#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nqt n PRO 7 N 0.00 2.27 -5.04 0.11 -0.02 -1.26 -5.06 135.00 126.01 1nqt n PRO 7 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.20 1nqt n PRO 7 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.32 1nqt n PRO 7 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nqt s ASN 8 N -1.26 2.50 0.19 2.55 4.22 -1.26 -5.01 114.94 116.88 1nqt s ASN 8 Ca 0.00 -0.39 0.08 0.00 -2.14 0.00 0.00 52.86 50.41 1nqt s ASN 8 Cb 0.00 -0.33 0.62 0.00 1.28 0.00 0.00 41.25 42.82 1nqt s ASN 8 CO 0.00 0.25 0.87 0.49 -2.04 0.00 0.00 177.10 176.68 1nqt n PHE 9 N 2.62 0.54 0.45 1.54 3.01 -1.26 -0.30 117.46 124.06 1nqt n PHE 9 Ca -0.16 0.66 -0.19 0.00 1.01 0.00 0.00 57.45 58.78 1nqt n PHE 9 Cb 0.53 -1.03 -0.09 0.00 -0.01 0.00 0.00 39.48 38.88 1nqt n PHE 9 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 1nqt h PHE 10 N 0.00 -1.06 -0.89 1.38 3.57 -1.92 -1.69 116.94 116.33 1nqt h PHE 10 Ca 0.42 -0.03 0.12 0.00 3.53 0.00 0.00 57.97 62.02 1nqt h PHE 10 Cb 1.04 0.35 -0.07 0.00 2.79 0.00 0.00 35.95 40.06 1nqt h PHE 10 CO -0.11 -0.65 0.57 -0.22 -2.23 0.00 0.00 178.31 175.67 1nqt h LYS 11 N -1.20 0.76 0.76 1.11 1.63 -1.07 0.25 116.57 118.80 1nqt h LYS 11 Ca -0.12 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.60 1nqt h LYS 11 Cb 0.88 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 32.34 1nqt h LYS 11 CO 0.19 0.50 -0.44 0.52 -3.45 0.00 0.00 179.45 176.77 1nqt h MET 12 N 0.78 -1.08 0.07 1.90 2.86 -1.15 0.20 114.93 118.52 1nqt h MET 12 Ca 0.43 0.07 0.02 0.00 -2.06 0.00 0.00 59.70 58.17 1nqt h MET 12 Cb 0.57 0.25 -0.04 0.00 0.06 0.00 0.00 31.60 32.44 1nqt h MET 12 CO -0.19 -0.72 -0.28 0.28 1.06 0.00 0.00 176.91 177.06 1nqt h VAL 13 N -1.12 0.39 -0.47 -2.22 2.07 -0.91 0.16 116.25 114.15 1nqt h VAL 13 Ca -0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.49 1nqt h VAL 13 Cb 0.89 0.39 -0.09 0.00 -1.52 0.00 0.00 31.29 30.96 1nqt h VAL 13 CO 0.12 0.00 -0.48 -0.33 0.02 0.00 0.00 177.57 176.90 1nqt h GLU 14 N -0.46 -0.30 -0.49 1.57 5.08 -0.87 -0.44 114.58 118.66 1nqt h GLU 14 Ca 0.04 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.52 1nqt h GLU 14 Cb 0.51 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.73 1nqt h GLU 14 CO -0.19 -0.20 -0.31 0.78 -1.00 0.00 0.00 179.01 178.08 1nqt h GLY 15 N -0.31 -0.13 0.27 -3.84 0.00 0.30 0.23 103.07 99.58 1nqt h GLY 15 Ca 0.13 0.40 0.14 0.00 0.00 0.00 0.00 47.33 48.00 1nqt h GLY 15 CO -0.63 -0.21 0.49 0.74 0.00 0.00 0.00 176.54 176.93 1nqt h PHE 16 N -0.20 0.86 0.25 5.60 0.05 0.06 0.01 116.94 123.58 1nqt h PHE 16 Ca 0.21 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 62.02 1nqt h PHE 16 Cb 0.53 -0.25 0.00 0.00 2.00 0.00 0.00 35.95 38.24 1nqt h PHE 16 CO -0.57 0.24 -0.12 0.35 -0.18 0.00 0.00 178.31 178.03 1nqt h PHE 17 N 0.70 -0.31 -0.84 -0.55 3.57 0.54 -2.39 116.94 117.66 1nqt h PHE 17 Ca 0.48 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.08 1nqt h PHE 17 Cb 0.64 0.10 -0.08 0.00 2.79 0.00 0.00 35.95 39.40 1nqt h PHE 17 CO -0.07 0.00 0.47 -0.44 -2.23 0.00 0.00 178.31 176.04 1nqt h ASP 18 N -0.65 0.64 0.00 0.41 3.32 -0.75 0.49 116.42 119.89 1nqt h ASP 18 Ca -0.03 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1nqt h ASP 18 Cb 0.46 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1nqt h ASP 18 CO 0.06 0.33 0.00 -1.14 -1.72 0.00 0.00 179.24 176.77 1nqt n ARG 19 N -4.78 0.00 -0.23 3.56 0.00 -0.04 -1.41 116.66 113.76 1nqt n ARG 19 Ca 0.15 0.64 0.02 0.00 -0.00 0.00 0.00 57.85 58.65 1nqt n ARG 19 Cb 0.33 -1.47 0.14 0.00 0.00 0.00 0.00 32.46 31.46 1nqt n ARG 19 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1nqt h GLY 20 N 0.00 0.99 -0.38 5.14 0.00 -1.22 -2.08 103.07 105.52 1nqt h GLY 20 Ca 0.00 -0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.21 1nqt h GLY 20 CO 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 176.54 176.17 1nqt h ALA 21 N 1.46 -0.50 -0.55 3.60 0.00 0.17 0.18 119.26 123.63 1nqt h ALA 21 Ca 0.35 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.40 1nqt h ALA 21 Cb 0.45 1.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.20 1nqt h ALA 21 CO -0.33 -0.70 -0.14 1.03 0.00 0.00 0.00 179.25 179.11 1nqt h SER 22 N -0.16 -0.52 -0.31 0.00 0.87 -0.61 0.15 113.55 112.97 1nqt h SER 22 Ca 0.06 0.17 0.07 0.00 -1.23 0.00 0.00 61.79 60.86 1nqt h SER 22 Cb 0.32 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 1nqt h SER 22 CO -0.44 -0.18 0.21 0.40 -0.53 0.00 0.00 176.83 176.29 1nqt h ILE 23 N -0.00 0.89 0.00 2.23 2.04 -0.55 -3.16 117.51 118.95 1nqt h ILE 23 Ca 0.26 -0.03 -0.07 0.00 1.00 0.00 0.00 64.86 66.02 1nqt h ILE 23 Cb 0.40 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1nqt h ILE 23 CO -0.57 0.02 -0.47 0.58 0.00 0.00 0.00 178.15 177.71 1nqt h VAL 24 N 0.08 1.00 -0.41 1.67 2.07 0.19 -3.41 116.25 117.44 1nqt h VAL 24 Ca 0.14 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.82 1nqt h VAL 24 Cb 0.46 2.04 -0.07 0.00 -1.52 0.00 0.00 31.29 32.21 1nqt h VAL 24 CO -0.01 0.34 -0.16 1.21 0.02 0.00 0.00 177.57 178.96 1nqt n GLU 25 N -4.58 -0.10 0.15 1.57 2.13 -0.02 -0.48 120.64 119.32 1nqt n GLU 25 Ca -0.15 0.64 -0.06 0.00 0.66 0.00 0.00 57.16 58.24 1nqt n GLU 25 Cb 0.44 -0.94 -0.03 0.00 0.27 0.00 0.00 31.44 31.18 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 -0.33 0.00 4.31 3.32 -1.80 -2.51 116.42 119.41 1nqt h ASP 26 Ca 0.14 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1nqt h ASP 26 Cb 0.25 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1nqt h ASP 26 CO -0.41 -0.22 0.01 0.29 -1.72 0.00 0.00 179.24 177.18 1nqt n LYS 27 N -3.14 0.00 0.06 3.56 4.76 -0.86 -0.43 118.16 122.11 1nqt n LYS 27 Ca -0.05 0.35 0.13 0.00 -2.87 0.00 0.00 58.31 55.86 1nqt n LYS 27 Cb 0.15 -1.51 0.31 0.00 -1.84 0.00 0.00 35.03 32.15 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 -1.34 0.63 0.00 -0.35 7.94 0.37 -4.18 117.00 120.07 1nqt n LEU 28 Ca 0.00 0.34 0.00 0.00 -1.11 0.00 0.00 56.01 55.24 1nqt n LEU 28 Cb 0.01 -0.27 0.00 0.00 0.53 0.00 0.00 43.42 43.69 1nqt n LEU 28 CO 0.00 -0.07 0.00 0.52 -1.11 0.00 0.00 177.39 176.73 1nqt n VAL 29 N -2.01 0.00 -2.37 1.96 0.31 0.42 -4.56 118.33 112.08 1nqt n VAL 29 Ca 0.05 0.34 -0.42 0.00 -0.01 0.00 0.00 64.34 64.30 1nqt n VAL 29 Cb 0.41 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.99 1nqt n VAL 29 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1nqt s GLU 30 N -0.84 4.41 0.00 5.55 -1.05 -1.06 -0.91 118.70 124.80 1nqt s GLU 30 Ca 0.00 1.83 0.00 0.00 -0.15 0.00 0.00 54.97 56.65 1nqt s GLU 30 Cb 0.00 -3.33 0.00 0.00 -0.44 0.00 0.00 34.13 30.36 1nqt s GLU 30 CO 0.00 -0.29 0.00 -0.25 0.95 0.00 0.00 175.26 175.67 1nqt n ASP 31 N 3.92 -1.08 0.00 0.83 8.00 -1.26 -4.42 116.55 122.53 1nqt n ASP 31 Ca 0.09 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1nqt n ASP 31 Cb 0.46 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1nqt n ASP 31 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nqt n LEU 32 N 0.00 0.00 -0.46 0.64 4.77 -1.15 -4.95 117.00 115.85 1nqt n LEU 32 Ca 0.00 -0.07 -0.01 0.00 -0.03 0.00 0.00 56.01 55.89 1nqt n LEU 32 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1nqt n LEU 32 CO 0.00 0.00 