 0.13 0.00 0.00 42.46 39.31 1nqt s ILE 208 CO 0.32 -0.02 0.84 -1.00 -1.91 0.00 0.00 174.94 173.17 1nqt s HIS 209 N -1.60 3.84 0.00 3.50 3.76 -1.26 -3.96 115.29 119.57 1nqt s HIS 209 Ca 0.29 1.67 0.00 0.00 -0.15 0.00 0.00 55.06 56.87 1nqt s HIS 209 Cb -0.11 -2.88 0.00 0.00 1.11 0.00 0.00 32.58 30.70 1nqt s HIS 209 CO 0.22 0.36 0.00 0.41 -0.85 0.00 0.00 174.74 174.87 1nqt n GLY 210 N 1.98 1.05 0.14 -2.22 0.00 -1.26 -4.34 105.19 100.55 1nqt n GLY 210 Ca -0.02 -0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.62 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 0.43 0.00 1.61 2.43 -2.00 -3.15 114.38 113.70 1nqt h ARG 211 Ca 0.00 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1nqt h ARG 211 Cb 0.04 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1nqt h ARG 211 CO 0.00 1.13 0.00 0.82 -1.51 0.00 0.00 179.97 180.41 1nqt h ILE 212 N -0.07 0.00 0.00 1.20 5.03 -1.94 -2.72 117.51 119.01 1nqt h ILE 212 Ca -0.08 -0.23 0.00 0.00 -0.12 0.00 0.00 64.86 64.42 1nqt h ILE 212 Cb 1.36 1.01 0.00 0.00 -3.03 0.00 0.00 36.82 36.17 1nqt h ILE 212 CO 0.13 0.00 -0.70 -1.20 -0.68 0.00 0.00 178.15 175.69 1nqt n SER 213 N -2.54 0.74 -0.00 1.72 7.64 -1.25 -4.77 113.62 115.16 1nqt n SER 213 Ca 0.01 -0.73 -0.00 0.00 1.01 0.00 0.00 58.87 59.16 1nqt n SER 213 Cb 0.20 1.06 -0.00 0.00 -1.01 0.00 0.00 64.21 64.45 1nqt n SER 213 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nqt h ALA 214 N 1.76 -0.37 -0.51 -0.43 0.00 -1.43 0.43 119.26 118.71 1nqt h ALA 214 Ca 0.00 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1nqt h ALA 214 Cb 0.33 0.64 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 1nqt h ALA 214 CO 0.00 -0.37 0.09 1.15 0.00 0.00 0.00 179.25 180.11 1nqt h THR 215 N -0.00 0.69 0.35 0.00 2.02 -1.79 0.47 112.91 114.65 1nqt h THR 215 Ca 0.00 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 1nqt h THR 215 Cb 0.01 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1nqt h THR 215 CO -0.00 0.04 -0.41 1.23 0.37 0.00 0.00 175.52 176.75 1nqt h GLY 216 N 0.22 -0.94 2.00 2.16 0.00 -1.79 -0.85 103.07 103.87 1nqt h GLY 216 Ca 0.26 0.47 0.00 0.00 0.00 0.00 0.00 47.33 48.06 1nqt h GLY 216 CO -0.35 -0.31 0.00 -0.09 0.00 0.00 0.00 176.54 175.79 1nqt h ARG 217 N -0.79 0.00 0.30 4.80 2.43 0.36 -1.41 114.38 120.07 1nqt h ARG 217 Ca -0.02 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1nqt h ARG 217 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1nqt h ARG 217 CO -0.10 0.00 -0.14 0.78 -1.51 0.00 0.00 179.97 179.00 1nqt h GLY 218 N 0.76 -0.42 0.34 2.80 0.00 0.13 -3.01 103.07 103.67 1nqt h GLY 218 Ca 0.00 0.16 0.21 0.00 0.00 0.00 0.00 47.33 47.69 1nqt h GLY 218 CO 0.00 -0.15 0.63 -2.08 0.00 0.00 0.00 176.54 174.93 1nqt h VAL 219 N -0.98 0.41 0.25 4.60 2.07 -0.28 -0.59 116.25 121.73 1nqt h VAL 219 Ca -0.04 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1nqt h VAL 219 Cb 0.49 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1nqt h VAL 219 CO 0.07 0.00 -0.12 0.15 0.02 0.00 0.00 177.57 177.69 1nqt h PHE 220 N 0.00 -0.31 -0.74 1.57 3.04 -1.45 -3.05 116.94 116.00 1nqt h PHE 220 Ca 0.34 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.29 1nqt h PHE 220 Cb 1.59 0.10 -0.04 0.00 2.56 0.00 0.00 35.95 40.17 1nqt h PHE 220 CO 0.00 0.01 0.47 0.45 -2.02 0.00 0.00 178.31 177.22 1nqt h HIS 221 N -0.98 0.94 -0.19 0.41 3.86 -1.11 0.23 115.15 118.32 1nqt h HIS 221 Ca -0.03 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1nqt h HIS 221 Cb 0.46 -0.32 -0.07 0.00 1.06 0.00 0.00 27.41 28.54 1nqt h HIS 221 CO 0.05 0.61 -0.42 0.78 0.86 0.00 0.00 177.93 179.81 1nqt h GLY 222 N 1.02 -0.67 0.92 2.45 0.00 -1.25 0.47 103.07 106.01 1nqt h GLY 222 Ca 0.27 0.52 -0.02 0.00 0.00 0.00 0.00 47.33 48.10 1nqt h GLY 222 CO -0.05 -0.21 -0.16 -2.22 0.00 0.00 0.00 176.54 173.89 1nqt h ILE 223 N -0.46 0.68 -0.74 2.60 2.04 -1.35 -3.18 117.51 117.10 1nqt h ILE 223 Ca 0.09 -0.15 0.17 0.00 1.00 0.00 0.00 64.86 65.96 1nqt h ILE 223 Cb 0.61 0.76 -0.12 0.00 -0.74 0.00 0.00 36.82 37.34 1nqt h ILE 223 CO -0.43 0.03 0.14 -0.08 0.00 0.00 0.00 178.15 177.81 1nqt h GLU 224 N -0.54 0.21 -0.84 2.37 4.81 -0.50 0.31 114.58 120.40 1nqt h GLU 224 Ca -0.05 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.25 1nqt h GLU 224 Cb 0.40 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.67 1nqt h GLU 224 CO 0.08 0.14 0.50 -0.91 -0.73 0.00 0.00 179.01 178.09 1nqt h ASN 225 N 0.22 0.75 0.08 1.04 2.35 -0.05 -2.57 115.58 117.40 1nqt h ASN 225 Ca 0.42 0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 56.07 1nqt h ASN 225 Cb 0.74 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 38.99 1nqt h ASN 225 CO -0.55 0.46 -0.63 -0.26 -1.65 0.00 0.00 177.43 174.79 1nqt h PHE 226 N 0.87 0.30 0.00 1.19 -1.00 -1.02 -3.29 116.94 114.00 1nqt h PHE 226 Ca 0.38 -0.22 0.00 0.00 2.81 0.00 0.00 57.97 60.94 1nqt h PHE 226 Cb 0.27 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.82 1nqt h PHE 226 CO -0.05 1.24 0.00 1.51 -1.61 0.00 0.00 178.31 179.41 1nqt n ILE 227 N -4.29 0.00 0.20 -0.55 0.13 0.89 0.13 119.36 115.86 1nqt n ILE 227 Ca -0.15 0.00 0.02 0.00 -1.10 0.00 0.00 62.75 61.52 1nqt n ILE 227 Cb 0.70 -0.73 -0.01 0.00 -0.84 0.00 0.00 39.64 38.77 1nqt n ILE 227 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1nqt n ASN 228 N -0.76 0.67 -4.43 9.51 5.03 -0.98 -4.74 115.26 119.55 1nqt n ASN 228 Ca 0.01 -0.83 -0.44 0.00 0.87 0.00 0.00 54.58 54.19 1nqt n ASN 228 Cb 0.00 0.61 -0.04 0.00 -1.02 0.00 0.00 39.78 39.33 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1nqt s GLU 229 N -1.01 3.11 0.24 3.52 2.56 0.12 -4.92 118.70 122.32 1nqt s GLU 229 Ca 0.03 -0.96 -0.12 0.00 0.00 0.00 0.00 54.97 53.92 1nqt s GLU 229 Cb 0.03 -4.21 0.34 0.00 2.00 0.00 0.00 34.13 32.30 1nqt s GLU 229 CO 0.13 -1.60 1.49 0.00 -0.56 0.00 0.00 175.26 174.72 1nqt n ALA 230 N 6.97 0.06 -0.08 6.30 0.00 -1.26 -1.25 120.51 131.24 1nqt n ALA 230 Ca -0.06 1.00 -0.08 0.00 0.00 0.00 0.00 53.44 54.30 1nqt n ALA 230 Cb 0.45 -0.53 -0.02 0.00 0.00 0.00 0.00 19.45 19.34 1nqt n ALA 230 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nqt h SER 231 N 0.00 -1.01 0.21 0.00 0.02 -1.95 -1.29 113.55 109.53 1nqt h SER 231 Ca 0.40 0.17 -0.18 0.00 -0.84 0.00 0.00 61.79 61.34 1nqt h SER 231 Cb 0.64 0.47 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 1nqt h SER 231 CO -0.97 -0.32 -0.71 1.88 -1.14 0.00 0.00 176.83 175.57 1nqt h TYR 232 N -0.28 0.59 0.00 3.45 -1.99 -1.61 -2.74 116.97 114.39 1nqt h TYR 232 Ca 0.15 -0.25 0.00 0.00 2.00 0.00 0.00 58.73 60.63 1nqt h TYR 232 Cb 0.53 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.16 1nqt h TYR 232 CO -0.49 1.01 0.00 -1.33 -0.00 0.00 0.00 178.16 177.35 1nqt n MET 233 N -3.86 0.86 -0.04 4.88 2.81 -0.38 -2.89 117.12 118.50 1nqt n MET 233 Ca -0.04 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.80 1nqt n MET 233 Cb 0.69 -1.09 -0.02 0.00 -0.71 0.00 0.00 33.22 32.10 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 -0.38 1.11 -0.30 7.83 7.64 -0.53 0.15 113.62 129.14 1nqt n SER 234 Ca 0.00 0.18 0.31 0.00 1.01 0.00 0.00 58.87 60.38 1nqt n SER 234 Cb 0.04 -0.58 0.48 0.00 -1.01 0.00 0.00 64.21 63.14 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 -3.61 0.00 -0.02 0.44 2.08 -1.13 0.34 119.36 117.46 1nqt n ILE 235 Ca -0.07 1.23 0.07 0.00 0.56 0.00 0.00 62.75 64.54 1nqt n ILE 235 Cb 0.27 -2.17 -0.16 0.00 -0.75 0.00 0.00 39.64 36.83 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 -3.27 0.06 -1.93 1.39 4.77 -1.14 -5.00 117.00 111.88 1nqt n LEU 236 Ca 0.26 0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 56.25 1nqt n LEU 236 Cb 1.54 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 42.72 1nqt n LEU 236 CO 0.26 0.08 0.04 0.61 -1.33 0.00 0.00 177.39 177.06 1nqt n GLY 237 N 1.35 -0.80 0.00 -0.72 0.00 1.05 -5.08 105.19 100.99 1nqt n GLY 237 Ca -0.09 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.67 0.00 -2.64 1.61 2.00 0.40 -4.94 117.12 112.88 1nqt n MET 238 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.61 1nqt n MET 238 Cb 0.24 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.47 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 -1.31 -0.96 2.03 5.66 -1.26 -4.88 114.28 113.56 1nqt n THR 239 Ca 0.00 0.01 -0.29 0.00 -3.05 0.00 0.00 64.05 60.72 1nqt n THR 239 Cb 0.00 -1.18 0.22 0.00 -1.55 0.00 0.00 70.33 67.82 1nqt n THR 239 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 1nqt s PRO 240 N -2.37 -0.73 0.00 1.09 0.02 -1.26 -5.07 135.00 126.68 1nqt s PRO 240 Ca 0.05 0.31 0.00 0.00 0.02 0.00 0.00 61.00 61.38 1nqt s PRO 240 Cb -0.01 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.89 1nqt s PRO 240 CO 0.34 -3.46 0.00 0.41 -0.33 0.00 0.00 177.00 173.96 1nqt n GLY 241 N -0.50 0.00 0.00 0.52 0.00 -1.26 -4.58 105.19 99.36 1nqt n GLY 241 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.15 0.00 0.28 1.61 7.35 -1.26 -4.60 117.46 118.69 1nqt n PHE 242 Ca 0.00 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 56.86 1nqt n PHE 242 Cb 0.49 -0.19 0.76 0.00 0.35 0.00 0.00 39.48 40.88 1nqt n PHE 242 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1nqt h GLY 243 N 0.00 0.00 0.00 7.13 0.00 -2.03 -3.47 103.07 104.70 1nqt h GLY 243 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1nqt h GLY 243 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.88 1nqt n ASP 244 N -3.14 0.00 -3.66 0.19 4.64 -1.26 -4.57 116.55 108.75 1nqt n ASP 244 Ca -0.00 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.29 1nqt n ASP 244 Cb 0.27 0.00 -0.08 0.00 -1.04 0.00 0.00 41.12 40.28 1nqt n ASP 244 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1nqt s LYS 245 N 0.00 0.69 -0.07 -0.67 1.02 -1.26 -4.17 119.74 115.29 1nqt s LYS 245 Ca 0.00 0.95 -0.01 0.00 0.02 0.00 0.00 55.97 56.94 1nqt s LYS 245 Cb 0.00 0.27 0.03 0.00 -0.52 0.00 0.00 37.83 37.60 1nqt s LYS 245 CO 0.00 -0.11 -0.02 0.95 -0.92 0.00 0.00 175.35 175.25 1nqt s THR 246 N 0.76 0.50 0.19 2.17 -4.23 -1.26 0.01 115.64 113.78 