0.10 -2.11 -1.33 0.00 0.00 177.39 174.05 1nqt n ARG 33 N -0.14 0.00 0.00 3.23 1.85 -0.09 -4.98 116.66 116.53 1nqt n ARG 33 Ca 0.00 -0.19 0.14 0.00 -1.00 0.00 0.00 57.85 56.81 1nqt n ARG 33 Cb 0.01 0.31 0.61 0.00 -1.05 0.00 0.00 32.46 32.33 1nqt n ARG 33 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1nqt n THR 34 N 0.00 0.00 0.00 8.89 -1.04 -1.16 -3.95 114.28 117.02 1nqt n THR 34 Ca -0.05 -0.13 -0.05 0.00 -2.04 0.00 0.00 64.05 61.77 1nqt n THR 34 Cb 0.30 0.13 0.15 0.00 -1.82 0.00 0.00 70.33 69.09 1nqt n THR 34 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1nqt h ARG 35 N 1.25 0.52 -2.24 -2.82 3.08 -1.94 -3.25 114.38 108.98 1nqt h ARG 35 Ca 0.00 -0.23 -0.59 0.00 0.07 0.00 0.00 59.98 59.23 1nqt h ARG 35 Cb 0.37 -0.01 -0.42 0.00 0.08 0.00 0.00 29.97 29.99 1nqt h ARG 35 CO 0.00 0.79 -0.64 -0.85 -1.07 0.00 0.00 179.97 178.20 1nqt n GLU 36 N -4.07 2.89 -3.08 0.04 0.28 -1.25 -5.07 120.64 110.38 1nqt n GLU 36 Ca -0.01 -4.75 -0.41 0.00 -0.16 0.00 0.00 57.16 51.83 1nqt n GLU 36 Cb 0.46 -2.23 -0.06 0.00 1.43 0.00 0.00 31.44 31.05 1nqt n GLU 36 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1nqt s SER 37 N -3.03 6.51 -0.43 -1.84 1.04 -1.23 -5.04 113.70 109.68 1nqt s SER 37 Ca 0.45 0.41 -0.15 0.00 0.48 0.00 0.00 55.95 57.14 1nqt s SER 37 Cb 0.23 -2.35 0.04 0.00 0.10 0.00 0.00 66.02 64.04 1nqt s SER 37 CO -0.09 -0.54 0.34 -1.61 0.98 0.00 0.00 173.24 172.33 1nqt s GLU 38 N 2.71 2.97 0.00 4.02 8.01 -1.26 -4.63 118.70 130.52 1nqt s GLU 38 Ca 0.26 -1.15 0.00 0.00 0.01 0.00 0.00 54.97 54.10 1nqt s GLU 38 Cb -0.15 -4.04 0.00 0.00 -4.31 0.00 0.00 34.13 25.64 1nqt s GLU 38 CO 0.13 -0.86 0.00 -1.91 0.01 0.00 0.00 175.26 172.63 1nqt n GLU 39 N 5.18 -1.85 -2.13 1.61 4.07 -1.26 -2.53 120.64 123.74 1nqt n GLU 39 Ca -0.12 0.24 -0.20 0.00 -0.06 0.00 0.00 57.16 57.03 1nqt n GLU 39 Cb 0.46 -3.73 -0.03 0.00 -0.06 0.00 0.00 31.44 28.07 1nqt n GLU 39 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1nqt n GLN 40 N 0.44 -1.65 -0.23 5.31 1.13 -1.26 -4.75 117.38 116.37 1nqt n GLN 40 Ca 0.00 1.03 0.10 0.00 -1.94 0.00 0.00 57.00 56.19 1nqt n GLN 40 Cb 0.24 -5.59 0.27 0.00 0.11 0.00 0.00 30.24 25.27 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1nqt n LYS 41 N -2.76 2.31 -0.18 -1.09 4.76 -1.05 -3.70 118.16 116.45 1nqt n LYS 41 Ca -0.22 -2.01 0.03 0.00 -2.87 0.00 0.00 58.31 53.25 1nqt n LYS 41 Cb 0.67 -1.47 0.12 0.00 -1.84 0.00 0.00 35.03 32.51 1nqt n LYS 41 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1nqt n ARG 42 N 1.17 1.82 0.00 1.97 1.74 -1.26 -1.20 116.66 120.90 1nqt n ARG 42 Ca 0.19 -0.94 0.08 0.00 -0.77 0.00 0.00 57.85 56.41 1nqt n ARG 42 Cb 0.51 -1.38 0.01 0.00 -1.02 0.00 0.00 32.46 30.58 1nqt n ARG 42 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1nqt n ASN 43 N 0.21 1.76 -0.61 0.55 5.15 -1.24 -3.75 115.26 117.34 1nqt n ASN 43 Ca 0.09 -1.38 0.11 0.00 -0.60 0.00 0.00 54.58 52.80 1nqt n ASN 43 Cb 0.33 0.37 0.02 0.00 -0.53 0.00 0.00 39.78 39.97 1nqt n ASN 43 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1nqt n ARG 44 N 0.09 1.51 0.00 1.20 0.63 -0.34 -3.90 116.66 115.84 1nqt n ARG 44 Ca 0.07 -1.22 0.14 0.00 -0.92 0.00 0.00 57.85 55.91 1nqt n ARG 44 Cb 0.35 -1.46 0.54 0.00 0.45 0.00 0.00 32.46 32.34 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1nqt n VAL 45 N 0.32 0.00 0.12 5.15 3.14 -1.23 -3.47 118.33 122.36 1nqt n VAL 45 Ca 0.10 -0.01 0.06 0.00 -2.96 0.00 0.00 64.34 61.53 1nqt n VAL 45 Cb 0.49 -0.27 0.32 0.00 -1.06 0.00 0.00 33.84 33.32 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 -1.40 0.08 -0.27 1.45 1.85 -1.25 -0.62 116.66 116.49 1nqt n ARG 46 Ca 0.08 0.53 0.06 0.00 -1.00 0.00 0.00 57.85 57.52 1nqt n ARG 46 Cb 0.32 -1.94 0.29 0.00 -1.05 0.00 0.00 32.46 30.08 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 0.00 1.23 -0.87 2.89 0.00 -1.88 -0.49 103.07 103.95 1nqt h GLY 47 Ca 0.00 -0.37 0.08 0.00 0.00 0.00 0.00 47.33 47.04 1nqt h GLY 47 CO 0.00 0.24 -0.55 -2.22 0.00 0.00 0.00 176.54 174.01 1nqt h ILE 48 N 0.90 0.00 -0.89 2.60 1.08 -1.18 1.81 117.51 121.82 1nqt h ILE 48 Ca 0.39 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 65.06 1nqt h ILE 48 Cb 0.31 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.00 1nqt h ILE 48 CO -0.15 0.00 0.60 -0.07 -0.69 0.00 0.00 178.15 177.83 1nqt h LEU 49 N -0.04 0.36 0.00 1.44 4.07 -1.30 0.84 115.31 120.68 1nqt h LEU 49 Ca 0.14 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.14 1nqt h LEU 49 Cb 0.41 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1nqt h LEU 49 CO -0.85 0.14 0.00 -2.11 -1.08 0.00 0.00 178.44 174.55 1nqt n ARG 50 N -4.49 0.90 -0.06 1.13 1.85 0.60 -2.15 116.66 114.43 1nqt n ARG 50 Ca 0.19 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.98 1nqt n ARG 50 Cb 0.72 -1.29 -0.10 0.00 -1.05 0.00 0.00 32.46 30.73 1nqt n ARG 50 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1nqt n ILE 51 N -0.79 0.85 0.06 8.89 5.41 0.28 -4.52 119.36 129.54 1nqt n ILE 51 Ca 0.13 -0.53 -0.10 0.00 1.00 0.00 0.00 62.75 63.25 1nqt n ILE 51 Cb 0.06 -0.67 0.02 0.00 -0.71 0.00 0.00 39.64 38.33 1nqt n ILE 51 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1nqt h ILE 52 N 0.00 1.39 0.23 1.39 2.04 -0.94 -3.34 117.51 118.29 1nqt h ILE 52 Ca -0.34 -2.23 0.01 0.00 1.00 0.00 0.00 64.86 63.30 1nqt h ILE 52 Cb 1.76 2.19 -0.03 0.00 -0.74 0.00 0.00 36.82 40.00 1nqt h ILE 52 CO 0.02 0.67 -0.38 0.50 0.00 0.00 0.00 178.15 178.95 1nqt h LYS 53 N 0.25 -0.66 -7.00 2.37 3.64 -1.66 -3.45 116.57 110.05 1nqt h LYS 53 Ca -0.04 0.05 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 1nqt h LYS 53 Cb 1.36 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1nqt h LYS 53 CO 0.13 -0.44 0.37 -1.25 -2.27 0.00 0.00 179.45 175.99 1nqt s PRO 54 N -5.96 4.18 0.18 1.90 0.04 -1.26 -5.01 135.00 129.08 1nqt s PRO 54 Ca -0.16 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 61.90 1nqt s PRO 54 Cb 0.07 -2.38 -0.08 0.00 0.04 0.00 0.00 34.50 32.15 1nqt s PRO 54 CO 0.63 -0.09 1.28 0.00 0.04 0.00 0.00 177.00 178.86 1nqt h ASN 56 N 5.58 0.00 -5.02 0.00 4.21 -1.09 -3.46 115.58 115.80 1nqt h ASN 56 Ca -0.44 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 56.96 1nqt h ASN 56 Cb 1.21 0.00 -0.19 0.00 -1.12 0.00 0.00 38.32 38.23 1nqt h ASN 56 CO 0.78 0.46 -0.28 -1.00 -1.29 0.00 0.00 177.43 176.11 1nqt s HIS 57 N -3.11 -0.13 -0.27 1.19 3.76 -1.01 -5.06 115.29 110.66 1nqt s HIS 57 Ca 0.03 0.12 -0.11 0.00 -0.15 0.00 0.00 55.06 54.95 1nqt s HIS 57 Cb 0.08 0.09 0.10 0.00 1.11 0.00 0.00 32.58 33.96 1nqt s HIS 57 CO 0.73 -0.43 0.60 0.54 -0.85 0.00 0.00 174.74 175.33 1nqt s VAL 58 N -1.86 -0.60 -0.15 -0.90 0.11 -1.26 -1.41 120.40 114.33 1nqt s VAL 58 Ca -0.10 0.04 -0.03 0.00 -2.93 0.00 0.00 61.98 58.96 1nqt s VAL 58 Cb -0.03 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 33.88 1nqt s VAL 58 CO 0.01 0.02 -0.05 -0.22 -3.33 0.00 0.00 175.10 171.53 1nqt s LEU 59 N 2.40 3.21 -0.08 2.54 2.96 -0.07 -4.98 118.68 124.66 1nqt s LEU 59 Ca -0.07 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1nqt s LEU 59 Cb -0.10 -1.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 1nqt s LEU 59 CO -0.18 0.18 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.48 1nqt s SER 60 N 0.28 4.25 0.15 3.68 0.01 -1.26 -1.07 113.70 119.74 1nqt s SER 60 Ca -0.04 -0.17 -0.06 0.00 1.31 0.00 0.00 55.95 56.99 1nqt s SER 60 Cb -0.14 -1.18 -0.02 0.00 0.21 0.00 0.00 66.02 64.89 1nqt s SER 60 CO 0.03 0.30 0.20 -1.48 0.41 0.00 0.00 173.24 172.70 1nqt s LEU 61 N -0.43 1.26 -0.34 2.44 2.34 0.27 -5.00 118.68 119.22 1nqt s LEU 61 Ca 0.05 -0.97 0.01 0.00 0.06 0.00 0.00 54.13 53.29 1nqt s LEU 61 Cb -0.12 0.89 0.14 0.00 -0.56 0.00 0.00 46.19 46.54 1nqt s LEU 61 CO 0.02 -0.83 0.31 -0.94 -1.06 0.00 0.00 176.35 173.85 1nqt s SER 62 N -2.99 1.80 0.46 1.48 1.04 -1.25 -0.81 113.70 113.42 1nqt s SER 62 Ca 0.18 -1.51 0.08 0.00 0.48 0.00 0.00 55.95 55.18 1nqt s SER 62 Cb 0.05 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.47 1nqt s SER 62 CO -0.00 -0.31 0.51 0.72 0.98 0.00 0.00 173.24 175.14 1nqt s PHE 63 N 1.60 2.40 0.19 5.02 -0.12 -0.59 -4.85 117.98 121.63 1nqt s PHE 63 Ca 0.15 -0.54 0.10 0.00 -0.05 0.00 0.00 56.93 56.59 1nqt s PHE 63 Cb -0.17 -2.21 -0.04 0.00 -0.63 0.00 0.00 43.02 39.97 1nqt s PHE 63 CO -0.11 -0.42 -0.21 -1.25 -0.05 0.00 0.00 175.22 173.18 1nqt s PRO 64 N -4.30 1.41 0.22 1.99 0.04 -1.26 0.54 135.00 133.65 1nqt s PRO 64 Ca 0.51 -1.49 0.01 0.00 0.04 0.00 0.00 61.00 60.07 1nqt s PRO 64 Cb -0.06 -1.59 -0.05 0.00 0.04 0.00 0.00 34.50 32.85 1nqt s PRO 64 CO 0.30 0.33 0.09 0.96 0.04 0.00 0.00 177.00 178.73 1nqt s ILE 65 N -1.92 0.40 -0.77 0.56 -4.36 -0.71 -4.94 121.20 109.45 1nqt s ILE 65 Ca 0.19 -1.99 0.03 0.00 -0.26 0.00 0.00 60.65 58.62 1nqt s ILE 65 Cb -0.07 -2.50 0.20 0.00 1.25 0.00 0.00 42.46 41.34 1nqt s ILE 65 CO 0.09 -0.09 0.67 0.54 0.24 0.00 0.00 174.94 176.39 1nqt n ARG 66 N -0.36 2.30 -0.74 0.37 1.74 -1.26 -2.94 116.66 115.77 1nqt n ARG 66 Ca -0.01 -4.53 -0.27 0.00 -0.77 0.00 0.00 57.85 52.27 1nqt n ARG 66 Cb 0.66 -2.33 -0.03 0.00 -1.02 0.00 0.00 32.46 29.74 1nqt n ARG 66 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1nqt n ARG 67 N 1.84 0.00 -0.21 5.56 1.74 -0.99 -4.54 116.66 120.06 1nqt n ARG 67 Ca 0.22 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.33 1nqt n ARG 67 Cb 0.36 -0.65 0.07 0.00 -1.02 0.00 0.00 32.46 31.23 1nqt n ARG 67 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1nqt n ASP 68 N 0.87 -0.22 -0.81 0.55 9.92 -1.26 0.75 116.55 126.35 1nqt n ASP 68 Ca 0.10 0.98 0.00 0.00 -0.53 0.00 0.00 54.79 55.34 1nqt n ASP 68 Cb 0.08 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.27 1nqt n ASP 68 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1nqt n ASP 69 N -4.92 0.96 0.00 -2.24 5.68 -1.26 -4.79 116.55 109.98 1nqt n ASP 69 Ca 0.09 -0.85 0.00 0.00 -0.50 0.00 0.00 54.79 53.52 1nqt n ASP 69 Cb 0.28 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1nqt n ASP 69 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nqt n GLY 70 N 0.60 1.47 3.76 6.12 0.00 0.23 -4.98 105.19 112.38 1nqt n GLY 70 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.84 4.80 0.35 1.61 1.04 -1.24 -4.78 113.70 114.63 1nqt s SER 71 Ca 0.00 2.02 0.02 0.00 0.48 0.00 0.00 55.95 58.46 1nqt s SER 71 Cb 0.00 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.55 1nqt s SER 71 CO 0.00 -1.84 0.53 0.26 0.98 0.00 0.00 173.24 173.17 1nqt s TRP 72 N -2.42 3.40 -0.22 5.02 0.51 -1.26 -2.34 118.94 121.63 1nqt s TRP 72 Ca 0.67 0.20 -0.27 0.00 -2.12 0.00 0.00 56.10 54.58 1nqt s TRP 72 Cb -0.21 -1.93 0.08 0.00 -0.81 0.00 0.00 33.47 30.60 1nqt s TRP 72 CO 0.45 0.07 0.77 -2.00 -0.51 0.00 0.00 176.95 175.73 1nqt s GLU 73 N -4.29 0.83 -0.18 4.98 2.12 -1.15 -4.92 118.70 116.09 1nqt s GLU 73 Ca 0.41 0.73 -0.05 0.00 0.36 0.00 0.00 54.97 56.42 1nqt s GLU 73 Cb -0.10 0.40 -0.03 0.00 0.26 0.00 0.00 34.13 34.67 1nqt s GLU 73 CO 0.35 -0.15 0.00 0.14 -0.54 0.00 0.00 175.26 175.06 1nqt s VAL 74 N -0.07 4.13 0.00 3.70 -7.23 -1.26 -1.74 120.40 117.92 1nqt s VAL 74 Ca -0.02 -0.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.89 1nqt s VAL 74 Cb -0.04 -2.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 1nqt s VAL 74 CO 0.02 0.45 0.06 -0.63 -0.31 0.00 0.00 175.10 174.69 1nqt s ILE 75 N 0.67 4.53 0.03 -0.62 1.01 0.19 -4.93 121.20 122.08 1nqt s ILE 75 Ca -0.00 -0.49 0.07 0.00 0.00 0.00 0.00 60.65 60.23 1nqt s ILE 75 Cb -0.14 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 1nqt s ILE 75 CO 0.02 0.35 -0.17 -1.83 0.00 0.00 0.00 174.94 173.30 1nqt s GLU 76 N -1.71 2.13 0.28 2.79 -1.05 -1.26 -1.54 118.70 118.34 1nqt s GLU 76 Ca 0.22 -0.94 -0.20 0.00 -0.15 0.00 0.00 54.97 53.89 1nqt s GLU 76 Cb -0.12 -2.21 0.03 0.00 -0.44 0.00 0.00 34.13 31.39 1nqt s GLU 76 CO 0.13 0.55 0.76 0.20 0.95 0.00 0.00 175.26 177.86 1nqt s GLY 77 N -1.36 -0.01 0.12 -3.83 0.00 0.01 -0.72 107.32 101.52 1nqt s GLY 77 Ca 0.14 -0.35 -0.08 0.00 0.00 0.00 0.00 44.72 44.43 1nqt s GLY 77 CO 0.05 -0.07 0.22 -0.19 0.00 0.00 0.00 173.10 173.11 1nqt s TYR 78 N -3.52 0.27 -0.09 1.90 1.51 0.21 -0.56 117.35 117.07 1nqt s TYR 78 Ca 0.12 -0.68 -0.04 0.00 -1.01 0.00 0.00 57.07 55.46 1nqt s TYR 78 Cb -0.05 -0.08 0.04 0.00 -0.11 0.00 0.00 41.96 41.76 1nqt s TYR 78 CO 0.07 -0.60 0.20 0.50 -1.11 0.00 0.00 175.55 174.61 1nqt s ARG 79 N -3.91 0.14 -0.15 -0.62 6.06 -0.23 0.47 118.95 120.71 1nqt s ARG 79 Ca 0.10 0.49 0.02 0.00 -2.50 0.00 0.00 55.73 53.84 1nqt s ARG 79 Cb 0.04 -0.15 0.01 0.00 0.06 0.00 0.00 34.95 34.92 1nqt s ARG 79 CO -0.07 -0.19 -0.20 0.00 -2.50 0.00 0.00 175.30 172.35 1nqt s ALA 80 N 1.43 2.15 -0.33 6.12 0.00 0.31 -0.89 121.76 130.55 1nqt s ALA 80 Ca -0.07 -1.05 -0.11 0.00 0.00 0.00 0.00 51.96 50.72 1nqt s ALA 80 Cb -0.11 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 21.98 1nqt s ALA 80 CO -0.07 -0.14 0.20 -0.65 0.00 0.00 0.00 175.76 175.09 1nqt s GLN 81 N 1.01 3.37 0.00 0.00 -0.21 -0.50 -0.91 119.66 122.42 1nqt s GLN 81 Ca -0.03 -0.71 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1nqt s GLN 81 Cb -0.15 -3.69 0.00 0.00 1.00 0.00 0.00 33.01 30.17 1nqt s GLN 81 CO -0.05 -0.45 0.00 1.58 -2.12 0.00 0.00 175.29 174.24 1nqt n HIS 82 N 5.04 0.00 -3.97 0.91 -0.00 0.92 -2.42 115.22 115.71 1nqt n HIS 82 Ca -0.13 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.37 1nqt n HIS 82 Cb 0.49 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.46 1nqt n HIS 82 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nqt s SER 83 N -1.49 6.30 -0.04 0.26 0.15 -1.24 -1.61 113.70 116.03 1nqt s SER 83 Ca 0.00 0.08 0.06 0.00 0.70 0.00 0.00 55.95 56.79 1nqt s SER 83 Cb 0.00 -1.86 0.09 0.00 -1.71 0.00 0.00 66.02 62.54 1nqt s SER 83 CO 0.00 -0.05 0.95 1.41 1.20 0.00 0.00 173.24 176.76 1nqt n HIS 84 N -1.24 0.00 0.01 3.44 -0.00 -1.26 -4.00 115.22 112.17 1nqt n HIS 84 Ca -0.09 -0.47 0.17 0.00 -0.00 0.00 0.00 57.72 57.33 1nqt n HIS 84 Cb 0.56 -0.07 0.64 0.00 -0.00 0.00 0.00 29.99 31.12 1nqt n HIS 84 CO 0.00 0.00 0.00 -0.56 -0.00 0.00 0.00 176.34 175.78 1nqt h GLN 85 N 0.00 0.10 -4.78 -0.41 -0.00 -1.95 -3.30 115.11 104.77 1nqt h GLN 85 Ca 0.00 -0.01 -0.66 0.00 -0.00 0.00 0.00 58.65 57.99 1nqt h GLN 85 Cb 0.90 -0.02 -0.37 0.00 -0.00 0.00 0.00 27.48 27.99 1nqt h GLN 85 CO 0.00 0.06 -0.80 0.50 -0.00 0.00 0.00 178.83 178.60 1nqt s ARG 86 N -5.12 2.15 0.28 0.06 6.06 -1.26 -4.95 118.95 116.17 1nqt s ARG 86 Ca -0.06 -1.26 