1nqt s THR 246 Ca -0.03 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 60.54 1nqt s THR 246 Cb -0.05 -0.61 -0.05 0.00 1.34 0.00 0.00 72.50 73.14 1nqt s THR 246 CO -0.06 0.26 -0.09 0.72 -0.54 0.00 0.00 174.62 174.92 1nqt s PHE 247 N 1.67 1.51 -0.01 3.99 -0.71 -0.12 0.57 117.98 124.88 1nqt s PHE 247 Ca 0.01 -0.73 0.01 0.00 -1.04 0.00 0.00 56.93 55.18 1nqt s PHE 247 Cb -0.13 -0.78 0.00 0.00 -1.21 0.00 0.00 43.02 40.91 1nqt s PHE 247 CO -0.04 0.16 -0.02 0.08 -1.34 0.00 0.00 175.22 174.05 1nqt s VAL 248 N -3.21 0.22 -0.08 -2.49 1.01 -0.34 -1.08 120.40 114.43 1nqt s VAL 248 Ca 0.22 -0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.14 1nqt s VAL 248 Cb 0.02 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 36.20 1nqt s VAL 248 CO 0.05 0.08 -0.19 0.54 0.00 0.00 0.00 175.10 175.58 1nqt s VAL 249 N 0.10 1.63 -0.44 2.92 0.11 -0.74 0.99 120.40 124.97 1nqt s VAL 249 Ca -0.01 -0.77 -0.16 0.00 -2.93 0.00 0.00 61.98 58.11 1nqt s VAL 249 Cb -0.03 -1.43 0.04 0.00 -1.53 0.00 0.00 36.38 33.43 1nqt s VAL 249 CO -0.00 0.46 0.41 -1.58 -3.33 0.00 0.00 175.10 171.06 1nqt s GLN 250 N 0.48 3.03 0.00 1.54 -0.44 0.11 -2.66 119.66 121.72 1nqt s GLN 250 Ca -0.17 -1.03 0.00 0.00 -2.50 0.00 0.00 55.36 51.67 1nqt s GLN 250 Cb -0.17 -4.04 0.00 0.00 -1.64 0.00 0.00 33.01 27.17 1nqt s GLN 250 CO 0.06 -0.92 0.00 0.41 0.50 0.00 0.00 175.29 175.35 1nqt n GLY 251 N 5.16 1.81 2.57 2.59 0.00 -1.26 0.13 105.19 116.19 1nqt n GLY 251 Ca -0.10 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 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 0.45 2.67 -3.17 1.61 -0.00 -1.26 -4.02 117.46 113.75 1nqt n PHE 252 Ca 0.00 -2.66 -0.01 0.00 -0.00 0.00 0.00 57.45 54.79 1nqt n PHE 252 Cb 0.00 -1.49 0.00 0.00 -0.00 0.00 0.00 39.48 37.99 1nqt n PHE 252 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 253 N 0.75 2.30 0.00 7.13 0.00 -1.26 -4.77 105.19 109.33 1nqt n GLY 253 Ca 0.54 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1nqt n GLY 253 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nqt n ASN 254 N -2.65 0.00 0.00 1.61 5.15 -1.26 -1.35 115.26 116.75 1nqt n ASN 254 Ca 0.00 0.58 0.00 0.00 -0.60 0.00 0.00 54.58 54.57 1nqt n ASN 254 Cb 0.02 -0.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.19 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 -1.29 0.00 -0.08 3.44 3.14 -1.26 -1.50 118.33 120.78 1nqt n VAL 255 Ca 0.00 0.77 -0.02 0.00 -2.96 0.00 0.00 64.34 62.14 1nqt n VAL 255 Cb 0.00 -1.19 -0.01 0.00 -1.06 0.00 0.00 33.84 31.58 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 -0.80 -0.46 0.38 7.55 0.00 -1.17 -0.22 105.19 110.47 1nqt n GLY 256 Ca 0.00 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 1nqt n GLY 256 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1nqt h LEU 257 N 0.00 -1.30 -1.33 0.99 5.85 -0.11 0.21 115.31 119.62 1nqt h LEU 257 Ca 0.04 0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1nqt h LEU 257 Cb 0.08 0.49 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1nqt h LEU 257 CO -0.18 -0.42 0.47 0.45 -0.34 0.00 0.00 178.44 178.42 1nqt h HIS 258 N -0.55 0.86 -0.26 1.25 3.86 -0.00 0.11 115.15 120.41 1nqt h HIS 258 Ca 0.01 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.25 1nqt h HIS 258 Cb 0.58 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.74 1nqt h HIS 258 CO -0.47 0.52 0.14 0.77 0.86 0.00 0.00 177.93 179.75 1nqt h SER 259 N 0.91 0.22 -0.63 2.45 0.02 -0.15 0.58 113.55 116.95 1nqt h SER 259 Ca 0.27 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.23 1nqt h SER 259 Cb -0.03 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1nqt h SER 259 CO -0.07 0.16 0.41 -0.03 -1.14 0.00 0.00 176.83 176.17 1nqt h MET 260 N 0.29 0.83 -0.76 3.45 1.85 0.90 0.30 114.93 121.79 1nqt h MET 260 Ca 0.11 -0.05 0.01 0.00 -0.61 0.00 0.00 59.70 59.15 1nqt h MET 260 Cb 0.02 -0.19 -0.04 0.00 0.43 0.00 0.00 31.60 31.82 1nqt h MET 260 CO -0.06 0.55 0.50 -0.09 -0.40 0.00 0.00 176.91 177.41 1nqt h ARG 261 N 0.85 0.99 0.18 0.39 1.12 0.79 0.12 114.38 118.82 1nqt h ARG 261 Ca 0.23 -0.06 -0.30 0.00 -1.11 0.00 0.00 59.98 58.74 1nqt h ARG 261 Cb -0.10 -0.22 0.03 0.00 -0.01 0.00 0.00 29.97 29.67 1nqt h ARG 261 CO -0.05 0.66 -1.28 1.88 -3.11 0.00 0.00 179.97 178.06 1nqt h TYR 262 N 1.02 0.95 0.08 2.20 0.05 0.37 -2.37 116.97 119.28 1nqt h TYR 262 Ca 0.28 -0.65 0.02 0.00 0.05 0.00 0.00 58.73 58.43 1nqt h TYR 262 Cb -0.12 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.54 1nqt h TYR 262 CO -0.02 1.49 -0.19 -0.07 -1.05 0.00 0.00 178.16 178.32 1nqt h LEU 263 N 0.15 -0.54 0.35 3.88 -0.00 -0.80 -3.02 115.31 115.33 1nqt h LEU 263 Ca -0.21 0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1nqt h LEU 263 Cb 1.98 0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 42.82 1nqt h LEU 263 CO 0.24 -0.27 -0.45 -0.74 -0.00 0.00 0.00 178.44 177.23 1nqt h HIS 264 N -0.35 -1.24 -0.99 1.13 2.76 -0.85 -2.22 115.15 113.40 1nqt h HIS 264 Ca 0.03 0.02 0.29 0.00 -2.20 0.00 0.00 60.37 58.51 1nqt h HIS 264 Cb 0.38 0.49 -0.04 0.00 1.55 0.00 0.00 27.41 29.80 1nqt h HIS 264 CO -0.20 -0.59 1.18 -0.09 -1.30 0.00 0.00 177.93 176.93 1nqt h ARG 265 N -0.84 0.00 -2.69 5.26 2.43 -1.30 -0.65 114.38 116.58 1nqt h ARG 265 Ca -0.03 0.00 -0.65 0.00 -0.81 0.00 0.00 59.98 58.49 1nqt h ARG 265 Cb 0.77 0.00 -0.39 0.00 -0.42 0.00 0.00 29.97 29.93 1nqt h ARG 265 CO -0.12 0.00 -0.34 1.19 -1.51 0.00 0.00 179.97 179.19 1nqt n PHE 266 N -3.26 3.51 0.00 2.20 3.72 -0.84 -4.99 117.46 117.80 1nqt n PHE 266 Ca 0.22 -4.02 0.00 0.00 -0.05 0.00 0.00 57.45 53.60 1nqt n PHE 266 Cb 1.48 -0.76 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 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 1.43 1.17 0.31 1.37 0.00 -0.25 -4.93 105.19 104.29 1nqt n GLY 267 Ca 0.26 0.08 -0.05 0.00 0.00 0.00 0.00 46.02 46.31 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 0.11 -1.07 -3.50 4.61 0.00 -1.23 -4.88 120.51 114.54 1nqt n ALA 268 Ca 0.00 0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.13 1nqt n ALA 268 Cb 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 19.45 19.17 1nqt n ALA 268 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nqt s LYS 269 N -0.07 2.73 0.23 0.00 2.20 0.10 -4.18 119.74 120.75 1nqt s LYS 269 Ca 0.06 -1.07 -0.30 0.00 -0.36 0.00 0.00 55.97 54.30 1nqt s LYS 269 Cb -0.09 -3.20 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 1nqt s LYS 269 CO 0.05 -0.52 1.21 0.00 -0.36 0.00 0.00 175.35 175.73 1nqt n ILE 271 N 1.96 0.24 -3.65 0.00 3.06 -0.24 -2.18 119.36 118.55 1nqt n ILE 271 Ca 0.03 -0.39 -0.02 0.00 -2.50 0.00 0.00 62.75 59.87 1nqt n ILE 271 Cb 0.44 1.14 -0.06 0.00 0.54 0.00 0.00 39.64 41.69 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 -0.24 -2.37 -0.18 1.51 0.00 -1.26 -2.70 121.76 116.53 1nqt s ALA 272 Ca 0.00 2.05 -0.05 0.00 0.00 0.00 0.00 51.96 53.96 1nqt s ALA 272 Cb 0.00 -1.78 0.07 0.00 0.00 0.00 0.00 23.12 21.41 1nqt s ALA 272 CO 0.00 -0.30 0.14 0.08 0.00 0.00 0.00 175.76 175.68 1nqt s VAL 273 N 1.00 -0.18 0.00 0.00 1.01 -1.25 -1.80 120.40 119.18 1nqt s VAL 273 Ca -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1nqt s VAL 273 Cb -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.74 1nqt s VAL 273 CO -0.12 -0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.34 1nqt n GLY 274 N 5.29 0.60 0.00 4.51 0.00 -1.09 -2.39 105.19 112.12 1nqt n GLY 274 Ca -0.06 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1nqt n GLY 274 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nqt n GLU 275 N 0.00 -2.32 0.26 1.61 1.02 -0.95 -4.05 120.64 116.22 1nqt n GLU 275 Ca 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.29 1nqt n GLU 275 Cb 0.00 0.00 0.58 0.00 -0.02 0.00 0.00 31.44 32.00 1nqt n GLU 275 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1nqt h SER 276 N 0.00 0.00 0.00 1.62 4.64 -1.99 -3.34 113.55 114.48 1nqt h SER 276 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nqt h SER 276 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1nqt h SER 276 CO 0.00 0.07 0.00 0.47 -0.87 0.00 0.00 176.83 176.50 1nqt n ASP 277 N -3.19 0.00 0.00 4.97 8.00 -1.26 -5.09 116.55 119.98 1nqt n ASP 277 Ca 0.01 0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.82 1nqt n ASP 277 Cb 0.36 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 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 1.92 4.29 3.81 0.44 0.00 -1.25 -5.01 105.19 109.39 1nqt n GLY 278 Ca 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 46.02 45.43 1nqt n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt s SER 279 N 1.00 -0.10 0.25 1.61 0.01 -1.26 -2.23 113.70 112.98 1nqt s SER 279 Ca 0.00 -0.57 -0.00 0.00 1.31 0.00 0.00 55.95 56.68 1nqt s SER 279 Cb 0.00 0.54 -0.03 0.00 0.21 0.00 0.00 66.02 66.73 1nqt s SER 279 CO 0.00 -1.02 0.23 -0.63 0.41 0.00 0.00 173.24 172.22 1nqt s ILE 280 N -2.85 0.00 -0.13 1.44 1.01 -1.00 -3.48 121.20 116.19 1nqt s ILE 280 Ca 0.16 -1.91 -0.31 0.00 0.00 0.00 0.00 60.65 58.58 1nqt s ILE 280 Cb -0.02 -2.48 0.13 0.00 0.01 0.00 0.00 42.46 40.09 1nqt s ILE 280 CO 0.04 0.00 1.06 0.86 0.00 0.00 0.00 174.94 176.91 1nqt s TRP 281 N -3.89 -0.25 0.00 3.97 -0.11 -0.76 -3.80 118.94 114.09 1nqt s TRP 281 Ca 0.37 0.27 0.00 0.00 1.22 0.00 0.00 56.10 57.96 1nqt s TRP 281 Cb 0.05 0.50 0.00 0.00 -1.50 0.00 0.00 33.47 32.52 1nqt s TRP 281 CO 0.16 -0.33 0.00 -1.71 -4.62 0.00 0.00 176.95 170.45 1nqt n ASN 282 N 0.14 0.00 0.00 5.86 2.85 -1.10 -2.94 115.26 120.07 1nqt n ASN 282 Ca -0.05 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 1nqt n ASN 282 Cb 0.59 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.61 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 -0.09 1.20 -0.02 -1.26 0.22 135.00 135.04 1nqt n PRO 283 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.28 1nqt n PRO 283 Cb 0.00 -1.29 -0.12 0.00 -0.02 0.00 0.00 33.50 32.07 1nqt n PRO 283 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1nqt n ASP 284 N -0.36 2.02 0.00 2.55 10.43 -1.26 -5.07 116.55 124.86 1nqt n ASP 284 Ca 0.00 -0.01 0.00 0.00 2.57 0.00 0.00 54.79 57.35 1nqt n ASP 284 Cb 0.00 -0.57 0.00 0.00 1.84 0.00 0.00 41.12 42.39 1nqt n ASP 284 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1nqt n GLY 285 N 2.13 3.28 2.93 0.44 0.00 0.13 -5.01 105.19 109.10 1nqt n GLY 285 Ca -0.42 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.00 -0.09 -0.43 -0.61 1.01 -0.93 -4.83 121.20 113.33 1nqt s ILE 286 Ca 0.00 0.20 -0.21 0.00 0.00 0.00 0.00 60.65 60.65 1nqt s ILE 286 Cb 0.00 -0.27 0.02 0.00 0.01 0.00 0.00 42.46 42.22 1nqt s ILE 286 CO 0.00 0.08 0.65 -0.62 0.00 0.00 0.00 174.94 175.05 1nqt s ASP 287 N 1.37 6.33 0.11 3.58 2.15 -1.26 -4.53 116.67 124.41 1nqt s ASP 287 Ca -0.07 -0.29 -0.21 0.00 0.43 0.00 0.00 52.55 52.41 1nqt s ASP 287 Cb -0.12 -2.32 -0.05 0.00 -0.30 0.00 0.00 42.92 40.14 1nqt s ASP 287 CO -0.06 -0.77 1.10 -2.65 -0.17 0.00 0.00 175.17 172.62 1nqt n PRO 288 N 6.26 -0.29 -0.15 4.34 -0.02 -1.26 -0.43 135.00 143.45 1nqt n PRO 288 Ca -0.01 1.08 -0.06 0.00 -2.02 0.00 0.00 63.50 62.48 1nqt n PRO 288 Cb 0.48 -1.59 -0.00 0.00 -0.02 0.00 0.00 33.50 32.37 1nqt n PRO 288 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1nqt h LYS 289 N 0.00 -0.19 0.46 -0.52 1.63 -1.98 0.51 116.57 116.47 1nqt h LYS 289 Ca 0.11 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 1nqt h LYS 289 Cb 0.27 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.94 1nqt h LYS 289 CO -0.62 -0.13 -0.34 0.93 -3.45 0.00 0.00 179.45 175.84 1nqt h GLU 290 N -0.20 -0.73 0.00 1.90 5.08 -1.17 -0.32 114.58 119.13 1nqt h GLU 290 Ca 0.20 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1nqt h GLU 290 Cb 0.53 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1nqt h GLU 290 CO -0.59 -0.49 0.00 -0.11 -1.00 0.00 0.00 179.01 176.82 1nqt n LEU 291 N -4.45 0.33 -0.07 1.33 7.94 -0.42 -0.98 117.00 120.68 1nqt n LEU 291 Ca -0.09 0.65 -0.12 0.00 -1.11 0.00 0.00 56.01 55.34 1nqt n LEU 291 Cb 0.33 -0.68 -0.09 0.00 0.53 0.00 0.00 43.42 43.50 1nqt n LEU 291 CO 0.21 -0.74 0.09 -0.08 -1.11 0.00 0.00 177.39 175.76 1nqt h GLU 292 N 0.00 0.00 -0.33 1.96 4.81 0.61 -2.98 114.58 118.66 1nqt h GLU 292 Ca 0.00 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1nqt h GLU 292 Cb 0.03 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1nqt h GLU 292 CO 0.00 0.74 0.04 -0.44 -0.73 0.00 0.00 179.01 178.62 1nqt h ASP 293 N -1.00 -0.04 -0.00 1.04 3.32 0.12 -2.19 116.42 117.66 1nqt h ASP 293 Ca -0.07 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1nqt h ASP 293 Cb 0.83 0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.42 1nqt h ASP 293 CO -0.04 0.01 -0.51 0.15 -1.72 0.00 0.00 179.24 177.14 1nqt h PHE 294 N 0.15 -1.48 0.00 4.55 3.57 -1.19 1.16 116.94 123.69 1nqt h PHE 294 Ca 0.16 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1nqt h PHE 294 Cb 0.19 0.65 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1nqt h PHE 294 CO -0.20 -0.56 0.00 1.17 -2.23 0.00 0.00 178.31 176.49 1nqt n LYS 295 N -5.46 0.04 -0.09 1.11 4.81 -0.99 -1.99 118.16 115.58 1nqt n LYS 295 Ca -0.07 0.25 -0.15 0.00 -0.87 0.00 0.00 58.31 57.47 1nqt n LYS 295 Cb 0.39 -1.50 -0.08 0.00 0.02 0.00 0.00 35.03 33.86 1nqt n LYS 295 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1nqt n LEU 296 N -1.27 2.60 -0.08 3.14 4.77 0.73 -4.47 117.00 122.42 1nqt n LEU 296 Ca 0.01 -0.02 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1nqt n LEU 296 Cb 0.02 -0.62 0.37 0.00 -2.33 0.00 0.00 43.42 40.86 1nqt n LEU 296 CO 0.02 0.71 1.19 -0.61 -1.33 0.00 0.00 177.39 177.37 1nqt h GLN 297 N -0.17 0.68 -1.92 3.23 4.15 0.17 -3.43 115.11 117.81 1nqt h GLN 297 Ca -0.43 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 58.99 1nqt h GLN 297 Cb 1.59 -0.15 -0.22 0.00 0.21 0.00 0.00 27.48 28.91 1nqt h GLN 297 CO -0.12 0.45 0.04 -3.38 -1.93 0.00 0.00 178.83 173.88 1nqt s HIS 298 N -5.61 -1.06 0.00 3.99 -3.43 -0.84 -5.09 115.29 103.25 1nqt s HIS 298 Ca -0.09 2.05 0.00 0.00 -0.80 0.00 0.00 55.06 56.22 1nqt s HIS 298 Cb 0.18 0.63 0.00 0.00 -1.43 0.00 0.00 32.58 31.96 1nqt s HIS 298 CO 0.75 -0.53 0.00 0.41 -2.00 0.00 0.00 174.74 173.37 1nqt n GLY 299 N 4.49 0.48 0.00 -1.38 0.00 -1.26 -4.59 105.19 102.93 1nqt n GLY 299 Ca -0.18 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1nqt n GLY 299 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nqt n SER 300 N 1.15 0.00 -0.03 1.61 3.41 -1.26 -4.91 113.62 113.58 1nqt n SER 300 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1nqt n SER 300 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1nqt n SER 300 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1nqt n ILE 301 N 0.00 0.46 -1.50 -1.33 -5.35 -1.26 -3.57 119.36 106.81 1nqt n ILE 301 Ca 0.00 -0.29 -0.51 0.00 -0.27 0.00 0.00 62.75 61.68 1nqt n ILE 301 Cb 0.00 -0.76 -0.05 0.00 -1.74 0.00 0.00 39.64 37.10 1nqt n ILE 301 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1nqt n LEU 302 N -2.23 0.29 0.00 7.28 4.32 -1.26 -2.46 117.00 122.93 1nqt n LEU 302 Ca -0.11 1.15 0.00 0.00 -0.02 0.00 0.00 56.01 57.03 1nqt n LEU 302 Cb 0.70 -1.06 0.00 0.00 -1.62 0.00 0.00 43.42 41.44 1nqt n LEU 302 CO 0.15 -1.99 0.00 0.61 -1.22 0.00 0.00 177.39 174.94 1nqt n GLY 303 N 1.83 0.50 3.74 -0.72 0.00 -1.26 -5.02 105.19 104.25 1nqt n GLY 303 Ca 0.17 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 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 3.30 1.04 1.61 5.36 -1.03 -5.03 117.98 121.24 1nqt s PHE 304 Ca 0.00 1.34 -0.14 0.00 -0.96 0.00 0.00 56.93 57.18 1nqt s PHE 304 Cb 0.00 -3.54 0.21 0.00 -0.34 0.00 0.00 43.02 39.35 1nqt s PHE 304 CO 0.00 -1.58 1.10 -2.14 -1.46 0.00 0.00 175.22 171.14 1nqt s PRO 305 N -0.49 0.10 -1.46 10.12 0.02 -1.26 -3.71 135.00 138.31 1nqt s PRO 305 Ca 0.53 0.37 -0.13 0.00 0.02 0.00 0.00 61.00 61.79 1nqt s PRO 305 Cb -0.35 -1.71 0.10 0.00 0.02 0.00 0.00 34.50 32.55 1nqt s PRO 305 CO 0.40 -2.92 0.69 1.17 -0.33 0.00 0.00 177.00 176.01 1nqt n LYS 306 N -4.28 -3.87 0.00 5.54 4.81 -1.26 -4.86 118.16 114.24 1nqt n LYS 306 Ca 0.07 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 57.99 1nqt n LYS 306 Cb 0.58 -5.25 0.00 0.00 0.02 0.00 0.00 35.03 30.38 1nqt n LYS 306 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nqt n ALA 307 N -4.03 0.00 0.00 3.14 0.00 -1.24 -4.93 120.51 113.45 1nqt n ALA 307 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1nqt n ALA 307 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1nqt n ALA 307 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nqt n LYS 308 N 0.00 0.00 -2.56 0.00 3.00 -1.15 -4.84 118.16 112.61 1nqt n LYS 308 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.90 1nqt n LYS 308 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.99 1nqt n LYS 308 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 1nqt s PRO 309 N 0.00 4.65 0.37 1.64 0.02 -1.26 -1.82 135.00 138.59 1nqt s PRO 309 Ca 0.00 1.68 0.07 0.00 0.02 0.00 0.00 61.00 62.77 1nqt s PRO 309 Cb 0.00 -3.27 -0.01 0.00 0.02 0.00 0.00 34.50 31.24 1nqt s PRO 309 CO 0.00 0.17 0.43 -0.47 -0.33 0.00 0.00 177.00 176.81 1nqt s TYR 310 N -0.49 2.91 -0.12 6.54 5.04 -1.23 -4.92 117.35 125.08 1nqt s TYR 310 Ca 0.47 -0.34 -0.01 0.00 -2.44 0.00 0.00 57.07 54.76 1nqt s TYR 310 Cb -0.29 -2.08 -0.02 0.00 0.35 0.00 0.00 41.96 39.92 1nqt s TYR 310 CO 0.35 -0.09 -0.09 -1.21 -1.34 0.00 0.00 175.55 173.16 1nqt s GLU 311 N -4.17 3.29 3.43 4.97 0.41 -1.26 -4.32 118.70 121.05 1nqt s GLU 311 Ca 0.47 -0.62 0.00 0.00 -0.41 0.00 0.00 54.97 54.42 1nqt s GLU 311 Cb -0.07 -2.69 0.00 0.00 -1.78 0.00 0.00 34.13 29.59 1nqt s GLU 311 CO 0.30 0.33 0.00 0.41 -0.49 0.00 0.00 175.26 175.81 1nqt n GLY 312 N 3.21 0.49 3.84 -1.39 0.00 -1.26 -4.88 105.19 105.19 1nqt n GLY 312 Ca -0.18 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 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 5.85 0.00 1.61 1.04 -1.26 -4.39 113.70 112.54 1nqt s SER 313 Ca 0.00 0.05 0.14 0.00 0.48 0.00 0.00 55.95 56.62 1nqt s SER 313 Cb 0.00 -1.65 0.51 0.00 0.10 0.00 0.00 66.02 64.98 1nqt s SER 313 CO 0.00 0.13 1.38 2.30 0.98 0.00 0.00 173.24 178.02 1nqt n ILE 314 N 0.07 0.27 0.70 -1.02 -0.00 -1.26 -4.21 119.36 113.90 1nqt n ILE 314 Ca -0.07 -0.32 0.06 0.00 -0.00 0.00 0.00 62.75 62.41 1nqt n ILE 314 Cb 0.53 0.19 0.33 0.00 -0.00 0.00 0.00 39.64 40.69 1nqt n ILE 314 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 1nqt n LEU 315 N 0.18 0.00 -0.11 7.28 4.77 -1.26 -1.44 117.00 126.43 1nqt n LEU 315 Ca 0.12 0.01 0.02 0.00 -0.03 0.00 0.00 56.01 56.13 1nqt n LEU 315 Cb 0.25 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 1nqt n LEU 315 CO 0.09 -0.01 0.37 -0.62 -1.33 0.00 0.00 177.39 175.89 1nqt n GLU 316 N -1.01 1.07 -2.10 3.23 1.02 -1.26 -4.60 120.64 116.99 1nqt n GLU 316 Ca 0.08 -1.21 -0.34 0.00 -0.02 0.00 0.00 57.16 55.68 1nqt n GLU 316 Cb 0.04 -0.80 0.02 0.00 -0.02 0.00 0.00 31.44 30.68 1nqt n GLU 316 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nqt s ALA 317 N -0.73 2.63 -0.32 0.62 0.00 -0.52 -4.54 121.76 118.90 1nqt s ALA 317 Ca 0.05 0.71 -0.25 0.00 0.00 0.00 0.00 51.96 52.47 1nqt s ALA 317 Cb 0.04 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.83 1nqt s ALA 317 CO 0.00 -0.92 0.85 0.34 0.00 0.00 0.00 175.76 176.04 1nqt s ASP 318 N -2.09 6.71 0.10 0.00 2.15 -1.26 -4.27 116.67 118.01 1nqt s ASP 318 Ca 0.70 0.70 -0.03 0.00 0.43 0.00 0.00 52.55 54.35 1nqt s ASP 318 Cb -0.22 -2.44 0.01 0.00 -0.30 0.00 0.00 42.92 39.98 1nqt s ASP 318 CO 0.32 -0.69 0.19 0.00 -0.17 0.00 0.00 175.17 174.82 1nqt n ASP 320 N -1.26 1.89 -4.16 0.00 10.43 0.19 -3.61 116.55 120.04 1nqt n ASP 320 Ca -0.02 0.44 -0.33 0.00 2.57 0.00 0.00 54.79 57.45 1nqt n ASP 320 Cb 0.15 -0.84 -0.16 0.00 1.84 0.00 0.00 41.12 42.12 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 2.28 -0.37 0.53 1.01 -0.74 -1.58 121.20 119.79 1nqt s ILE 321 Ca -0.27 -0.87 -0.13 0.00 0.00 0.00 0.00 60.65 59.38 1nqt s ILE 321 Cb 0.06 -1.96 0.01 0.00 0.01 0.00 0.00 42.46 40.58 1nqt s ILE 321 CO 0.41 0.52 0.24 -0.22 0.00 0.00 0.00 174.94 175.90 1nqt s LEU 322 N 1.24 4.73 -0.33 2.97 1.98 0.85 -1.20 118.68 128.92 1nqt s LEU 322 Ca 0.03 -0.74 -0.10 0.00 -2.89 0.00 0.00 54.13 50.43 1nqt s LEU 322 Cb -0.14 -2.10 0.01 0.00 0.66 0.00 0.00 46.19 44.62 1nqt s LEU 322 CO -0.10 -0.34 0.16 0.27 -1.89 0.00 0.00 176.35 174.45 1nqt s ILE 323 N 1.65 4.53 -0.60 6.68 -4.36 0.28 -2.05 121.20 127.34 1nqt s ILE 323 Ca 0.05 -0.59 -0.25 0.00 -0.26 0.00 0.00 60.65 59.59 1nqt s ILE 323 Cb -0.18 -3.38 0.04 0.00 1.25 0.00 0.00 42.46 40.18 1nqt s ILE 323 CO 0.09 -0.03 1.06 -2.84 0.24 0.00 0.00 174.94 173.46 1nqt s PRO 324 N 1.58 3.33 -0.57 0.37 0.02 -1.22 0.08 135.00 138.60 1nqt s PRO 324 Ca 0.04 -0.19 0.06 0.00 0.02 0.00 0.00 61.00 60.93 1nqt s PRO 324 Cb -0.18 -4.08 0.29 0.00 0.02 0.00 0.00 34.50 30.55 1nqt s PRO 324 CO 0.06 -1.67 0.80 0.00 -0.33 0.00 0.00 177.00 175.86 1nqt n ALA 325 N 8.01 3.97 -2.08 -1.55 0.00 0.34 -0.06 120.51 129.14 1nqt n ALA 325 Ca 0.03 -4.50 0.00 0.00 0.00 0.00 0.00 53.44 48.97 1nqt n ALA 325 Cb 0.48 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.10 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 0.44 0.00 -0.74 0.00 0.00 -1.23 -4.14 120.51 114.85 1nqt n ALA 326 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1nqt n ALA 326 Cb 0.44 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.09 1nqt n ALA 326 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nqt s SER 327 N 2.00 2.01 0.98 0.00 1.04 -1.26 -4.74 113.70 113.73 1nqt s SER 327 Ca 0.00 1.67 -0.12 0.00 0.48 0.00 0.00 55.95 57.98 1nqt s SER 327 Cb 0.00 -2.33 0.18 0.00 0.10 0.00 0.00 66.02 63.97 1nqt s SER 327 CO 0.00 -3.59 1.10 -1.61 0.98 0.00 0.00 173.24 170.12 1nqt s GLU 328 N -4.62 0.61 -0.13 4.02 2.02 -1.26 -4.41 118.70 114.93 1nqt s GLU 328 Ca 0.67 0.53 -0.05 0.00 0.02 0.00 0.00 54.97 56.13 1nqt s GLU 328 Cb -0.23 -1.76 0.01 0.00 0.10 0.00 0.00 34.13 32.25 1nqt s GLU 328 CO 0.61 -2.61 0.14 1.63 0.02 0.00 0.00 175.26 175.04 1nqt n LYS 329 N -4.09 -0.38 0.00 1.61 5.02 -0.17 -4.83 118.16 115.32 1nqt n LYS 329 Ca 0.06 0.25 0.05 0.00 -2.02 0.00 0.00 58.31 56.64 1nqt n LYS 329 Cb 0.57 -0.44 0.04 0.00 -0.02 0.00 0.00 35.03 35.18 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 -0.38 0.61 -3.51 1.97 7.27 -1.12 -4.80 117.38 117.42 1nqt n GLN 330 Ca -0.04 -1.06 -0.29 0.00 0.07 0.00 0.00 57.00 55.68 1nqt n GLN 330 Cb 0.15 -1.18 -0.12 0.00 2.41 0.00 0.00 30.24 31.49 1nqt n GLN 330 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1nqt s LEU 331 N -0.94 1.24 0.00 1.69 1.43 -0.91 -4.98 118.68 116.22 1nqt s LEU 331 Ca 0.12 -2.19 0.02 0.00 -1.03 0.00 0.00 54.13 51.05 1nqt s LEU 331 Cb 0.09 -0.50 0.03 0.00 0.03 0.00 0.00 46.19 45.84 1nqt s LEU 331 CO 0.14 -0.31 0.25 0.35 0.23 0.00 0.00 176.35 177.01 1nqt n THR 332 N 4.05 0.00 0.23 5.49 -2.24 -1.26 -1.51 114.28 119.04 1nqt n THR 332 Ca 0.10 -0.55 0.07 0.00 -2.27 0.00 0.00 64.05 61.40 1nqt n THR 332 Cb 0.37 -0.94 0.57 0.00 -2.10 0.00 0.00 70.33 68.23 1nqt n THR 332 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1nqt h LYS 333 N 0.00 0.03 0.00 -0.78 3.64 -1.94 -0.54 116.57 116.98 1nqt h LYS 333 Ca -0.08 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1nqt h LYS 333 Cb 0.37 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1nqt h LYS 333 CO 0.11 0.10 0.00 0.45 -2.27 0.00 0.00 179.45 177.84 1nqt n SER 334 N -4.45 0.00 -0.06 4.20 2.88 -1.26 -4.03 113.62 110.90 1nqt n SER 334 Ca -0.02 0.00 0.25 0.00 -1.33 0.00 0.00 58.87 57.76 1nqt n SER 334 Cb 0.15 0.00 0.71 0.00 -0.75 0.00 0.00 64.21 64.33 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 -0.50 -3.46 -0.00 -1.96 -3.32 115.58 106.34 1nqt h ASN 335 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 56.30 56.39 1nqt h ASN 335 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 38.32 38.23 1nqt h ASN 335 CO 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 177.43 177.28 1nqt n ALA 336 N -2.50 0.05 0.02 4.14 0.00 -0.21 -0.02 120.51 121.99 1nqt n ALA 336 Ca 0.14 0.53 -0.07 0.00 0.00 0.00 0.00 53.44 54.04 1nqt n ALA 336 Cb 0.85 -0.29 0.10 0.00 0.00 0.00 0.00 19.45 20.11 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 0.48 -0.14 0.00 0.11 -1.81 -3.26 132.00 127.39 1nqt h PRO 337 Ca 0.22 -0.27 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1nqt h PRO 337 Cb 0.34 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1nqt h PRO 337 CO -0.51 0.86 0.00 0.54 -0.21 0.00 0.00 178.00 178.68 1nqt n ARG 338 N -3.98 0.63 -3.19 1.05 3.00 0.97 -4.80 116.66 110.33 1nqt n ARG 338 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.85 57.43 1nqt n ARG 338 Cb 0.55 -1.07 -0.06 0.00 0.00 0.00 0.00 32.46 31.89 1nqt n ARG 338 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1nqt s VAL 339 N -1.78 4.90 -0.02 1.55 -7.23 -1.23 -4.68 120.40 111.91 1nqt s VAL 339 Ca 0.00 1.27 0.12 0.00 -1.81 0.00 0.00 61.98 61.55 1nqt s VAL 339 Cb 0.00 -3.94 -0.23 0.00 0.56 0.00 0.00 36.38 32.77 1nqt s VAL 339 CO 0.00 0.41 0.75 0.11 -0.31 0.00 0.00 175.10 176.06 1nqt h LYS 340 N 5.65 0.00 -6.84 4.82 1.79 -1.80 -3.48 116.57 116.71 1nqt h LYS 340 Ca -0.45 -0.01 -0.57 0.00 -2.18 0.00 0.00 60.65 57.44 1nqt h LYS 340 Cb 1.20 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 32.01 1nqt h LYS 340 CO 0.70 0.57 0.19 0.00 -1.08 0.00 0.00 179.45 179.82 1nqt n ALA 341 N -2.53 0.34 -0.07 3.86 0.00 -1.24 -4.73 120.51 116.15 1nqt n ALA 341 Ca -0.15 0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.22 1nqt n ALA 341 Cb 1.04 -2.14 -0.15 0.00 0.00 0.00 0.00 19.45 18.20 1nqt n ALA 341 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nqt n LYS 342 N -0.94 0.67 -5.09 0.00 4.76 -0.61 -4.93 118.16 112.02 1nqt n LYS 342 Ca 0.13 0.13 -0.32 0.00 -2.87 0.00 0.00 58.31 55.38 1nqt n LYS 342 Cb 0.46 -1.62 -0.16 0.00 -1.84 0.00 0.00 35.03 31.87 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 -2.53 2.35 -0.21 -0.18 1.01 -0.84 -1.71 121.20 119.09 1nqt s ILE 343 Ca -0.12 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.62 1nqt s ILE 343 Cb 0.07 -1.92 0.03 0.00 0.01 0.00 0.00 42.46 40.65 1nqt s ILE 343 CO 0.79 0.55 -0.15 -0.63 0.00 0.00 0.00 174.94 175.50 1nqt s ILE 344 N 0.30 2.20 -0.47 2.92 1.01 0.05 -0.10 121.20 127.10 1nqt s ILE 344 Ca -0.16 -1.17 -0.13 0.00 0.00 0.00 0.00 60.65 59.19 1nqt s ILE 344 Cb -0.17 -2.07 0.09 0.00 0.01 0.00 0.00 42.46 40.32 1nqt s ILE 344 CO 0.08 0.32 0.38 0.00 0.00 0.00 0.00 174.94 175.72 1nqt s ALA 345 N 1.24 3.49 0.07 9.38 0.00 -0.87 0.38 121.76 135.45 1nqt s ALA 345 Ca -0.00 -2.27 -0.30 0.00 0.00 0.00 0.00 51.96 49.39 1nqt s ALA 345 Cb -0.16 -2.98 -0.09 0.00 0.00 0.00 0.00 23.12 19.89 1nqt s ALA 345 CO -0.09 -1.80 1.84 -1.21 0.00 0.00 0.00 175.76 174.50 1nqt s GLU 346 N 1.54 4.15 -0.14 0.00 2.02 -0.22 -3.40 118.70 122.65 1nqt s GLU 346 Ca 0.04 2.53 0.16 0.00 0.02 0.00 0.00 54.97 57.72 1nqt s GLU 346 Cb -0.25 -3.83 0.43 0.00 0.10 0.00 0.00 34.13 30.57 1nqt s GLU 346 CO 0.04 -0.87 1.33 0.41 0.02 0.00 0.00 175.26 176.19 1nqt n GLY 347 N 4.30 4.05 3.59 -1.39 0.00 0.92 -4.13 105.19 112.53 1nqt n GLY 347 Ca 0.18 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.57 -0.62 -0.34 4.61 0.00 -1.17 -4.55 121.76 117.11 1nqt s ALA 348 Ca 0.36 -0.56 -0.23 0.00 0.00 0.00 0.00 51.96 51.54 1nqt s ALA 348 Cb 0.29 0.94 0.00 0.00 0.00 0.00 0.00 23.12 24.36 1nqt s ALA 348 CO 0.08 -0.85 0.75 -0.80 0.00 0.00 0.00 175.76 174.94 1nqt s ASN 349 N -2.95 6.56 -0.57 0.00 0.01 -1.26 -4.37 114.94 112.36 1nqt s ASN 349 Ca 0.16 0.42 -0.02 0.00 -0.71 0.00 0.00 52.86 52.71 1nqt s ASN 349 Cb -0.01 -2.38 -0.02 0.00 0.41 0.00 0.00 41.25 39.25 1nqt s ASN 349 CO 0.04 -0.66 0.49 0.61 -1.51 0.00 0.00 177.10 176.07 1nqt n GLY 350 N 4.45 -0.05 1.51 0.66 0.00 -1.26 -4.75 105.19 105.74 1nqt n GLY 350 Ca 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.48 4.12 -3.69 1.61 -0.04 -1.26 -1.00 135.00 132.26 1nqt n PRO 351 Ca -0.09 -3.05 -0.13 0.00 -0.04 0.00 0.00 63.50 60.19 1nqt n PRO 351 Cb 0.57 -2.11 -0.13 0.00 -0.04 0.00 0.00 33.50 31.80 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 -2.81 -0.24 0.96 0.52 -4.23 -1.26 -2.13 115.64 106.45 1nqt s THR 352 Ca 0.50 0.21 -0.12 0.00 -1.18 0.00 0.00 61.69 61.10 1nqt s THR 352 Cb 0.39 -0.43 0.16 0.00 1.34 0.00 0.00 72.50 73.96 1nqt s THR 352 CO 0.13 0.09 1.10 0.42 -0.54 0.00 0.00 174.62 175.82 1nqt s THR 353 N 1.88 2.25 0.16 3.99 -4.23 -0.57 -4.83 115.64 114.29 1nqt s THR 353 Ca -0.04 0.08 -0.12 0.00 -1.18 0.00 0.00 61.69 60.43 1nqt s THR 353 Cb -0.11 -2.61 0.05 0.00 1.34 0.00 0.00 72.50 71.17 1nqt s THR 353 CO -0.09 -0.11 1.68 -0.65 -0.54 0.00 0.00 174.62 174.91 1nqt h PRO 354 N -1.74 0.86 -0.09 3.99 0.11 -1.99 -0.78 132.00 132.36 1nqt h PRO 354 Ca -0.53 -0.19 -0.05 0.00 0.11 0.00 0.00 66.00 65.34 1nqt h PRO 354 Cb 1.32 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1nqt h PRO 354 CO 0.57 0.79 -0.19 0.93 -0.21 0.00 0.00 178.00 179.89 1nqt h GLU 355 N 0.76 0.15 -0.27 1.05 4.39 -1.94 -1.23 114.58 117.49 1nqt h GLU 355 Ca 0.17 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.69 1nqt h GLU 355 Cb 0.31 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1nqt h GLU 355 CO -0.00 0.34 -0.44 0.00 -1.16 0.00 0.00 179.01 177.75 1nqt h ALA 356 N 1.67 0.72 0.72 3.43 0.00 -1.64 -2.83 119.26 121.33 1nqt h ALA 356 Ca 0.03 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1nqt h ALA 356 Cb 0.43 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1nqt h ALA 356 CO 0.03 0.67 -0.34 -0.44 0.00 0.00 0.00 179.25 179.16 1nqt h ASP 357 N 0.55 -0.82 -1.05 0.00 3.32 0.05 -1.70 116.42 116.78 1nqt h ASP 357 Ca 0.04 0.02 0.30 0.00 0.02 0.00 0.00 57.03 57.40 1nqt h ASP 357 Cb 0.98 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 40.69 1nqt h ASP 357 CO 0.09 -0.57 0.74 0.50 -1.72 0.00 0.00 179.24 178.28 1nqt h LYS 358 N -0.98 0.09 0.21 3.56 3.64 -1.38 0.18 116.57 121.89 1nqt h LYS 358 Ca -0.10 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1nqt h LYS 358 Cb 0.74 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1nqt h LYS 358 CO 0.16 0.06 -0.10 0.97 -2.27 0.00 0.00 179.45 178.27 1nqt h ILE 359 N 0.09 0.00 -1.22 2.00 6.09 -1.24 -2.49 117.51 120.75 1nqt h ILE 359 Ca 0.52 -0.33 0.37 0.00 -1.37 0.00 0.00 64.86 64.05 1nqt h ILE 359 Cb 1.89 0.00 -0.11 0.00 0.47 0.00 0.00 36.82 39.07 1nqt h ILE 359 CO -0.07 0.00 0.79 -0.26 -3.07 0.00 0.00 178.15 175.54 1nqt h PHE 360 N -0.62 0.52 0.00 2.19 0.04 -0.19 1.65 116.94 120.53 1nqt h PHE 360 Ca -0.03 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.68 1nqt h PHE 360 Cb 0.22 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 1nqt h PHE 360 CO 0.04 -0.08 -0.39 1.25 -0.60 0.00 0.00 178.31 178.52 1nqt h LEU 361 N 0.20 0.00 0.46 1.54 6.46 -0.70 0.99 115.31 124.25 1nqt h LEU 361 Ca 0.72 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 58.45 1nqt h LEU 361 Cb 2.