0.18 0.00 -2.50 0.00 0.00 55.73 52.09 1nqt s ARG 86 Cb 0.19 -2.82 0.99 0.00 0.06 0.00 0.00 34.95 33.37 1nqt s ARG 86 CO 0.73 -0.56 1.10 2.41 -2.50 0.00 0.00 175.30 176.48 1nqt n THR 87 N 4.48 -0.25 -3.61 4.11 -1.04 -1.24 -2.54 114.28 114.20 1nqt n THR 87 Ca -0.14 1.36 -0.40 0.00 -2.04 0.00 0.00 64.05 62.83 1nqt n THR 87 Cb 0.43 -2.22 -0.08 0.00 -1.82 0.00 0.00 70.33 66.64 1nqt n THR 87 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1nqt s PRO 88 N -4.94 2.70 0.17 -2.82 0.02 -1.21 -4.37 135.00 124.55 1nqt s PRO 88 Ca -0.06 -2.28 -0.33 0.00 0.02 0.00 0.00 61.00 58.36 1nqt s PRO 88 Cb 0.23 -3.90 -0.16 0.00 0.02 0.00 0.00 34.50 30.68 1nqt s PRO 88 CO 0.56 -1.19 1.09 0.00 -0.33 0.00 0.00 177.00 177.12 1nqt s LYS 90 N -0.47 1.73 0.00 0.00 2.47 -0.03 0.15 119.74 123.59 1nqt s LYS 90 Ca 0.73 -0.84 0.00 0.00 -1.56 0.00 0.00 55.97 54.31 1nqt s LYS 90 Cb -0.89 -1.71 0.00 0.00 -1.46 0.00 0.00 37.83 33.77 1nqt s LYS 90 CO 0.53 0.46 0.00 0.41 0.16 0.00 0.00 175.35 176.92 1nqt n GLY 91 N 2.38 2.50 3.81 5.54 0.00 -0.89 -1.52 105.19 117.01 1nqt n GLY 91 Ca -0.16 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.13 -0.02 0.00 -1.26 -2.37 107.32 105.16 1nqt s GLY 92 Ca 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 44.00 1nqt s GLY 92 CO 0.00 -0.10 -0.20 -0.42 0.00 0.00 0.00 173.10 172.38 1nqt s ILE 93 N -3.41 2.34 -0.19 0.90 1.01 0.14 -0.52 121.20 121.47 1nqt s ILE 93 Ca 0.67 -0.90 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1nqt s ILE 93 Cb -0.11 -1.94 -0.00 0.00 0.01 0.00 0.00 42.46 40.41 1nqt s ILE 93 CO 0.53 0.54 -0.11 -0.60 0.00 0.00 0.00 174.94 175.31 1nqt s ARG 94 N 0.57 3.28 -0.57 2.79 3.52 -0.96 -3.53 118.95 124.05 1nqt s ARG 94 Ca -0.12 -0.69 -0.15 0.00 -0.13 0.00 0.00 55.73 54.63 1nqt s ARG 94 Cb -0.16 -2.80 0.14 0.00 -1.56 0.00 0.00 34.95 30.57 1nqt s ARG 94 CO 0.04 -0.10 0.52 0.71 -0.81 0.00 0.00 175.30 175.66 1nqt s TYR 95 N 1.15 3.31 -0.18 5.12 4.12 -1.26 -0.12 117.35 129.48 1nqt s TYR 95 Ca 0.01 -1.39 -0.28 0.00 0.02 0.00 0.00 57.07 55.44 1nqt s TYR 95 Cb -0.14 -3.79 0.08 0.00 -1.52 0.00 0.00 41.96 36.59 1nqt s TYR 95 CO -0.03 -1.02 0.78 0.45 0.02 0.00 0.00 175.55 175.75 1nqt s SER 96 N 3.42 -0.63 -0.02 2.29 0.15 -0.65 -4.63 113.70 113.62 1nqt s SER 96 Ca 0.05 1.00 -0.01 0.00 0.70 0.00 0.00 55.95 57.68 1nqt s SER 96 Cb -0.28 0.93 -0.02 0.00 -1.71 0.00 0.00 66.02 64.95 1nqt s SER 96 CO 0.02 -0.37 2.19 0.35 1.20 0.00 0.00 173.24 176.62 1nqt n THR 97 N 1.79 2.16 -1.49 6.45 -2.24 -0.12 -2.66 114.28 118.18 1nqt n THR 97 Ca -0.15 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1nqt n THR 97 Cb 0.56 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 1nqt n THR 97 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1nqt n ASP 98 N 1.54 0.00 -3.99 3.42 9.92 -1.26 -4.98 116.55 121.20 1nqt n ASP 98 Ca 0.07 -1.14 0.00 0.00 -0.53 0.00 0.00 54.79 53.19 1nqt n ASP 98 Cb 0.55 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 1nqt n ASP 98 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 1nqt n VAL 99 N 0.00 0.00 0.00 2.53 0.24 -1.09 -5.05 118.33 114.96 1nqt n VAL 99 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1nqt n VAL 99 Cb 0.53 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 1nqt n VAL 99 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1nqt n SER 100 N 0.00 0.00 0.33 -1.34 3.41 -1.26 -4.90 113.62 109.86 1nqt n SER 100 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.68 1nqt n SER 100 Cb 0.00 0.00 0.36 0.00 -0.26 0.00 0.00 64.21 64.31 1nqt n SER 100 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1nqt h VAL 101 N 0.00 0.00 0.11 -3.33 2.07 -1.98 2.67 116.25 115.79 1nqt h VAL 101 Ca 0.00 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.22 1nqt h VAL 101 Cb 0.00 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1nqt h VAL 101 CO 0.00 0.00 -1.46 0.44 0.02 0.00 0.00 177.57 176.57 1nqt h ASP 102 N 0.00 0.36 0.54 0.57 3.45 -1.98 -3.00 116.42 116.35 1nqt h ASP 102 Ca 0.00 -0.48 -0.03 0.00 0.43 0.00 0.00 57.03 56.96 1nqt h ASP 102 Cb 1.42 -0.12 0.01 0.00 -0.56 0.00 0.00 39.33 40.08 1nqt h ASP 102 CO -0.00 1.39 -0.26 -0.08 -1.57 0.00 0.00 179.24 178.73 1nqt h GLU 103 N 0.06 -0.70 -0.81 3.56 4.81 0.43 -1.56 114.58 120.38 1nqt h GLU 103 Ca -0.21 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.15 1nqt h GLU 103 Cb 2.00 0.16 -0.06 0.00 0.63 0.00 0.00 28.75 31.48 1nqt h GLU 103 CO 0.16 -0.39 0.53 -0.39 -0.73 0.00 0.00 179.01 178.19 1nqt h VAL 104 N -0.95 0.97 0.00 0.32 -1.51 -1.46 0.67 116.25 114.28 1nqt h VAL 104 Ca -0.07 -0.27 -0.04 0.00 -1.23 0.00 0.00 66.70 65.09 1nqt h VAL 104 Cb 0.63 0.12 -0.01 0.00 -2.13 0.00 0.00 31.29 29.90 1nqt h VAL 104 CO 0.12 0.14 -0.21 0.11 -1.23 0.00 0.00 177.57 176.51 1nqt h LYS 105 N 0.78 0.00 0.12 5.19 1.57 -1.37 -0.55 116.57 122.31 1nqt h LYS 105 Ca 0.37 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 1nqt h LYS 105 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1nqt h LYS 105 CO -0.14 0.21 -0.06 0.00 -0.57 0.00 0.00 179.45 178.89 1nqt h ALA 106 N 1.79 -0.16 -0.56 3.86 0.00 0.13 -2.95 119.26 121.38 1nqt h ALA 106 Ca -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1nqt h ALA 106 Cb 0.60 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1nqt h ALA 106 CO 0.03 -0.20 0.25 -0.07 0.00 0.00 0.00 179.25 179.25 1nqt h LEU 107 N -0.93 0.71 -1.48 0.00 4.07 -0.99 -0.04 115.31 116.65 1nqt h LEU 107 Ca -0.02 -0.07 0.01 0.00 0.08 0.00 0.00 57.88 57.89 1nqt h LEU 107 Cb 0.51 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 1nqt h LEU 107 CO 0.03 0.62 0.36 0.00 -1.08 0.00 0.00 178.44 178.37 1nqt h ALA 108 N 1.49 1.65 0.03 1.53 0.00 -1.19 0.71 119.26 123.49 1nqt h ALA 108 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1nqt h ALA 108 Cb 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1nqt h ALA 108 CO -0.02 0.31 -0.01 1.03 0.00 0.00 0.00 179.25 180.55 1nqt h SER 109 N 0.70 -0.03 0.10 0.00 0.87 -0.86 -3.06 113.55 111.26 1nqt h SER 109 Ca 0.21 -0.21 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1nqt h SER 109 Cb -0.02 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 1nqt h SER 109 CO -0.05 0.19 -0.31 0.25 -0.53 0.00 0.00 176.83 176.38 1nqt h LEU 110 N -0.26 -0.89 -0.88 2.23 5.85 0.20 -2.95 115.31 118.61 1nqt h LEU 110 Ca -0.00 0.11 0.10 0.00 0.84 0.00 0.00 57.88 58.93 1nqt h LEU 110 Cb 0.24 0.34 -0.13 0.00 0.37 0.00 0.00 40.66 41.48 1nqt h LEU 110 CO 0.01 -0.39 -0.50 0.24 -0.34 0.00 0.00 178.44 177.45 1nqt h MET 111 N -0.51 -0.07 -0.74 1.25 2.86 -0.95 0.16 114.93 116.93 1nqt h MET 111 Ca 0.04 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.75 1nqt h MET 111 Cb 0.56 0.02 -0.09 0.00 0.06 0.00 0.00 31.60 32.14 1nqt h MET 111 CO -0.20 -0.05 -0.43 2.41 1.06 0.00 0.00 176.91 179.71 1nqt n THR 112 N -5.35 -0.50 -0.08 2.22 -1.04 -1.12 -0.31 114.28 108.11 1nqt n THR 112 Ca 0.04 1.79 -0.14 0.00 -2.04 0.00 0.00 64.05 63.70 1nqt n THR 112 Cb 0.32 -2.23 -0.05 0.00 -1.82 0.00 0.00 70.33 66.56 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 0.79 -0.75 -1.42 0.05 -1.22 -2.78 116.97 111.64 1nqt h TYR 113 Ca 0.13 -0.25 0.08 0.00 0.05 0.00 0.00 58.73 58.74 1nqt h TYR 113 Cb 0.32 -0.16 -0.05 0.00 1.01 0.00 0.00 36.73 37.85 1nqt h TYR 113 CO -0.76 0.99 0.49 -0.22 -1.05 0.00 0.00 178.16 177.62 1nqt h LYS 114 N 0.36 0.70 -0.15 4.88 3.64 0.18 -1.40 116.57 124.78 1nqt h LYS 114 Ca 0.03 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 1nqt h LYS 114 Cb 0.88 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1nqt h LYS 114 CO 0.07 0.46 -0.15 0.00 -2.27 0.00 0.00 179.45 177.57 1nqt h ALA 116 N 0.61 0.89 -0.27 0.00 0.00 -1.10 0.29 119.26 119.67 1nqt h ALA 116 Ca 0.02 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1nqt h ALA 116 Cb 0.68 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 1nqt h ALA 116 CO 0.04 0.03 -0.55 0.28 0.00 0.00 0.00 179.25 179.05 1nqt h VAL 117 N 0.66 0.00 -1.36 0.00 2.07 -1.20 -0.98 116.25 115.45 1nqt h VAL 117 Ca 0.30 0.00 -0.59 0.00 0.82 0.00 0.00 66.70 67.23 1nqt h VAL 117 Cb 0.21 0.00 -0.21 0.00 -1.52 0.00 0.00 31.29 29.77 1nqt h VAL 117 CO -0.19 0.00 0.63 1.33 0.02 0.00 0.00 177.57 179.36 1nqt n VAL 118 N -5.37 3.40 -3.21 2.57 0.24 -0.81 -4.77 118.33 110.39 1nqt n VAL 118 Ca -0.05 -3.38 -0.01 0.00 -2.04 0.00 0.00 64.34 58.86 1nqt n VAL 118 Cb 0.36 -1.45 -0.00 0.00 -1.47 0.00 0.00 33.84 31.27 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 -0.04 -4.50 -1.34 8.00 -0.37 -4.86 116.55 113.76 1nqt n ASP 119 Ca 0.50 -0.03 -0.38 0.00 0.71 0.00 0.00 54.79 55.60 1nqt n ASP 119 Cb 0.45 -0.04 -0.12 0.00 -0.02 0.00 0.00 41.12 41.39 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 -4.11 4.77 -0.82 2.53 1.01 0.89 -5.00 120.40 119.68 1nqt s VAL 120 Ca 0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 1nqt s VAL 120 Cb -0.00 -3.30 -0.11 0.00 0.00 0.00 0.00 36.38 32.97 1nqt s VAL 120 CO 0.02 0.24 2.54 -0.81 0.00 0.00 0.00 175.10 177.09 1nqt n PRO 121 N 4.99 2.31 -4.16 2.72 -0.04 -1.26 -4.21 135.00 135.35 1nqt n PRO 121 Ca -0.15 -1.42 -0.13 0.00 -0.04 0.00 0.00 63.50 61.76 1nqt n PRO 121 Cb 0.51 -2.36 -0.11 0.00 -0.04 0.00 0.00 33.50 31.51 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 2.51 0.98 0.18 0.54 2.99 -1.26 -4.48 117.98 119.44 1nqt s PHE 122 Ca 0.50 -0.68 -0.04 0.00 0.00 0.00 0.00 56.93 56.71 1nqt s PHE 122 Cb 0.16 -0.55 -0.05 0.00 0.00 0.00 0.00 43.02 42.59 1nqt s PHE 122 CO -0.03 -0.04 0.41 0.20 -0.00 0.00 0.00 175.22 175.76 1nqt s GLY 123 N -2.45 2.06 0.37 4.36 0.00 -1.05 -4.79 107.32 105.82 1nqt s GLY 123 Ca 0.05 -0.63 -0.27 0.00 0.00 0.00 0.00 44.72 43.86 1nqt s GLY 123 CO -0.01 -0.56 1.25 -0.32 0.00 0.00 0.00 173.10 173.46 1nqt s GLY 124 N -2.74 2.94 0.28 0.20 0.00 -1.26 -0.85 107.32 105.89 1nqt s GLY 124 Ca 0.41 1.14 -0.13 0.00 0.00 0.00 0.00 44.72 46.14 1nqt s GLY 124 CO 0.27 1.73 0.55 0.00 0.00 0.00 0.00 173.10 175.65 1nqt s ALA 125 N -1.26 -0.35 -0.29 3.20 0.00 -0.57 -0.05 121.76 122.42 1nqt s ALA 125 Ca 0.54 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 51.40 1nqt s ALA 125 Cb -0.36 1.00 0.19 0.00 0.00 0.00 0.00 23.12 23.95 1nqt s ALA 125 CO 0.47 -0.89 1.42 0.21 0.00 0.00 0.00 175.76 176.96 1nqt s LYS 126 N -3.73 0.06 0.38 0.00 2.47 -0.09 -4.19 119.74 114.64 1nqt s LYS 126 Ca 0.21 0.06 0.05 0.00 -1.56 0.00 0.00 55.97 54.73 1nqt s LYS 126 Cb -0.02 0.03 -0.07 0.00 -1.46 0.00 0.00 37.83 36.31 1nqt s LYS 126 CO 0.10 -0.01 0.03 0.00 0.16 0.00 0.00 175.35 175.63 1nqt s ALA 127 N -0.22 2.86 -0.28 3.13 0.00 0.32 0.11 121.76 127.68 1nqt s ALA 127 Ca 0.08 -2.12 -0.20 0.00 0.00 0.00 0.00 51.96 49.72 1nqt s ALA 127 Cb -0.04 0.39 0.10 0.00 0.00 0.00 0.00 23.12 23.57 1nqt s ALA 127 CO -0.14 -0.20 0.84 0.20 0.00 0.00 0.00 175.76 176.46 1nqt s GLY 128 N -3.62 -0.37 -0.18 0.00 0.00 0.18 -2.26 107.32 101.07 1nqt s GLY 128 Ca 0.34 2.54 0.01 0.00 0.00 0.00 0.00 44.72 47.61 1nqt s GLY 128 CO 0.16 2.16 -0.20 0.14 0.00 0.00 0.00 173.10 175.36 1nqt s VAL 129 N 0.95 2.06 -1.18 1.40 1.01 0.83 0.64 120.40 126.11 1nqt s VAL 129 Ca -0.04 -0.95 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 1nqt s VAL 129 Cb -0.05 -1.86 -0.11 0.00 0.00 0.00 0.00 36.38 34.36 1nqt s VAL 129 CO -0.11 0.53 1.96 1.17 0.00 0.00 0.00 175.10 178.66 1nqt n LYS 130 N 4.62 1.40 -3.99 2.72 3.00 0.10 -2.03 118.16 123.99 1nqt n LYS 130 Ca -0.21 -2.37 -0.09 0.00 -0.00 0.00 0.00 58.31 55.64 1nqt n LYS 130 Cb 0.50 -3.76 -0.08 0.00 0.00 0.00 0.00 35.03 31.69 1nqt n LYS 130 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 1nqt s ILE 131 N 11.90 0.10 -0.45 3.15 1.10 -1.21 -4.67 121.20 131.12 1nqt s ILE 131 Ca 0.70 -1.49 0.02 0.00 -0.51 0.00 0.00 60.65 59.37 1nqt s ILE 131 Cb -0.01 -1.76 0.15 0.00 0.15 0.00 0.00 42.46 40.99 1nqt s ILE 131 CO 0.14 -0.46 0.28 0.21 -2.11 0.00 0.00 174.94 173.01 1nqt s ASN 132 N -2.96 3.24 0.15 4.50 3.84 -1.26 -0.94 114.94 121.51 1nqt s ASN 132 Ca 0.15 -2.79 0.08 0.00 0.21 0.00 0.00 52.86 50.52 1nqt s ASN 132 Cb 0.05 -0.88 0.55 0.00 -0.55 0.00 0.00 41.25 40.42 1nqt s ASN 132 CO -0.03 -0.23 0.65 -2.65 -2.79 0.00 0.00 177.10 172.05 1nqt n PRO 133 N 3.30 -0.03 0.23 0.43 -0.02 -1.26 0.22 135.00 137.87 1nqt n PRO 133 Ca 0.15 0.57 0.16 0.00 -2.02 0.00 0.00 63.50 62.36 1nqt n PRO 133 Cb 0.38 -1.03 0.82 0.00 -0.02 0.00 0.00 33.50 33.65 1nqt n PRO 133 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1nqt h LYS 134 N 0.00 0.00 -0.34 -0.52 1.79 -1.97 -1.38 116.57 114.15 1nqt h LYS 134 Ca 0.35 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.82 1nqt h LYS 134 Cb 0.91 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 1nqt h LYS 134 CO -0.32 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.14 1nqt n ASN 135 N -2.58 3.43 -4.36 0.86 3.02 0.59 -4.94 115.26 111.27 1nqt n ASN 135 Ca -0.02 -2.00 -0.22 0.00 -0.03 0.00 0.00 54.58 52.31 1nqt n ASN 135 Cb 0.06 -0.21 -0.11 0.00 -0.61 0.00 0.00 39.78 38.91 1nqt n ASN 135 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1nqt s TYR 136 N -1.57 1.91 0.82 3.10 2.02 -0.52 -5.07 117.35 118.02 1nqt s TYR 136 Ca 0.37 -0.46 -0.11 0.00 -0.37 0.00 0.00 57.07 56.50 1nqt s TYR 136 Cb 0.23 -0.91 0.10 0.00 -0.40 0.00 0.00 41.96 40.97 1nqt s TYR 136 CO 0.32 0.41 1.17 0.95 -1.57 0.00 0.00 175.55 176.83 1nqt s THR 137 N -2.31 2.05 0.10 -0.71 -4.23 -1.26 -4.82 115.64 104.46 1nqt s THR 137 Ca 0.20 -0.06 -0.35 0.00 -1.18 0.00 0.00 61.69 60.30 1nqt s THR 137 Cb -0.05 -2.99 -0.15 0.00 1.34 0.00 0.00 72.50 70.65 1nqt s THR 137 CO 0.08 0.00 1.56 0.44 -0.54 0.00 0.00 174.62 176.16 1nqt h ASP 138 N -1.07 -1.55 -0.52 3.99 5.19 -1.99 -1.38 116.42 119.09 1nqt h ASP 138 Ca -0.45 0.15 0.08 0.00 -0.62 0.00 0.00 57.03 56.19 1nqt h ASP 138 Cb 1.31 0.56 -0.10 0.00 0.18 0.00 0.00 39.33 41.28 1nqt h ASP 138 CO 0.60 -0.59 -0.46 -1.13 -3.12 0.00 0.00 179.24 174.54 1nqt h ASN 139 N -0.83 -1.55 -0.47 6.45 -0.73 -2.00 0.11 115.58 116.56 1nqt h ASN 139 Ca -0.02 0.24 0.09 0.00 1.87 0.00 0.00 56.30 58.48 1nqt h ASN 139 Cb 0.80 0.68 -0.08 0.00 0.27 0.00 0.00 38.32 39.99 1nqt h ASN 139 CO -0.23 -0.35 -0.04 -0.33 -0.37 0.00 0.00 177.43 176.11 1nqt h GLU 140 N -0.27 0.07 -0.79 6.67 5.08 -1.88 -0.18 114.58 123.28 1nqt h GLU 140 Ca 0.15 -0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.69 1nqt h GLU 140 Cb 0.57 -0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.68 1nqt h GLU 140 CO -0.65 0.05 0.17 -0.07 -1.00 0.00 0.00 179.01 