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.10 1nqt h LEU 361 CO -0.33 0.39 -0.22 -0.08 -0.62 0.00 0.00 178.44 177.58 1nqt h GLU 362 N 0.00 -0.59 -5.52 1.25 4.22 0.29 -3.33 114.58 110.89 1nqt h GLU 362 Ca -0.00 0.04 -0.67 0.00 0.08 0.00 0.00 59.36 58.80 1nqt h GLU 362 Cb 0.83 0.14 -0.13 0.00 0.50 0.00 0.00 28.75 30.09 1nqt h GLU 362 CO 0.05 -0.40 1.56 -0.98 -2.18 0.00 0.00 179.01 177.07 1nqt s ARG 363 N -3.76 3.83 0.00 1.92 1.70 -0.89 -4.86 118.95 116.90 1nqt s ARG 363 Ca -0.09 -1.85 0.00 0.00 -0.47 0.00 0.00 55.73 53.32 1nqt s ARG 363 Cb 0.01 -5.26 0.00 0.00 -0.57 0.00 0.00 34.95 29.12 1nqt s ARG 363 CO 0.27 -2.04 0.00 0.09 -1.08 0.00 0.00 175.30 172.54 1nqt n ASN 364 N 7.56 0.00 -4.12 -2.89 3.02 -1.20 -4.71 115.26 112.92 1nqt n ASN 364 Ca 0.37 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.58 1nqt n ASN 364 Cb 0.47 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.50 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 0.00 2.65 -0.21 2.41 -1.09 0.33 -4.86 121.20 120.44 1nqt s ILE 365 Ca 0.00 -1.58 -0.29 0.00 -2.23 0.00 0.00 60.65 56.55 1nqt s ILE 365 Cb 0.00 -2.58 -0.03 0.00 -1.58 0.00 0.00 42.46 38.27 1nqt s ILE 365 CO 0.00 -0.14 1.57 -0.32 -1.23 0.00 0.00 174.94 174.81 1nqt s MET 366 N 1.16 3.88 -0.21 2.79 1.75 -0.69 -4.53 119.30 123.45 1nqt s MET 366 Ca -0.05 1.68 -0.09 0.00 -1.25 0.00 0.00 55.69 55.98 1nqt s MET 366 Cb -0.20 -4.00 -0.04 0.00 2.84 0.00 0.00 34.83 33.43 1nqt s MET 366 CO -0.03 -1.19 0.11 0.08 -0.65 0.00 0.00 175.02 173.33 1nqt s VAL 367 N 4.89 5.01 -0.40 10.11 1.01 -1.26 -0.77 120.40 138.99 1nqt s VAL 367 Ca 0.69 0.05 -0.10 0.00 0.00 0.00 0.00 61.98 62.62 1nqt s VAL 367 Cb -0.25 -3.30 0.05 0.00 0.00 0.00 0.00 36.38 32.88 1nqt s VAL 367 CO 0.28 0.40 0.24 -0.63 0.00 0.00 0.00 175.10 175.39 1nqt s ILE 368 N 0.75 4.45 0.09 2.22 1.01 0.16 -4.33 121.20 125.55 1nqt s ILE 368 Ca 0.06 -1.11 -0.36 0.00 0.00 0.00 0.00 60.65 59.24 1nqt s ILE 368 Cb -0.13 -3.59 -0.18 0.00 0.01 0.00 0.00 42.46 38.57 1nqt s ILE 368 CO 0.02 -0.37 1.12 -2.65 0.00 0.00 0.00 174.94 173.06 1nqt n PRO 369 N 4.97 0.63 -0.18 2.79 -0.02 -1.26 -1.06 135.00 140.87 1nqt n PRO 369 Ca -0.11 0.23 -0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1nqt n PRO 369 Cb 0.44 -1.72 0.09 0.00 -0.02 0.00 0.00 33.50 32.29 1nqt n PRO 369 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1nqt h ASP 370 N 3.38 -0.01 -0.06 2.55 -0.00 -1.81 0.71 116.42 121.19 1nqt h ASP 370 Ca -0.46 0.10 0.02 0.00 -0.00 0.00 0.00 57.03 56.69 1nqt h ASP 370 Cb 1.38 0.15 -0.00 0.00 -0.00 0.00 0.00 39.33 40.86 1nqt h ASP 370 CO 0.69 0.01 0.78 0.25 -0.00 0.00 0.00 179.24 180.98 1nqt h LEU 371 N 0.25 0.00 0.00 0.15 5.85 -1.90 -0.59 115.31 119.07 1nqt h LEU 371 Ca 0.29 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1nqt h LEU 371 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1nqt h LEU 371 CO -0.38 0.00 -0.67 0.00 -0.34 0.00 0.00 178.44 177.05 1nqt n TYR 372 N -2.68 0.00 -0.00 1.25 4.19 0.03 -4.43 117.16 115.51 1nqt n TYR 372 Ca 0.01 0.00 -0.02 0.00 3.31 0.00 0.00 57.90 61.19 1nqt n TYR 372 Cb 0.82 0.16 0.24 0.00 0.49 0.00 0.00 39.34 41.05 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 0.52 -4.77 2.98 5.85 0.56 -2.87 115.31 117.59 1nqt h LEU 373 Ca 0.00 -0.14 -0.67 0.00 0.84 0.00 0.00 57.88 57.92 1nqt h LEU 373 Cb 0.67 -0.14 -0.24 0.00 0.37 0.00 0.00 40.66 41.32 1nqt h LEU 373 CO 0.00 0.67 0.82 -3.20 -0.34 0.00 0.00 178.44 176.39 1nqt n ASN 374 N -4.20 7.17 -0.08 1.25 5.15 -0.25 -3.59 115.26 120.71 1nqt n ASN 374 Ca 0.01 -3.61 0.02 0.00 -0.60 0.00 0.00 54.58 50.40 1nqt n ASN 374 Cb 0.33 -1.12 -0.00 0.00 -0.53 0.00 0.00 39.78 38.45 1nqt n ASN 374 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nqt n ALA 375 N -0.07 2.52 -0.26 5.20 0.00 -1.08 -4.68 120.51 122.14 1nqt n ALA 375 Ca 0.52 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.64 1nqt n ALA 375 Cb 0.36 -0.15 0.10 0.00 0.00 0.00 0.00 19.45 19.76 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 0.95 1.07 0.75 0.00 0.00 -1.81 -0.60 103.07 103.43 1nqt h GLY 376 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.04 1nqt h GLY 376 CO 0.00 0.24 0.15 -1.33 0.00 0.00 0.00 176.54 175.60 1nqt h GLY 377 N 0.83 0.47 0.61 4.60 0.00 -1.83 -1.43 103.07 106.31 1nqt h GLY 377 Ca 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 1nqt h GLY 377 CO -0.14 0.06 -0.48 -2.08 0.00 0.00 0.00 176.54 173.89 1nqt h VAL 378 N 0.31 0.05 -0.32 4.60 2.07 -1.80 0.11 116.25 121.28 1nqt h VAL 378 Ca 0.16 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.71 1nqt h VAL 378 Cb 0.11 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1nqt h VAL 378 CO -0.14 0.00 -0.22 0.74 0.02 0.00 0.00 177.57 177.97 1nqt h THR 379 N -1.02 0.00 -0.62 2.57 2.02 -0.67 0.42 112.91 115.61 1nqt h THR 379 Ca -0.07 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.24 1nqt h THR 379 Cb 0.87 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.17 1nqt h THR 379 CO -0.02 0.00 -0.00 0.58 0.37 0.00 0.00 175.52 176.45 1nqt h VAL 380 N -0.04 0.49 -0.77 3.16 2.07 -1.10 -0.75 116.25 119.30 1nqt h VAL 380 Ca 0.05 -0.04 0.22 0.00 0.82 0.00 0.00 66.70 67.76 1nqt h VAL 380 Cb 0.18 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1nqt h VAL 380 CO -0.33 0.02 0.60 0.77 0.02 0.00 0.00 177.57 178.65 1nqt h SER 381 N 0.11 0.00 -0.39 0.57 4.64 0.25 1.04 113.55 119.77 1nqt h SER 381 Ca 0.32 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.61 1nqt h SER 381 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 1nqt h SER 381 CO -0.53 0.00 0.11 0.22 -0.87 0.00 0.00 176.83 175.76 1nqt h TYR 382 N 0.00 0.65 0.00 4.77 -0.00 0.41 -2.09 116.97 120.70 1nqt h TYR 382 Ca 0.37 -0.07 -0.08 0.00 -0.00 0.00 0.00 58.73 58.95 1nqt h TYR 382 Cb 1.56 -0.18 -0.01 0.00 -0.00 0.00 0.00 36.73 38.10 1nqt h TYR 382 CO 0.00 0.61 -0.39 0.74 -0.00 0.00 0.00 178.16 179.13 1nqt h PHE 383 N 0.49 0.00 -0.15 -3.82 0.05 0.11 -0.74 116.94 112.88 1nqt h PHE 383 Ca 0.13 0.00 -0.15 0.00 3.82 0.00 0.00 57.97 61.76 1nqt h PHE 383 Cb 0.28 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.22 1nqt h PHE 383 CO 0.01 0.39 -0.56 1.49 -0.18 0.00 0.00 178.31 179.46 1nqt h GLU 384 N 0.00 0.45 0.63 1.51 4.81 -0.57 0.13 114.58 121.54 1nqt h GLU 384 Ca -0.00 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 58.91 1nqt h GLU 384 Cb 0.74 0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.16 1nqt h GLU 384 CO 0.05 0.89 -0.30 2.35 -0.73 0.00 0.00 179.01 181.27 1nqt h TRP 385 N 0.34 -0.79 -0.68 0.92 7.01 -0.84 -1.80 115.95 120.11 1nqt h TRP 385 Ca 0.00 -0.02 0.15 0.00 2.11 0.00 0.00 58.89 61.13 1nqt h TRP 385 Cb 1.09 0.26 -0.12 0.00 -2.10 0.00 0.00 29.16 28.29 1nqt h TRP 385 CO 0.04 -0.49 0.02 -0.07 -2.79 0.00 0.00 178.44 175.14 1nqt h LEU 386 N -1.03 -0.28 -0.72 0.65 3.38 -1.12 0.40 115.31 116.59 1nqt h LEU 386 Ca -0.09 0.17 0.16 0.00 0.09 0.00 0.00 57.88 58.21 1nqt h LEU 386 Cb 0.65 0.29 -0.11 0.00 0.09 0.00 0.00 40.66 41.58 1nqt h LEU 386 CO 0.14 -0.13 0.13 0.50 0.09 0.00 0.00 178.44 179.17 1nqt h LYS 387 N 0.12 0.22 -0.56 1.13 3.64 -0.53 0.35 116.57 120.94 1nqt h LYS 387 Ca 0.37 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.75 1nqt h LYS 387 Cb 0.61 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1nqt h LYS 387 CO -0.58 0.15 0.35 -0.91 -2.27 0.00 0.00 179.45 176.18 1nqt h ASN 388 N 0.23 0.58 0.47 4.20 2.35 0.66 -2.47 115.58 121.59 1nqt h ASN 388 Ca 0.40 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.10 1nqt h ASN 388 Cb 0.69 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1nqt h ASN 388 CO -0.53 0.41 -0.25 -0.07 -1.65 0.00 0.00 177.43 175.33 1nqt h LEU 389 N 0.70 0.00 0.00 1.61 3.38 0.47 -2.71 115.31 118.76 1nqt h LEU 389 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1nqt h LEU 389 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1nqt h LEU 389 CO -0.08 0.25 -0.56 0.78 0.09 0.00 0.00 178.44 178.92 1nqt h ASN 390 N 0.00 0.00 -1.00 -0.43 2.35 -0.25 -3.48 115.58 112.77 1nqt h ASN 390 Ca -0.00 -0.06 -0.39 0.00 -0.55 0.00 0.00 56.30 55.29 1nqt h ASN 390 Cb 0.56 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.77 1nqt h ASN 390 CO 0.03 0.03 -0.35 1.41 -1.65 0.00 0.00 177.43 176.90 1nqt n HIS 391 N -2.56 -0.05 -3.78 1.19 8.25 -0.96 -4.96 115.22 112.36 1nqt n HIS 391 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.36 1nqt n HIS 391 Cb 0.50 -3.32 -0.11 0.00 1.12 0.00 0.00 29.99 28.18 1nqt n HIS 391 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1nqt s VAL 392 N -2.62 0.01 0.12 1.59 1.01 -1.26 -5.11 120.40 114.15 1nqt s VAL 392 Ca 0.00 -0.07 -0.31 0.00 0.00 0.00 0.00 61.98 61.60 1nqt s VAL 392 Cb 0.00 -0.40 -0.08 0.00 0.00 0.00 0.00 36.38 35.90 1nqt s VAL 392 CO 0.00 -0.04 1.42 -0.94 0.00 0.00 0.00 175.10 175.54 1nqt s SER 393 N -0.05 6.78 0.08 3.32 1.04 -1.26 -4.88 113.70 118.73 1nqt s SER 393 Ca -0.02 2.38 -0.37 0.00 0.48 0.00 0.00 55.95 58.43 1nqt s SER 393 Cb -0.02 -2.59 -0.18 0.00 0.10 0.00 0.00 66.02 63.33 1nqt s SER 393 CO 0.01 -0.68 1.16 -1.22 0.98 0.00 0.00 173.24 173.48 1nqt n TYR 394 N 3.94 1.03 0.00 5.02 4.02 -1.26 -1.57 117.16 128.35 1nqt n TYR 394 Ca 0.12 0.82 0.00 0.00 -0.01 0.00 0.00 57.90 58.82 1nqt n TYR 394 Cb 0.42 -2.21 0.00 0.00 -0.02 0.00 0.00 39.34 37.52 1nqt n TYR 394 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nqt n GLY 395 N 2.03 2.47 0.00 2.72 0.00 -1.26 -4.25 105.19 106.90 1nqt n GLY 395 Ca 0.18 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1nqt n GLY 395 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nqt n ARG 396 N 0.00 -0.00 -3.05 1.61 0.00 -0.61 0.53 116.66 115.15 1nqt n ARG 396 Ca 0.00 0.01 -0.26 0.00 -0.00 0.00 0.00 57.85 57.61 1nqt n ARG 396 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 32.46 32.39 1nqt n ARG 396 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1nqt n LEU 397 N -2.64 3.71 0.00 6.15 4.32 -1.26 -4.74 117.00 122.53 1nqt n LEU 397 Ca 0.00 -5.52 0.00 0.00 -0.02 0.00 0.00 56.01 50.47 1nqt n LEU 397 Cb 0.02 -0.34 0.00 0.00 -1.62 0.00 0.00 43.42 41.47 1nqt n LEU 397 CO 0.00 2.30 0.00 0.35 -1.22 0.00 0.00 177.39 178.82 1nqt n THR 398 N 0.02 0.00 -0.27 -5.08 -2.24 0.19 -4.97 114.28 101.93 1nqt n THR 398 Ca 0.30 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1nqt n THR 398 Cb 0.44 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.82 0.10 4.78 0.05 -1.79 -0.34 116.94 120.56 1nqt h PHE 399 Ca 0.00 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.81 1nqt h PHE 399 Cb 0.00 -0.26 0.00 0.00 2.00 0.00 0.00 35.95 37.70 1nqt h PHE 399 CO 0.00 0.39 -0.05 -0.22 -0.18 0.00 0.00 178.31 178.25 1nqt h LYS 400 N 0.80 -0.13 -0.57 1.51 1.63 -1.92 -2.47 116.57 115.42 1nqt h LYS 400 Ca 0.35 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 60.32 1nqt h LYS 400 Cb 0.23 0.03 -0.11 0.00 -0.60 0.00 0.00 32.23 31.78 1nqt h LYS 400 CO -0.20 -0.09 0.01 0.98 -3.45 0.00 0.00 179.45 176.71 1nqt n TYR 401 N -2.55 0.37 0.28 1.91 9.36 -1.15 -0.09 117.16 125.28 1nqt n TYR 401 Ca -0.02 0.69 -0.11 0.00 3.32 0.00 0.00 57.90 61.78 1nqt n TYR 401 Cb 0.05 -0.93 -0.05 0.00 -0.63 0.00 0.00 39.34 37.78 1nqt n TYR 401 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1nqt h GLU 402 N 0.00 -0.69 -1.00 2.98 4.81 -1.10 -0.65 114.58 118.92 1nqt h GLU 402 Ca 0.35 0.05 0.35 0.00 -0.13 0.00 0.00 59.36 59.97 1nqt h GLU 402 Cb 0.72 0.16 -0.18 0.00 0.63 0.00 0.00 28.75 30.07 1nqt h GLU 402 CO -0.54 -0.46 0.30 -0.09 -0.73 0.00 0.00 179.01 177.49 1nqt h ARG 403 N -0.84 0.01 0.59 1.92 1.12 -0.00 0.59 114.38 117.76 1nqt h ARG 403 Ca -0.07 -0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.77 1nqt h ARG 403 Cb 0.55 -0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.52 1nqt h ARG 403 CO 0.12 0.00 -0.28 -0.44 -3.11 0.00 0.00 179.97 176.26 1nqt h ASP 404 N 0.01 -0.67 -1.03 -3.80 3.45 -1.11 -2.08 116.42 111.19 1nqt h ASP 404 Ca 0.73 0.02 0.36 0.00 0.43 0.00 0.00 57.03 58.57 1nqt h ASP 404 Cb 1.77 0.17 -0.15 0.00 -0.56 0.00 0.00 39.33 40.56 1nqt h ASP 404 CO -0.84 -0.28 0.59 0.28 -1.57 0.00 0.00 179.24 177.42 1nqt h SER 405 N -1.18 0.44 0.00 6.45 0.02 0.10 -0.32 113.55 119.06 1nqt h SER 405 Ca -0.08 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1nqt h SER 405 Cb 0.60 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1nqt h SER 405 CO 0.13 -0.22 0.00 0.59 -1.14 0.00 0.00 176.83 176.20 1nqt n ASN 406 N -5.06 0.00 -0.32 3.07 5.03 0.17 -1.92 115.26 116.23 1nqt n ASN 406 Ca 0.34 0.94 0.27 0.00 0.87 0.00 0.00 54.58 56.99 1nqt n ASN 406 Cb 1.11 -0.48 0.50 0.00 -1.02 0.00 0.00 39.78 39.88 1nqt n ASN 406 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1nqt n TYR 407 N -1.94 1.00 0.04 3.10 0.53 -0.47 0.19 117.16 119.61 1nqt n TYR 407 Ca 0.00 1.17 0.00 0.00 -1.02 0.00 0.00 57.90 58.05 1nqt n TYR 407 Cb 0.00 -1.47 0.31 0.00 -1.03 0.00 0.00 39.34 37.15 1nqt n TYR 407 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1nqt h HIS 408 N 0.00 0.45 0.29 -0.72 3.86 -1.02 0.27 115.15 118.28 1nqt h HIS 408 Ca 0.77 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.91 1nqt h HIS 408 Cb 1.93 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 30.27 1nqt h HIS 408 CO -0.15 0.51 -0.17 -0.07 0.86 0.00 0.00 177.93 178.91 1nqt h LEU 409 N 0.41 -0.44 -0.57 2.43 -0.00 0.29 -0.96 115.31 116.47 1nqt h LEU 409 Ca 0.08 0.02 0.10 0.00 -0.00 0.00 0.00 57.88 58.09 1nqt h LEU 409 Cb 0.40 0.13 -0.11 0.00 -0.00 0.00 0.00 40.66 41.08 1nqt h LEU 409 CO 0.02 -0.27 -0.33 -0.07 -0.00 0.00 0.00 178.44 177.79 1nqt h LEU 410 N -0.43 -1.15 -1.08 1.67 3.38 -1.24 0.74 115.31 117.19 1nqt h LEU 410 Ca -0.04 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1nqt h LEU 410 Cb 0.35 0.57 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1nqt h LEU 410 CO 0.04 -0.31 0.11 0.23 0.09 0.00 0.00 178.44 178.61 1nqt n MET 411 N -5.43 0.11 -0.04 1.13 2.81 0.93 -0.16 117.12 116.46 1nqt n MET 411 Ca 0.04 0.59 -0.05 0.00 -1.81 0.00 0.00 57.70 56.46 1nqt n MET 411 Cb 0.35 -1.96 -0.14 0.00 -0.71 0.00 0.00 33.22 30.76 1nqt n MET 411 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1nqt n SER 412 N -2.09 0.38 0.17 7.83 7.64 0.25 -2.73 113.62 125.06 1nqt n SER 412 Ca -0.01 0.18 -0.13 0.00 1.01 0.00 0.00 58.87 59.91 1nqt n SER 412 Cb 0.14 0.68 -0.08 0.00 -1.01 0.00 0.00 64.21 63.94 1nqt n SER 412 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1nqt h VAL 413 N 0.00 0.67 0.01 0.44 2.07 0.55 -1.45 116.25 118.54 1nqt h VAL 413 Ca -0.35 -0.55 0.01 0.00 0.82 0.00 0.00 66.70 66.63 1nqt h VAL 413 Cb 1.92 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 32.61 1nqt h VAL 413 CO 0.04 0.10 -0.28 -0.61 0.02 0.00 0.00 177.57 176.85 1nqt h GLN 414 N -0.75 -0.34 -0.33 1.57 4.15 -0.95 -0.68 115.11 117.77 1nqt h GLN 414 Ca -0.04 0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.47 1nqt h GLN 414 Cb 0.50 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.20 1nqt h GLN 414 CO 0.07 -0.23 -0.11 0.93 -1.93 0.00 0.00 178.83 177.56 1nqt h GLU 415 N -0.35 -0.04 0.00 1.69 5.08 -1.61 -0.38 114.58 118.97 1nqt h GLU 415 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1nqt h GLU 415 Cb 0.38 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1nqt h GLU 415 CO -0.18 -0.03 0.22 0.77 -1.00 0.00 0.00 179.01 178.80 1nqt h SER 416 N -0.04 0.00 0.06 1.42 0.02 -0.41 -0.53 113.55 114.07 1nqt h SER 416 Ca 0.16 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.79 1nqt h SER 416 Cb 0.29 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 1nqt h SER 416 CO -0.36 0.00 -1.79 0.18 -1.14 0.00 0.00 176.83 173.72 1nqt n LEU 417 N -2.81 2.31 0.00 5.07 4.32 -0.34 -3.88 117.00 121.67 1nqt n LEU 417 Ca -0.02 0.28 0.03 0.00 -0.02 0.00 0.00 56.01 56.28 1nqt n LEU 417 Cb 0.27 -1.03 0.19 0.00 -1.62 0.00 0.00 43.42 41.24 1nqt n LEU 417 CO 0.14 0.62 0.40 -0.62 -1.22 0.00 0.00 177.39 176.70 1nqt n GLU 418 N -3.89 0.35 -1.23 3.23 1.02 -0.27 -1.02 120.64 118.83 1nqt n GLU 418 Ca -0.35 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.64 1nqt n GLU 418 Cb 0.89 -1.29 0.13 0.00 -0.02 0.00 0.00 31.44 31.15 1nqt n GLU 418 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1nqt n ARG 419 N -0.79 2.44 -2.71 3.49 1.74 -0.82 -4.00 116.66 116.00 1nqt n ARG 419 Ca 0.05 -3.45 -0.05 0.00 -0.77 0.00 0.00 57.85 53.62 1nqt n ARG 419 Cb 0.02 -2.03 0.08 0.00 -1.02 0.00 0.00 32.46 29.52 1nqt n ARG 419 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1nqt n LYS 420 N -0.99 1.32 0.00 5.56 4.81 -0.19 -5.03 118.16 123.64 1nqt n LYS 420 Ca 0.42 -2.45 0.00 0.00 -0.87 0.00 0.00 58.31 55.41 1nqt n LYS 420 Cb 0.99 -0.61 0.00 0.00 0.02 0.00 0.00 35.03 35.43 1nqt n LYS 420 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1nqt n PHE 421 N -0.63 0.00 -1.29 5.64 -0.00 -1.26 -5.06 117.46 114.87 1nqt n PHE 421 Ca -0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 57.07 1nqt n PHE 421 Cb 0.84 0.00 -0.07 0.00 -0.00 0.00 0.00 39.48 40.24 1nqt n PHE 421 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 422 N 0.00 1.58 3.60 7.13 0.00 -1.26 -4.79 105.19 111.45 1nqt n GLY 422 Ca 0.00 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 1nqt n GLY 422 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nqt s LYS 423 N 5.99 0.84 -0.88 1.61 2.20 -1.26 -5.09 119.74 123.17 1nqt s LYS 423 Ca 0.64 0.89 -0.00 0.00 -0.36 0.00 0.00 55.97 57.14 1nqt s LYS 423 Cb 0.09 0.41 0.25 0.00 -1.51 0.00 0.00 37.83 37.08 1nqt s LYS 423 CO 0.17 -0.12 0.96 -2.39 -0.36 0.00 0.00 175.35 173.61 1nqt n HIS 424 N 2.50 3.56 0.00 4.03 -0.00 -1.26 -4.45 115.22 119.60 1nqt n HIS 424 Ca -0.15 -3.73 0.00 0.00 -0.00 0.00 0.00 57.72 53.84 1nqt n HIS 424 Cb 0.55 -1.01 0.00 0.00 -0.00 0.00 0.00 29.99 29.53 1nqt n HIS 424 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1nqt n GLY 425 N 1.63 0.31 0.00 -1.39 0.00 -1.26 -5.08 105.19 99.39 1nqt n GLY 425 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1nqt n GLY 425 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nqt n GLY 426 N 0.00 -3.12 3.74 -0.02 0.00 -1.26 -4.62 105.19 99.90 1nqt n GLY 426 Ca 0.00 0.40 -0.41 0.00 0.00 0.00 0.00 46.02 46.01 1nqt n GLY 426 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nqt s THR 427 N -1.96 3.54 -0.66 2.61 2.01 -1.26 -5.03 115.64 114.89 1nqt s THR 427 Ca 0.00 1.31 0.04 0.00 0.31 0.00 0.00 61.69 63.35 1nqt s THR 427 Cb 0.00 -3.83 0.31 0.00 0.01 0.00 0.00 72.50 68.99 1nqt s THR 427 CO 0.00 0.21 1.00 2.30 -0.69 0.00 0.00 174.62 177.44 1nqt n ILE 428 N 2.46 3.26 -0.17 1.82 -0.00 -1.26 -4.82 119.36 120.64 1nqt n ILE 428 Ca 0.04 -5.54 -0.10 0.00 -0.00 0.00 0.00 62.75 57.15 1nqt n ILE 428 Cb 0.45 -1.64 0.00 0.00 -0.00 0.00 0.00 39.64 38.45 1nqt n ILE 428 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.55 175.90 1nqt h PRO 429 N 3.52 0.94 0.00 6.28 0.11 -1.93 -3.22 132.00 137.71 1nqt h PRO 429 Ca 0.19 -0.33 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1nqt h PRO 429 Cb 0.53 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1nqt h PRO 429 CO 0.88 0.99 0.21 0.44 -0.21 0.00 0.00 178.00 180.31 1nqt n ILE 430 N -4.24 0.00 -3.70 4.15 -5.35 -1.26 -4.21 119.36 104.74 1nqt n ILE 430 Ca 0.01 0.21 -0.36 0.00 -0.27 0.00 0.00 62.75 62.34 1nqt n ILE 430 Cb 0.36 -0.53 -0.09 0.00 -1.74 0.00 0.00 39.64 37.64 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 -1.07 5.30 1.24 7.28 0.11 -1.22 -4.87 120.40 127.17 1nqt s VAL 431 Ca 0.00 0.16 -0.18 0.00 -2.93 0.00 0.00 61.98 59.03 1nqt s VAL 431 Cb 0.00 -3.45 0.30 0.00 -1.53 0.00 0.00 36.38 31.69 1nqt s VAL 431 CO 0.00 0.38 1.03 -2.84 -3.33 0.00 0.00 175.10 170.34 1nqt s PRO 432 N 0.86 -1.49 0.72 1.54 0.02 -1.26 -5.01 135.00 130.38 1nqt s PRO 432 Ca 0.07 0.26 -0.08 0.00 0.02 0.00 0.00 61.00 61.27 1nqt s PRO 432 Cb -0.13 -1.54 0.06 0.00 0.02 0.00 0.00 34.50 32.91 1nqt s PRO 432 CO 0.03 -3.96 1.05 0.95 -0.33 0.00 0.00 177.00 174.74 1nqt s THR 433 N -2.66 2.41 0.20 0.99 -4.23 -1.26 -4.85 115.64 106.23 1nqt s THR 433 Ca 0.69 -0.13 -0.09 0.00 -1.18 0.00 0.00 61.69 60.98 1nqt s THR 433 Cb -0.15 -3.07 0.12 0.00 1.34 0.00 0.00 72.50 70.74 1nqt s THR 433 CO 0.59 -0.08 1.74 0.00 -0.54 0.00 0.00 174.62 176.32 1nqt h ALA 434 N -0.68 0.95 -0.22 3.99 0.00 -1.99 -1.09 119.26 120.22 1nqt h ALA 434 Ca -0.45 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.21 1nqt h ALA 434 Cb 1.