177.51 1nqt h LEU 141 N 0.07 -0.05 0.71 1.33 3.38 0.33 0.15 115.31 121.24 1nqt h LEU 141 Ca 0.23 0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.34 1nqt h LEU 141 Cb 0.35 0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.35 1nqt h LEU 141 CO -0.42 -0.10 -0.34 -0.08 0.09 0.00 0.00 178.44 177.59 1nqt h GLU 142 N 0.22 -0.92 -0.32 1.13 4.81 -0.06 -1.96 114.58 117.48 1nqt h GLU 142 Ca 0.46 0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.78 1nqt h GLU 142 Cb 0.84 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.39 1nqt h GLU 142 CO -0.58 -0.61 -0.19 1.63 -0.73 0.00 0.00 179.01 178.52 1nqt n LYS 143 N -5.50 -0.14 0.00 1.92 5.02 0.30 -0.99 118.16 118.78 1nqt n LYS 143 Ca -0.14 1.11 0.00 0.00 -2.02 0.00 0.00 58.31 57.27 1nqt n LYS 143 Cb 0.39 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1nqt n LYS 143 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1nqt n ILE 144 N -3.71 0.00 0.08 -0.18 -0.00 0.07 -1.01 119.36 114.60 1nqt n ILE 144 Ca 0.01 1.08 0.04 0.00 -0.00 0.00 0.00 62.75 63.87 1nqt n ILE 144 Cb 0.08 -1.52 0.20 0.00 -0.00 0.00 0.00 39.64 38.40 1nqt n ILE 144 CO 0.00 0.00 0.00 1.07 -0.00 0.00 0.00 176.55 177.62 1nqt n THR 145 N -1.83 1.07 -0.07 1.39 5.66 -0.66 -1.36 114.28 118.49 1nqt n THR 145 Ca 0.00 0.62 -0.08 0.00 -3.05 0.00 0.00 64.05 61.53 1nqt n THR 145 Cb 0.00 -1.62 -0.05 0.00 -1.55 0.00 0.00 70.33 67.12 1nqt n THR 145 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1nqt h ARG 146 N 0.00 0.00 -0.81 1.09 3.08 0.69 -3.09 114.38 115.34 1nqt h ARG 146 Ca 0.00 0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.22 1nqt h ARG 146 Cb 0.37 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.37 1nqt h ARG 146 CO 0.00 0.35 0.54 -0.09 -1.07 0.00 0.00 179.97 179.70 1nqt h ARG 147 N -1.00 0.42 0.10 0.04 9.65 -0.89 0.48 114.38 123.18 1nqt h ARG 147 Ca -0.08 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 1nqt h ARG 147 Cb 0.62 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 1nqt h ARG 147 CO -0.05 0.28 -0.12 0.35 2.80 0.00 0.00 179.97 183.23 1nqt h PHE 148 N 0.43 -0.32 -0.85 2.20 3.57 -1.33 -1.80 116.94 118.83 1nqt h PHE 148 Ca 0.41 0.00 0.09 0.00 3.53 0.00 0.00 57.97 62.00 1nqt h PHE 148 Cb 0.95 0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.76 1nqt h PHE 148 CO -0.00 -0.19 0.55 1.15 -2.23 0.00 0.00 178.31 177.59 1nqt h THR 149 N -0.26 0.97 0.34 4.41 2.02 -0.87 0.40 112.91 119.92 1nqt h THR 149 Ca 0.01 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 1nqt h THR 149 Cb 0.26 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1nqt h THR 149 CO -0.05 0.15 -0.16 0.24 0.37 0.00 0.00 175.52 176.07 1nqt h MET 150 N 0.84 -0.44 -0.94 6.66 2.86 -0.39 0.47 114.93 123.99 1nqt h MET 150 Ca 0.39 0.03 0.16 0.00 -2.06 0.00 0.00 59.70 58.22 1nqt h MET 150 Cb 0.39 0.10 -0.08 0.00 0.06 0.00 0.00 31.60 32.07 1nqt h MET 150 CO -0.16 -0.29 0.60 0.93 1.06 0.00 0.00 176.91 179.05 1nqt h GLU 151 N -0.50 0.68 -0.07 1.72 4.39 -1.15 1.20 114.58 120.85 1nqt h GLU 151 Ca -0.05 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1nqt h GLU 151 Cb 0.35 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1nqt h GLU 151 CO 0.08 0.45 -0.16 1.25 -1.16 0.00 0.00 179.01 179.46 1nqt h LEU 152 N 0.70 0.11 0.14 1.33 5.85 -0.09 -2.72 115.31 120.63 1nqt h LEU 152 Ca 0.49 -0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.96 1nqt h LEU 152 Cb 0.82 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.84 1nqt h LEU 152 CO -0.25 0.29 -1.07 0.00 -0.34 0.00 0.00 178.44 177.06 1nqt h ALA 153 N 1.73 -0.02 -0.12 1.25 0.00 0.35 0.42 119.26 122.88 1nqt h ALA 153 Ca 0.02 -0.84 0.03 0.00 0.00 0.00 0.00 54.91 54.13 1nqt h ALA 153 Cb 0.36 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1nqt h ALA 153 CO 0.02 0.55 0.09 0.87 0.00 0.00 0.00 179.25 180.78 1nqt h LYS 154 N -0.30 0.00 -0.17 0.00 1.57 -0.19 -2.48 116.57 115.00 1nqt h LYS 154 Ca -0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1nqt h LYS 154 Cb 1.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.04 1nqt h LYS 154 CO 0.13 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.64 1nqt n LYS 155 N -4.34 2.12 -1.06 3.15 4.76 -1.03 -4.99 118.16 116.76 1nqt n LYS 155 Ca -0.00 -1.93 0.00 0.00 -2.87 0.00 0.00 58.31 53.50 1nqt n LYS 155 Cb 0.21 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 1nqt n LYS 155 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nqt n GLY 156 N 1.24 1.00 0.28 0.72 0.00 -0.94 -4.97 105.19 102.52 1nqt n GLY 156 Ca 0.14 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.70 0.00 -3.63 1.61 3.72 0.15 -4.74 117.46 111.87 1nqt n PHE 157 Ca 0.00 -1.19 -0.04 0.00 -0.05 0.00 0.00 57.45 56.17 1nqt n PHE 157 Cb 0.24 -0.19 -0.05 0.00 -0.94 0.00 0.00 39.48 38.54 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 -3.02 -0.48 0.00 4.37 -1.16 -1.18 -4.77 121.20 114.96 1nqt s ILE 158 Ca 0.34 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.48 1nqt s ILE 158 Cb 0.31 -1.00 0.00 0.00 0.61 0.00 0.00 42.46 42.38 1nqt s ILE 158 CO -0.01 0.00 0.00 0.61 -2.81 0.00 0.00 174.94 172.73 1nqt n GLY 159 N 4.83 1.96 0.33 1.50 0.00 0.71 -4.58 105.19 109.94 1nqt n GLY 159 Ca -0.16 0.05 0.21 0.00 0.00 0.00 0.00 46.02 46.12 1nqt n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt h PRO 160 N 0.00 0.00 0.00 1.61 0.13 -1.81 0.31 132.00 132.23 1nqt h PRO 160 Ca 0.00 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.76 1nqt h PRO 160 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 1nqt h PRO 160 CO 0.00 0.00 -2.08 0.41 -0.23 0.00 0.00 178.00 176.11 1nqt n GLY 161 N -0.99 -0.58 0.34 1.56 0.00 -1.26 -4.83 105.19 99.42 1nqt n GLY 161 Ca -0.03 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 1nqt n GLY 161 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nqt h ILE 162 N -1.00 0.00 -2.33 -0.61 2.04 -1.66 -3.20 117.51 110.76 1nqt h ILE 162 Ca -0.56 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 64.85 1nqt h ILE 162 Cb 1.49 0.00 -0.27 0.00 -0.74 0.00 0.00 36.82 37.30 1nqt h ILE 162 CO -0.34 0.00 -0.36 -0.62 0.00 0.00 0.00 178.15 176.83 1nqt s ASP 163 N -4.48 -0.31 -0.32 1.72 2.15 0.06 -0.56 116.67 114.93 1nqt s ASP 163 Ca -0.12 0.94 -0.10 0.00 0.43 0.00 0.00 52.55 53.70 1nqt s ASP 163 Cb 0.01 1.43 -0.00 0.00 -0.30 0.00 0.00 42.92 44.06 1nqt s ASP 163 CO 0.36 -0.24 0.17 -0.69 -0.17 0.00 0.00 175.17 174.59 1nqt s VAL 164 N 2.64 4.66 0.83 1.11 1.01 0.40 -0.21 120.40 130.83 1nqt s VAL 164 Ca 0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.41 1nqt s VAL 164 Cb -0.13 -3.40 0.10 0.00 0.00 0.00 0.00 36.38 32.95 1nqt s VAL 164 CO -0.14 0.02 1.20 -2.84 0.00 0.00 0.00 175.10 173.34 1nqt s PRO 165 N 1.62 1.72 0.25 2.72 0.02 -1.22 -2.09 135.00 138.02 1nqt s PRO 165 Ca 0.04 -0.02 -0.19 0.00 0.02 0.00 0.00 61.00 60.85 1nqt s PRO 165 Cb -0.17 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.42 1nqt s PRO 165 CO 0.07 -1.73 0.64 0.00 -0.33 0.00 0.00 177.00 175.64 1nqt s ALA 166 N -3.61 -1.02 0.75 -1.55 0.00 -1.00 -2.34 121.76 112.99 1nqt s ALA 166 Ca 0.64 -0.34 -0.10 0.00 0.00 0.00 0.00 51.96 52.16 1nqt s ALA 166 Cb -0.10 0.90 0.06 0.00 0.00 0.00 0.00 23.12 23.98 1nqt s ALA 166 CO 0.49 -0.95 1.11 -1.25 0.00 0.00 0.00 175.76 175.16 1nqt s PRO 167 N -3.92 2.26 0.00 0.00 0.04 -1.26 0.23 135.00 132.35 1nqt s PRO 167 Ca 0.12 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.26 1nqt s PRO 167 Cb -0.04 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1nqt s PRO 167 CO 0.04 -1.35 0.00 -3.47 0.04 0.00 0.00 177.00 172.26 1nqt n ASP 168 N -3.13 1.70 0.09 6.66 2.03 -1.22 -4.48 116.55 118.21 1nqt n ASP 168 Ca 0.08 -0.04 -0.22 0.00 0.52 0.00 0.00 54.79 55.12 1nqt n ASP 168 Cb 0.60 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.85 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 0.46 0.00 -0.67 2.86 -1.99 -3.28 114.93 112.31 1nqt h MET 169 Ca 0.00 -0.73 -0.00 0.00 -2.06 0.00 0.00 59.70 56.91 1nqt h MET 169 Cb 0.00 0.26 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 1nqt h MET 169 CO 0.00 1.34 -0.00 0.66 1.06 0.00 0.00 176.91 179.97 1nqt h SER 170 N -0.04 0.00 -2.95 1.22 4.64 -1.89 -3.44 113.55 111.09 1nqt h SER 170 Ca -0.19 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.58 1nqt h SER 170 Cb 1.88 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.81 1nqt h SER 170 CO 0.21 0.00 -0.77 0.42 -0.87 0.00 0.00 176.83 175.83 1nqt s THR 171 N -4.96 2.10 0.15 2.95 -4.23 -1.24 -4.77 115.64 105.64 1nqt s THR 171 Ca -0.05 -2.18 0.02 0.00 -1.18 0.00 0.00 61.69 58.30 1nqt s THR 171 Cb 0.17 -2.09 -0.01 0.00 1.34 0.00 0.00 72.50 71.91 1nqt s THR 171 CO 0.64 -0.39 0.06 0.61 -0.54 0.00 0.00 174.62 175.00 1nqt n GLY 172 N -0.21 3.76 0.27 3.99 0.00 -1.26 -3.38 105.19 108.36 1nqt n GLY 172 Ca -0.09 -1.96 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.33 -0.71 1.61 4.11 -1.97 -1.75 114.58 115.54 1nqt h GLU 173 Ca -0.11 0.02 0.17 0.00 0.07 0.00 0.00 59.36 59.51 1nqt h GLU 173 Cb 0.45 0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.64 1nqt h GLU 173 CO 0.18 -0.22 -0.08 2.89 0.07 0.00 0.00 179.01 181.85 1nqt n ARG 174 N -5.36 -0.06 0.15 1.06 1.85 -1.26 -0.14 116.66 112.90 1nqt n ARG 174 Ca -0.04 1.08 -0.11 0.00 -1.00 0.00 0.00 57.85 57.79 1nqt n ARG 174 Cb 0.28 -1.67 -0.06 0.00 -1.05 0.00 0.00 32.46 29.95 1nqt n ARG 174 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1nqt h GLU 175 N 0.00 -0.44 -1.13 2.89 5.08 -1.75 -2.45 114.58 116.79 1nqt h GLU 175 Ca 0.38 0.03 0.32 0.00 -1.00 0.00 0.00 59.36 59.09 1nqt h GLU 175 Cb 0.70 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.95 1nqt h GLU 175 CO -0.70 -0.13 0.73 0.52 -1.00 0.00 0.00 179.01 178.43 1nqt h MET 176 N -0.97 0.27 0.44 2.33 2.86 0.05 0.55 114.93 120.45 1nqt h MET 176 Ca -0.05 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1nqt h MET 176 Cb 0.51 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1nqt h MET 176 CO 0.08 0.18 -0.21 1.03 1.06 0.00 0.00 176.91 179.05 1nqt h SER 177 N 0.28 -0.50 -0.84 1.22 0.87 -0.48 0.33 113.55 114.43 1nqt h SER 177 Ca 0.66 -0.04 0.07 0.00 -1.23 0.00 0.00 61.79 61.25 1nqt h SER 177 Cb 1.85 0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 63.88 1nqt h SER 177 CO -0.32 -0.27 0.50 -0.50 -0.53 0.00 0.00 176.83 175.72 1nqt h TRP 178 N -0.70 0.92 0.35 2.24 6.55 0.37 0.20 115.95 125.88 1nqt h TRP 178 Ca -0.06 0.03 -0.00 0.00 0.95 0.00 0.00 58.89 59.81 1nqt h TRP 178 Cb 0.51 -0.29 -0.03 0.00 -0.86 0.00 0.00 29.16 28.49 1nqt h TRP 178 CO -0.02 0.43 -0.38 0.82 -1.05 0.00 0.00 178.44 178.24 1nqt h ILE 179 N 0.89 0.23 -0.23 1.49 2.04 -0.02 0.22 117.51 122.13 1nqt h ILE 179 Ca 0.38 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.27 1nqt h ILE 179 Cb 0.25 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 36.49 1nqt h ILE 179 CO -0.20 0.00 -0.45 0.00 0.00 0.00 0.00 178.15 177.50 1nqt h ALA 180 N -0.33 -0.75 -0.26 1.87 0.00 -0.19 -0.98 119.26 118.62 1nqt h ALA 180 Ca -0.02 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1nqt h ALA 180 Cb 0.69 0.99 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1nqt h ALA 180 CO -0.08 -0.94 -0.14 0.22 0.00 0.00 0.00 179.25 178.31 1nqt h ASP 181 N -0.39 -0.47 -0.28 0.00 1.82 -0.22 -1.28 116.42 115.60 1nqt h ASP 181 Ca 0.04 0.11 0.06 0.00 -0.39 0.00 0.00 57.03 56.85 1nqt h ASP 181 Cb 0.51 0.25 -0.06 0.00 0.68 0.00 0.00 39.33 40.72 1nqt h ASP 181 CO -0.42 -0.18 -0.12 0.74 -1.61 0.00 0.00 179.24 177.65 1nqt h THR 182 N -0.11 0.62 -0.58 2.25 2.02 -0.15 -0.85 112.91 116.10 1nqt h THR 182 Ca 0.14 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.40 1nqt h THR 182 Cb 0.33 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.29 1nqt h THR 182 CO -0.33 0.00 0.23 0.22 0.37 0.00 0.00 175.52 176.01 1nqt h TYR 183 N -0.07 0.41 0.00 3.16 3.20 -0.54 -1.59 116.97 121.54 1nqt h TYR 183 Ca 0.14 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 1nqt h TYR 183 Cb 0.29 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1nqt h TYR 183 CO -0.31 0.14 -0.40 0.00 -1.64 0.00 0.00 178.16 175.94 1nqt h ALA 184 N 1.38 1.01 -0.00 1.82 0.00 -0.71 0.10 119.26 122.86 1nqt h ALA 184 Ca 0.28 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1nqt h ALA 184 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1nqt h ALA 184 CO -0.26 0.50 -0.50 0.43 0.00 0.00 0.00 179.25 179.42 1nqt n SER 185 N -3.59 0.75 0.00 0.00 7.64 -0.37 -2.99 113.62 115.05 1nqt n SER 185 Ca -0.00 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.33 1nqt n SER 185 Cb 0.51 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 1nqt n SER 185 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1nqt n THR 186 N -1.24 0.00 -0.24 0.44 -1.04 -0.63 -4.69 114.28 106.88 1nqt n THR 186 Ca 0.07 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.03 1nqt n THR 186 Cb 0.34 -0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.90 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 1.18 -0.56 12.58 1.08 -1.78 -2.87 117.51 127.14 1nqt h ILE 187 Ca 0.00 -0.33 -0.34 0.00 -0.39 0.00 0.00 64.86 63.81 1nqt h ILE 187 Cb 0.00 0.19 -0.17 0.00 -3.07 0.00 0.00 36.82 33.77 1nqt h ILE 187 CO 0.00 0.17 0.44 0.61 -0.69 0.00 0.00 178.15 178.68 1nqt n GLY 188 N -1.27 3.93 0.19 5.37 0.00 0.34 -4.50 105.19 109.24 1nqt n GLY 188 Ca 0.06 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 45.02 1nqt n GLY 188 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1nqt h HIS 189 N 1.09 0.59 -0.00 1.61 6.17 -1.40 -3.11 115.15 120.10 1nqt h HIS 189 Ca 0.35 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.42 1nqt h HIS 189 Cb 1.45 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 31.19 1nqt h HIS 189 CO 0.90 0.45 -0.04 0.66 0.71 0.00 0.00 177.93 180.61 1nqt n TYR 190 N -4.71 0.00 -2.83 5.26 4.02 -1.26 -4.86 117.16 112.79 1nqt n TYR 190 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.48 1nqt n TYR 190 Cb 0.08 -0.21 -0.04 0.00 -0.02 0.00 0.00 39.34 39.15 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 -2.47 7.17 -0.06 7.72 3.68 -1.17 -4.90 116.67 126.64 1nqt s ASP 191 Ca 0.31 1.42 0.00 0.00 2.13 0.00 0.00 52.55 56.41 1nqt s ASP 191 Cb 0.20 -2.50 0.09 0.00 -1.45 0.00 0.00 42.92 39.26 1nqt s ASP 191 CO 0.46 -0.28 1.16 0.00 0.13 0.00 0.00 175.17 176.63 1nqt n ILE 192 N 4.15 1.33 -1.86 4.11 3.06 -1.26 -2.55 119.36 126.35 1nqt n ILE 192 Ca 0.04 -0.28 0.00 0.00 -2.50 0.00 0.00 62.75 60.02 1nqt n ILE 192 