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1nqt h ALA 434 CO 0.62 0.63 0.05 0.93 0.00 0.00 0.00 179.25 181.48 1nqt h GLU 435 N 1.07 0.35 -0.03 0.00 3.07 -1.99 -2.46 114.58 114.59 1nqt h GLU 435 Ca 0.23 -0.09 0.03 0.00 -0.50 0.00 0.00 59.36 59.04 1nqt h GLU 435 Cb 0.31 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.13 1nqt h GLU 435 CO -0.01 0.48 -0.21 0.35 -1.40 0.00 0.00 179.01 178.22 1nqt h PHE 436 N 0.17 -0.55 -0.16 4.33 -0.00 -1.90 0.26 116.94 119.09 1nqt h PHE 436 Ca 0.07 0.02 0.03 0.00 -0.00 0.00 0.00 57.97 58.08 1nqt h PHE 436 Cb 0.29 0.25 -0.01 0.00 -0.00 0.00 0.00 35.95 36.47 1nqt h PHE 436 CO 0.01 -0.29 0.11 0.37 -0.00 0.00 0.00 178.31 178.52 1nqt h GLN 437 N -0.32 0.11 -0.07 1.11 5.75 -1.15 0.44 115.11 120.99 1nqt h GLN 437 Ca 0.07 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.50 1nqt h GLN 437 Cb 0.41 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.93 1nqt h GLN 437 CO -0.21 0.07 -0.18 -0.44 -2.65 0.00 0.00 178.83 175.42 1nqt h ASP 438 N 0.11 0.27 -0.25 -0.69 3.45 -0.79 -1.34 116.42 117.19 1nqt h ASP 438 Ca 0.07 -0.60 0.05 0.00 0.43 0.00 0.00 57.03 56.97 1nqt h ASP 438 Cb 0.14 -0.08 -0.04 0.00 -0.56 0.00 0.00 39.33 38.79 1nqt h ASP 438 CO -0.01 0.83 -0.03 -0.09 -1.57 0.00 0.00 179.24 178.36 1nqt h ARG 439 N -0.27 0.03 0.07 3.56 1.12 0.48 0.23 114.38 119.60 1nqt h ARG 439 Ca -0.00 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.86 1nqt h ARG 439 Cb 0.80 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.75 1nqt h ARG 439 CO 0.04 0.02 -0.03 0.82 -3.11 0.00 0.00 179.97 177.71 1nqt h ILE 440 N 0.03 0.96 -0.75 1.20 2.04 -0.22 -2.83 117.51 117.93 1nqt h ILE 440 Ca 0.12 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.92 1nqt h ILE 440 Cb 0.17 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 1nqt h ILE 440 CO -0.23 0.02 0.50 -1.28 0.00 0.00 0.00 178.15 177.16 1nqt h SER 441 N -0.12 0.86 -1.71 1.72 0.87 -0.83 -3.12 113.55 111.22 1nqt h SER 441 Ca -0.01 -0.02 -0.60 0.00 -1.23 0.00 0.00 61.79 59.93 1nqt h SER 441 Cb 0.10 -0.21 -0.41 0.00 -0.44 0.00 0.00 62.40 61.44 1nqt h SER 441 CO 0.01 0.62 -0.58 0.61 -0.53 0.00 0.00 176.83 176.97 1nqt n GLY 442 N -1.42 5.91 3.76 5.77 0.00 0.78 -5.04 105.19 114.95 1nqt n GLY 442 Ca 0.08 -2.75 -0.40 0.00 0.00 0.00 0.00 46.02 42.95 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 -3.57 3.35 0.28 4.61 0.00 -1.07 -4.89 121.76 120.46 1nqt s ALA 443 Ca 0.48 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 53.21 1nqt s ALA 443 Cb 0.38 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 20.16 1nqt s ALA 443 CO -0.19 -0.30 0.67 -1.54 0.00 0.00 0.00 175.76 174.39 1nqt s SER 444 N -0.92 -0.18 0.29 0.00 1.04 -1.26 -5.04 113.70 107.62 1nqt s SER 444 Ca 0.48 -0.74 -0.03 0.00 0.48 0.00 0.00 55.95 56.15 1nqt s SER 444 Cb -0.32 0.71 0.40 0.00 0.10 0.00 0.00 66.02 66.90 1nqt s SER 444 CO 0.41 -1.33 1.94 -0.08 0.98 0.00 0.00 173.24 175.17 1nqt h GLU 445 N 2.06 1.10 -0.08 4.02 4.81 -1.95 -0.62 114.58 123.92 1nqt h GLU 445 Ca -0.22 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 58.95 1nqt h GLU 445 Cb 1.25 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 1nqt h GLU 445 CO 0.27 0.76 0.20 1.57 -0.73 0.00 0.00 179.01 181.09 1nqt h LYS 446 N 1.13 0.00 -0.01 1.92 2.10 -1.93 0.20 116.57 119.98 1nqt h LYS 446 Ca 0.30 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.78 1nqt h LYS 446 Cb -0.07 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.27 1nqt h LYS 446 CO -0.06 0.00 -0.66 -0.44 -2.00 0.00 0.00 179.45 176.29 1nqt h ASP 447 N 0.00 0.60 0.24 7.07 3.32 -1.46 -2.38 116.42 123.80 1nqt h ASP 447 Ca 0.04 -0.75 -0.13 0.00 0.02 0.00 0.00 57.03 56.21 1nqt h ASP 447 Cb 0.44 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1nqt h ASP 447 CO -0.00 1.27 -0.48 0.40 -1.72 0.00 0.00 179.24 178.70 1nqt h ILE 448 N -0.01 1.34 0.00 0.35 1.08 -0.78 -1.94 117.51 117.54 1nqt h ILE 448 Ca -0.08 -1.70 0.00 0.00 -0.39 0.00 0.00 64.86 62.69 1nqt h ILE 448 Cb 1.36 1.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.89 1nqt h ILE 448 CO 0.13 0.51 0.00 0.52 -0.69 0.00 0.00 178.15 178.62 1nqt n VAL 449 N -3.97 0.00 -0.19 1.67 0.31 0.34 -1.36 118.33 115.13 1nqt n VAL 449 Ca -0.02 1.11 -0.05 0.00 -0.01 0.00 0.00 64.34 65.37 1nqt n VAL 449 Cb 0.54 -2.05 -0.05 0.00 -0.91 0.00 0.00 33.84 31.37 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 -1.10 -0.20 -0.19 3.52 8.25 -0.90 0.17 115.22 124.77 1nqt n HIS 450 Ca 0.00 0.57 -0.13 0.00 -0.26 0.00 0.00 57.72 57.90 1nqt n HIS 450 Cb 0.00 -0.50 -0.10 0.00 1.12 0.00 0.00 29.99 30.51 1nqt n HIS 450 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1nqt h SER 451 N 0.00 -1.87 -0.97 0.41 4.64 -1.39 0.83 113.55 115.20 1nqt h SER 451 Ca 0.07 0.25 0.23 0.00 -0.47 0.00 0.00 61.79 61.87 1nqt h SER 451 Cb 0.19 0.78 -0.12 0.00 -0.31 0.00 0.00 62.40 62.94 1nqt h SER 451 CO -0.43 -0.36 0.54 1.23 -0.87 0.00 0.00 176.83 176.94 1nqt h GLY 452 N -0.31 1.77 1.04 -0.77 0.00 0.30 0.24 103.07 105.34 1nqt h GLY 452 Ca 0.09 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1nqt h GLY 452 CO -0.64 -0.22 0.33 -2.00 0.00 0.00 0.00 176.54 174.00 1nqt h LEU 453 N 0.56 1.07 -0.59 3.11 6.46 0.42 -2.56 115.31 123.78 1nqt h LEU 453 Ca 0.61 -0.16 -0.15 0.00 -0.12 0.00 0.00 57.88 58.05 1nqt h LEU 453 Cb 1.12 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1nqt h LEU 453 CO -0.47 0.94 -0.60 0.00 -0.62 0.00 0.00 178.44 177.69 1nqt h ALA 454 N 1.17 0.78 -0.58 1.25 0.00 0.27 -1.23 119.26 120.92 1nqt h ALA 454 Ca 0.26 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1nqt h ALA 454 Cb 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1nqt h ALA 454 CO -0.02 0.72 0.07 -0.92 0.00 0.00 0.00 179.25 179.10 1nqt h TYR 455 N 0.26 1.00 0.15 0.00 5.03 -1.10 0.16 116.97 122.47 1nqt h TYR 455 Ca -0.00 -0.13 -0.01 0.00 2.58 0.00 0.00 58.73 61.17 1nqt h TYR 455 Cb 1.12 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 39.12 1nqt h TYR 455 CO 0.03 0.86 -0.07 1.15 -1.32 0.00 0.00 178.16 178.81 1nqt h THR 456 N 0.89 1.00 -0.80 1.81 2.02 -1.31 0.60 112.91 117.12 1nqt h THR 456 Ca 0.18 -0.81 0.01 0.00 0.77 0.00 0.00 66.41 66.56 1nqt h THR 456 Cb 0.42 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.28 1nqt h THR 456 CO 0.01 0.19 0.53 0.24 0.37 0.00 0.00 175.52 176.86 1nqt h MET 457 N -0.60 1.05 0.46 6.66 2.86 -1.05 -0.02 114.93 124.28 1nqt h MET 457 Ca -0.02 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1nqt h MET 457 Cb 0.46 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1nqt h MET 457 CO 0.03 0.69 -0.22 1.49 1.06 0.00 0.00 176.91 179.97 1nqt h GLU 458 N 1.08 -0.59 -0.79 1.72 4.81 -0.90 -0.39 114.58 119.51 1nqt h GLU 458 Ca 0.29 0.04 0.11 0.00 -0.13 0.00 0.00 59.36 59.68 1nqt h GLU 458 Cb -0.12 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.31 1nqt h GLU 458 CO -0.06 -0.29 0.41 -0.09 -0.73 0.00 0.00 179.01 178.25 1nqt h ARG 459 N -0.97 0.64 -0.28 1.92 2.43 -0.64 -0.59 114.38 116.88 1nqt h ARG 459 Ca -0.06 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 1nqt h ARG 459 Cb 0.58 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1nqt h ARG 459 CO 0.10 0.42 0.03 0.77 -1.51 0.00 0.00 179.97 179.79 1nqt h SER 460 N 0.66 0.46 -0.56 -3.80 0.02 -1.01 -1.43 113.55 107.89 1nqt h SER 460 Ca 0.40 -0.28 0.10 0.00 -0.84 0.00 0.00 61.79 61.18 1nqt h SER 460 Cb 0.47 -0.12 -0.08 0.00 0.14 0.00 0.00 62.40 62.80 1nqt h SER 460 CO -0.30 0.63 0.09 0.00 -1.14 0.00 0.00 176.83 176.10 1nqt h ALA 461 N 0.85 0.62 -0.59 3.77 0.00 0.41 0.41 119.26 124.74 1nqt h ALA 461 Ca 0.08 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1nqt h ALA 461 Cb 0.37 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1nqt h ALA 461 CO 0.01 -0.33 0.15 0.00 0.00 0.00 0.00 179.25 179.08 1nqt h ARG 462 N 0.21 0.92 -0.33 0.00 3.08 -0.93 -0.87 114.38 116.46 1nqt h ARG 462 Ca 0.29 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1nqt h ARG 462 Cb 0.42 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1nqt h ARG 462 CO -0.40 0.82 0.01 1.96 -1.07 0.00 0.00 179.97 181.29 1nqt h GLN 463 N 0.88 0.51 0.29 0.04 4.20 0.03 -0.67 115.11 120.39 1nqt h GLN 463 Ca 0.19 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1nqt h GLN 463 Cb 0.31 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1nqt h GLN 463 CO -0.00 0.53 -0.14 0.82 -0.67 0.00 0.00 178.83 179.37 1nqt h ILE 464 N 0.49 0.70 -1.00 2.54 2.04 -0.18 -2.09 117.51 120.00 1nqt h ILE 464 Ca 0.11 -0.69 0.21 0.00 1.00 0.00 0.00 64.86 65.49 1nqt h ILE 464 Cb 0.31 1.03 -0.11 0.00 -0.74 0.00 0.00 36.82 37.31 1nqt h ILE 464 CO 0.01 0.13 0.61 0.24 0.00 0.00 0.00 178.15 179.14 1nqt h MET 465 N -0.79 0.67 -0.21 2.37 2.86 -1.01 0.05 114.93 118.88 1nqt h MET 465 Ca -0.04 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.43 1nqt h MET 465 Cb 0.51 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 1nqt h MET 465 CO 0.07 0.44 -0.36 -0.09 1.06 0.00 0.00 176.91 178.03 1nqt h ARG 466 N 0.69 0.61 0.50 1.72 2.43 -1.11 -2.05 114.38 117.18 1nqt h ARG 466 Ca 0.60 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 59.37 1nqt h ARG 466 Cb 1.02 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1nqt h ARG 466 CO -0.40 0.99 -0.26 1.15 -1.51 0.00 0.00 179.97 179.94 1nqt h THR 467 N 0.30 0.47 -0.02 0.20 2.02 -0.64 -1.41 112.91 113.82 1nqt h THR 467 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1nqt h THR 467 Cb 0.95 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1nqt h THR 467 CO 0.08 0.00 -0.03 0.00 0.37 0.00 0.00 175.52 175.95 1nqt h ALA 468 N -0.21 -0.26 0.00 6.16 0.00 -1.00 0.58 119.26 124.54 1nqt h ALA 468 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1nqt h ALA 468 Cb 0.55 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1nqt h ALA 468 CO 0.10 -0.28 0.29 -0.12 0.00 0.00 0.00 179.25 179.24 1nqt n MET 469 N -2.88 0.06 -0.02 0.00 0.00 -0.78 -0.66 117.12 112.84 1nqt n MET 469 Ca -0.00 0.47 -0.21 0.00 0.00 0.00 0.00 57.70 57.96 1nqt n MET 469 Cb 0.01 -1.98 -0.13 0.00 0.00 0.00 0.00 33.22 31.13 1nqt n MET 469 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1nqt h LYS 470 N 0.00 0.18 -0.89 2.12 3.64 0.12 -3.34 116.57 118.40 1nqt h LYS 470 Ca 0.00 -0.31 -0.24 0.00 -1.27 0.00 0.00 60.65 58.83 1nqt h LYS 470 Cb 0.58 0.12 -0.14 0.00 -0.41 0.00 0.00 32.23 32.37 1nqt h LYS 470 CO 0.00 1.15 0.31 0.66 -2.27 0.00 0.00 179.45 179.30 1nqt n TYR 471 N -4.03 1.97 -0.67 1.91 4.01 0.16 -4.90 117.16 115.61 1nqt n TYR 471 Ca -0.26 -1.14 -0.03 0.00 -0.16 0.00 0.00 57.90 56.32 1nqt n TYR 471 Cb 0.84 -0.63 -0.01 0.00 -0.31 0.00 0.00 39.34 39.23 1nqt n TYR 471 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1nqt n ASN 472 N -0.29 -2.60 -4.10 7.72 4.13 -0.42 -4.93 115.26 114.77 1nqt n ASN 472 Ca 0.35 0.06 -0.29 0.00 1.68 0.00 0.00 54.58 56.38 1nqt n ASN 472 Cb 1.21 -2.00 0.27 0.00 -1.54 0.00 0.00 39.78 37.72 1nqt n ASN 472 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1nqt s LEU 473 N -0.88 0.01 0.00 3.41 1.43 -1.03 -4.96 118.68 116.66 1nqt s LEU 473 Ca 0.00 1.26 0.00 0.00 -1.03 0.00 0.00 54.13 54.36 1nqt s LEU 473 Cb 0.00 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.26 1nqt s LEU 473 CO 0.00 -4.71 0.00 0.61 0.23 0.00 0.00 176.35 172.48 1nqt n GLY 474 N 1.07 0.45 1.31 -3.19 0.00 -1.26 -4.56 105.19 99.01 1nqt n GLY 474 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1nqt n GLY 474 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nqt n LEU 475 N 0.00 4.52 -2.55 0.99 4.32 -1.26 -4.64 117.00 118.38 1nqt n LEU 475 Ca 0.00 -3.70 -0.30 0.00 -0.02 0.00 0.00 56.01 51.98 1nqt n LEU 475 Cb 0.00 -0.66 -0.01 0.00 -1.62 0.00 0.00 43.42 41.13 1nqt n LEU 475 CO 0.00 1.19 1.53 -0.67 -1.22 0.00 0.00 177.39 178.22 1nqt n ASP 476 N -1.07 6.89 0.04 -1.43 2.03 -1.26 -4.11 116.55 117.64 1nqt n ASP 476 Ca 0.36 -3.43 0.22 0.00 0.52 0.00 0.00 54.79 52.46 1nqt n ASP 476 Cb 1.13 -1.15 0.71 0.00 -0.72 0.00 0.00 41.12 41.09 1nqt n ASP 476 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1nqt h LEU 477 N 3.35 0.00 0.60 -2.67 4.07 -1.82 -0.97 115.31 117.87 1nqt h LEU 477 Ca 0.45 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.38 1nqt h LEU 477 Cb 0.54 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.28 1nqt h LEU 477 CO 1.09 0.00 -0.29 -0.09 -1.08 0.00 0.00 178.44 178.08 1nqt h ARG 478 N 0.00 -0.77 -0.70 1.13 2.43 -1.84 -2.34 114.38 112.30 1nqt h ARG 478 Ca 0.25 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.51 1nqt h ARG 478 Cb 1.36 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 31.03 1nqt h ARG 478 CO -0.00 -0.49 0.42 1.79 -1.51 0.00 0.00 179.97 180.18 1nqt h THR 479 N -1.17 1.05 -0.98 0.20 1.35 -1.81 0.23 112.91 111.77 1nqt h THR 479 Ca -0.08 -0.28 0.21 0.00 -0.55 0.00 0.00 66.41 65.71 1nqt h THR 479 Cb 0.64 0.17 -0.09 0.00 -1.73 0.00 0.00 68.15 67.14 1nqt h THR 479 CO 0.13 0.15 0.62 0.00 -0.25 0.00 0.00 175.52 176.17 1nqt h ALA 480 N 1.32 1.92 0.04 6.62 0.00 -1.23 0.59 119.26 128.53 1nqt h ALA 480 Ca 0.29 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 1nqt h ALA 480 Cb 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1nqt h ALA 480 CO -0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 179.25 178.81 1nqt h ALA 481 N 1.63 -0.06 -0.79 0.00 0.00 -0.03 -1.29 119.26 118.73 1nqt h ALA 481 Ca 0.55 -0.32 0.10 0.00 0.00 0.00 0.00 54.91 55.24 1nqt h ALA 481 Cb 1.09 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1nqt h ALA 481 CO -0.31 -0.16 0.52 1.88 0.00 0.00 0.00 179.25 181.17 1nqt h TYR 482 N -0.79 0.74 -0.02 0.00 0.05 -0.46 0.55 116.97 117.04 1nqt h TYR 482 Ca -0.01 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 1nqt h TYR 482 Cb 0.67 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.17 1nqt h TYR 482 CO 0.16 0.34 0.00 0.28 -1.05 0.00 0.00 178.16 177.88 1nqt h VAL 483 N 0.68 1.25 -0.97 -2.88 2.07 0.19 -1.67 116.25 114.92 1nqt h VAL 483 Ca 0.37 -0.74 0.26 0.00 0.82 0.00 0.00 66.70 67.41 1nqt h VAL 483 Cb 0.51 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 1nqt h VAL 483 CO -0.14 0.20 0.67 -1.13 0.02 0.00 0.00 177.57 177.19 1nqt h ASN 484 N -0.26 0.17 0.02 0.57 -1.24 0.11 -1.49 115.58 113.47 1nqt h ASN 484 Ca 0.01 0.02 -0.00 0.00 0.71 0.00 0.00 56.30 57.04 1nqt h ASN 484 Cb 0.32 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.36 1nqt h ASN 484 CO 0.00 0.05 -0.01 0.00 -1.29 0.00 0.00 177.43 176.18 1nqt h ALA 485 N 1.55 -0.03 -0.61 1.57 0.00 -0.20 -3.20 119.26 118.35 1nqt h ALA 485 Ca 0.49 -0.30 0.08 0.00 0.00 0.00 0.00 54.91 55.18 1nqt h ALA 485 Cb 1.64 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 19.34 1nqt h ALA 485 CO -0.10 -0.05 -0.48 0.82 0.00 0.00 0.00 179.25 179.44 1nqt h ILE 486 N -0.97 0.05 -0.85 0.00 1.08 -0.64 0.22 117.51 116.41 1nqt h ILE 486 Ca -0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.61 1nqt h ILE 486 Cb 0.61 0.05 -0.15 0.00 -3.07 0.00 0.00 36.82 34.27 1nqt h ILE 486 CO 0.01 0.00 -0.34 -0.33 -0.69 0.00 0.00 178.15 176.79 1nqt h GLU 487 N -0.23 -0.05 0.73 2.37 5.08 -1.42 0.54 114.58 121.60 1nqt h GLU 487 Ca 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1nqt h GLU 487 Cb 0.56 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1nqt h GLU 487 CO -0.71 -0.03 -0.40 0.87 -1.00 0.00 0.00 179.01 177.74 1nqt h LYS 488 N -0.05 -1.01 -0.97 2.33 1.57 -0.64 0.11 116.57 117.92 1nqt h LYS 488 Ca 0.32 0.07 0.26 0.00 -1.87 0.00 0.00 60.65 59.43 1nqt h LYS 488 Cb 0.59 0.23 -0.13 0.00 0.08 0.00 0.00 32.23 33.00 1nqt h LYS 488 CO -0.88 -0.67 0.51 0.28 -0.57 0.00 0.00 179.45 178.12 1nqt h VAL 489 N -1.04 0.45 -0.15 0.50 2.07 -0.36 0.15 116.25 117.86 1nqt h VAL 489 Ca -0.10 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1nqt h VAL 489 Cb 0.82 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1nqt h VAL 489 CO 0.13 0.08 -0.01 0.15 0.02 0.00 0.00 177.57 177.94 1nqt h PHE 490 N 0.44 0.30 -0.51 1.57 3.57 0.56 -2.67 116.94 120.19 1nqt h PHE 490 Ca 0.64 -0.06 0.10 0.00 3.53 0.00 0.00 57.97 62.19 1nqt h PHE 490 Cb 1.29 -0.08 -0.09 0.00 2.79 0.00 0.00 35.95 39.86 1nqt h PHE 490 CO -0.06 0.51 -0.06 -0.22 -2.23 0.00 0.00 178.31 176.25 1nqt h LYS 491 N -0.00 0.06 0.05 1.11 3.64 0.19 0.39 116.57 122.01 1nqt h LYS 491 Ca 0.04 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1nqt h LYS 491 Cb 0.40 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1nqt h LYS 491 CO 0.01 0.04 -0.29 0.28 -2.27 0.00 0.00 179.45 177.21 1nqt h VAL 492 N 0.06 0.00 -0.48 2.00 2.07 -1.37 0.24 116.25 118.77 1nqt h VAL 492 Ca 0.25 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.86 1nqt h VAL 492 Cb 0.39 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.06 1nqt h VAL 492 CO -0.47 0.00 -0.37 1.88 0.02 0.00 0.00 177.57 178.62 1nqt h TYR 493 N -0.41 -1.06 -0.41 1.57 0.05 -0.98 -2.18 116.97 113.55 1nqt h TYR 493 Ca -0.00 0.07 0.01 0.00 0.05 0.00 0.00 58.73 58.86 1nqt h TYR 493 Cb 0.41 0.53 -0.02 0.00 1.01 0.00 0.00 36.73 38.66 1nqt h TYR 493 CO -0.40 -0.41 0.25 -0.97 -1.05 0.00 0.00 178.16 175.59 1nqt h ASN 494 N -0.24 0.42 -0.06 3.88 -0.73 0.02 -0.85 115.58 118.01 1nqt h ASN 494 Ca 0.18 -0.00 -0.69 0.00 1.87 0.00 0.00 56.30 57.66 1nqt h ASN 494 Cb 0.56 -0.09 -0.00 0.00 0.27 0.00 0.00 38.32 39.05 1nqt h ASN 494 CO -0.61 0.30 3.53 -0.62 -0.37 0.00 0.00 177.43 179.66 1nqt n GLU 495 N -4.84 3.43 0.00 6.67 1.02 0.81 -3.93 120.64 123.80 1nqt n GLU 495 Ca 0.01 -2.41 0.00 0.00 -0.02 0.00 0.00 57.16 54.75 1nqt n GLU 495 Cb 0.05 -2.97 0.00 0.00 -0.02 0.00 0.00 31.44 28.50 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 4.43 0.00 0.00 0.62 0.00 -1.20 -4.93 120.51 119.43 1nqt n ALA 496 Ca 0.68 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.12 1nqt n ALA 496 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 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 -0.80 0.00 0.00 0.00 -0.33 -4.37 105.19 99.70 1nqt n GLY 497 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 0.07 1.61 0.24 -1.26 -4.68 118.33 114.31 1nqt n VAL 498 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1nqt n VAL 498 Cb 0.00 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 1nqt n VAL 498 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1nqt h THR 499 N 0.00 0.91 -2.26 3.34 2.02 -2.02 -3.18 112.91 111.72 1nqt h THR 499 Ca 0.00 -2.42 -0.61 0.00 0.77 0.00 0.00 66.41 64.14 1nqt h THR 499 Cb 0.00 2.38 -0.41 0.00 -1.74 0.00 0.00 68.15 68.38 1nqt h THR 499 CO 0.00 0.52 -0.50 0.49 0.37 0.00 0.00 175.52 176.40 1nqt n PHE 500 N -3.12 3.69 1.12 3.16 0.99 -1.26 -5.29 117.46 116.75 1nqt n PHE 500 Ca -0.04 -3.99 0.12 0.00 -0.00 0.00 0.00 57.45 53.54 1nqt n PHE 500 Cb 0.84 -0.59 0.20 0.00 -1.00 0.00 0.00 39.48 38.93 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39