Cb 0.50 -0.96 0.00 0.00 0.54 0.00 0.00 39.64 39.73 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 0.33 0.00 -0.11 9.51 3.02 -1.26 -4.92 115.26 121.83 1nqt n ASN 193 Ca 0.08 -1.02 0.27 0.00 -0.03 0.00 0.00 54.58 53.87 1nqt n ASN 193 Cb 0.65 -0.00 0.64 0.00 -0.61 0.00 0.00 39.78 40.45 1nqt n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nqt h ALA 194 N 0.00 2.63 -0.03 5.41 0.00 -1.77 0.88 119.26 126.39 1nqt h ALA 194 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1nqt h ALA 194 Cb 1.01 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1nqt h ALA 194 CO 0.00 -1.25 0.00 0.72 0.00 0.00 0.00 179.25 178.72 1nqt n HIS 195 N -3.59 0.04 -0.89 0.00 8.25 -1.26 -2.46 115.22 115.31 1nqt n HIS 195 Ca 0.17 -0.02 0.08 0.00 -0.26 0.00 0.00 57.72 57.69 1nqt n HIS 195 Cb 1.10 0.00 0.38 0.00 1.12 0.00 0.00 29.99 32.59 1nqt n HIS 195 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nqt n ALA 196 N -0.56 3.66 1.18 -1.41 0.00 0.31 -4.20 120.51 119.49 1nqt n ALA 196 Ca 0.17 -1.96 0.14 0.00 0.00 0.00 0.00 53.44 51.79 1nqt n ALA 196 Cb 0.14 -1.04 0.64 0.00 0.00 0.00 0.00 19.45 19.19 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 -2.81 0.00 0.16 0.00 0.11 -1.26 -3.45 120.40 113.16 1nqt s VAL 198 Ca 0.20 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.27 1nqt s VAL 198 Cb 0.19 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 34.06 1nqt s VAL 198 CO 0.51 0.00 0.17 0.35 -3.33 0.00 0.00 175.10 172.80 1nqt n THR 199 N 1.51 0.00 -1.41 5.04 -2.24 -0.99 -4.70 114.28 111.49 1nqt n THR 199 Ca -0.13 -0.60 -0.10 0.00 -2.27 0.00 0.00 64.05 60.94 1nqt n THR 199 Cb 0.57 -0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 68.18 1nqt n THR 199 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nqt n GLY 200 N 3.02 1.03 3.97 3.38 0.00 -1.26 -4.53 105.19 110.79 1nqt n GLY 200 Ca 0.02 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 1nqt n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nqt s LYS 201 N -3.07 3.01 1.05 1.61 -2.85 -1.26 -4.14 119.74 114.08 1nqt s LYS 201 Ca 0.00 -0.72 -0.15 0.00 -1.00 0.00 0.00 55.97 54.10 1nqt s LYS 201 Cb 0.00 -2.64 0.11 0.00 -2.06 0.00 0.00 37.83 33.24 1nqt s LYS 201 CO 0.00 -0.22 0.40 -2.30 0.10 0.00 0.00 175.35 173.34 1nqt n PRO 202 N -1.96 -1.15 -0.03 1.78 -0.02 -1.26 -3.66 135.00 128.69 1nqt n PRO 202 Ca 0.02 -0.30 -0.13 0.00 -2.02 0.00 0.00 63.50 61.06 1nqt n PRO 202 Cb 0.58 -1.89 -0.11 0.00 -0.02 0.00 0.00 33.50 32.06 1nqt n PRO 202 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1nqt h ILE 203 N -1.96 1.52 -0.17 4.25 1.08 -1.92 1.10 117.51 121.40 1nqt h ILE 203 Ca -0.50 -1.64 0.05 0.00 -0.39 0.00 0.00 64.86 62.38 1nqt h ILE 203 Cb 1.32 2.61 -0.01 0.00 -3.07 0.00 0.00 36.82 37.68 1nqt h ILE 203 CO 0.39 0.42 0.43 -1.28 -0.69 0.00 0.00 178.15 177.41 1nqt h SER 204 N -0.72 0.00 -0.02 1.72 0.87 -1.93 1.20 113.55 114.66 1nqt h SER 204 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1nqt h SER 204 Cb 0.70 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 1nqt h SER 204 CO 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 176.83 176.13 1nqt n GLN 205 N -3.17 1.93 0.00 2.24 1.13 -1.09 -4.94 117.38 113.49 1nqt n GLN 205 Ca 0.02 -1.60 0.00 0.00 -1.94 0.00 0.00 57.00 53.48 1nqt n GLN 205 Cb 0.52 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.41 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 1.37 1.64 3.04 1.08 0.00 0.41 -4.90 105.19 107.84 1nqt n GLY 206 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1nqt n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nqt n GLY 207 N -0.51 -3.14 3.31 -0.02 0.00 0.38 -4.65 105.19 100.57 1nqt n GLY 207 Ca 0.00 -1.42 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 1nqt n GLY 207 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1nqt s ILE 208 N -2.52 1.92 0.05 -0.61 2.07 -1.26 -4.78 121.20 116.07 1nqt s ILE 208 Ca 0.62 -1.45 -0.31 0.00 -1.41 0.00 0.00 60.65 58.11 1nqt s ILE 208 Cb -0.08 -1.69 -0.06 0.00 0.13 0.00 0.00 42.46 40.77 1nqt s ILE 208 CO 0.49 0.16 1.24 -1.00 -1.91 0.00 0.00 174.94 173.92 1nqt s HIS 209 N -0.94 3.34 0.00 3.50 3.76 -1.26 -3.85 115.29 119.83 1nqt s HIS 209 Ca 0.10 1.21 0.00 0.00 -0.15 0.00 0.00 55.06 56.22 1nqt s HIS 209 Cb -0.10 -3.47 0.00 0.00 1.11 0.00 0.00 32.58 30.13 1nqt s HIS 209 CO 0.03 -1.50 0.00 0.41 -0.85 0.00 0.00 174.74 172.83 1nqt n GLY 210 N 3.30 0.97 0.05 -2.22 0.00 -1.26 -4.24 105.19 101.79 1nqt n GLY 210 Ca 0.10 -0.15 0.01 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 210 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nqt n ARG 211 N -0.12 0.72 0.09 1.61 0.63 -1.25 -3.72 116.66 114.62 1nqt n ARG 211 Ca 0.00 -0.11 -0.22 0.00 -0.92 0.00 0.00 57.85 56.60 1nqt n ARG 211 Cb 0.11 -1.50 -0.14 0.00 0.45 0.00 0.00 32.46 31.38 1nqt n ARG 211 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1nqt h ILE 212 N 0.00 1.34 0.00 5.15 2.04 -1.94 -3.26 117.51 120.83 1nqt h ILE 212 Ca -0.24 -2.49 -0.06 0.00 1.00 0.00 0.00 64.86 63.06 1nqt h ILE 212 Cb 1.54 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 40.47 1nqt h ILE 212 CO 0.01 0.74 -0.28 0.77 0.00 0.00 0.00 178.15 179.39 1nqt h SER 213 N 0.10 0.00 -1.36 1.72 4.64 -2.00 -3.39 113.55 113.25 1nqt h SER 213 Ca -0.19 0.00 0.40 0.00 -0.47 0.00 0.00 61.79 61.53 1nqt h SER 213 Cb 1.88 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.91 1nqt h SER 213 CO 0.22 0.28 0.97 0.00 -0.87 0.00 0.00 176.83 177.44 1nqt h ALA 214 N 1.72 3.24 0.03 5.18 0.00 -1.64 0.12 119.26 127.92 1nqt h ALA 214 Ca -0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 1nqt h ALA 214 Cb 1.12 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1nqt h ALA 214 CO 0.04 -1.65 -0.87 1.15 0.00 0.00 0.00 179.25 177.92 1nqt h THR 215 N 0.02 1.25 -0.43 0.00 2.02 -1.79 -2.82 112.91 111.16 1nqt h THR 215 Ca 0.66 -2.30 0.08 0.00 0.77 0.00 0.00 66.41 65.62 1nqt h THR 215 Cb 2.58 2.76 -0.07 0.00 -1.74 0.00 0.00 68.15 71.69 1nqt h THR 215 CO -0.03 0.52 0.03 1.23 0.37 0.00 0.00 175.52 177.63 1nqt h GLY 216 N -0.72 0.46 1.80 2.16 0.00 -1.54 0.02 103.07 105.25 1nqt h GLY 216 Ca -0.22 0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.08 1nqt h GLY 216 CO -0.07 -0.09 -0.20 3.21 0.00 0.00 0.00 176.54 179.40 1nqt h ARG 217 N 0.14 0.24 0.45 4.80 3.08 -0.99 -2.59 114.38 119.51 1nqt h ARG 217 Ca 0.21 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1nqt h ARG 217 Cb 0.29 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 1nqt h ARG 217 CO -0.33 0.44 -0.41 0.78 -1.07 0.00 0.00 179.97 179.38 1nqt h GLY 218 N 0.87 -0.99 -0.27 0.04 0.00 -1.07 -2.07 103.07 99.58 1nqt h GLY 218 Ca 0.04 0.46 0.02 0.00 0.00 0.00 0.00 47.33 47.86 1nqt h GLY 218 CO 0.03 -0.33 -0.16 -0.62 0.00 0.00 0.00 176.54 175.46 1nqt n VAL 219 N -5.51 -0.18 0.00 4.60 0.31 -0.61 -0.82 118.33 116.12 1nqt n VAL 219 Ca -0.11 1.64 0.00 0.00 -0.01 0.00 0.00 64.34 65.86 1nqt n VAL 219 Cb 0.40 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 1nqt n VAL 219 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1nqt n PHE 220 N -3.58 0.00 -0.24 3.52 -0.00 -0.99 0.11 117.46 116.28 1nqt n PHE 220 Ca 0.01 0.00 0.18 0.00 -0.00 0.00 0.00 57.45 57.63 1nqt n PHE 220 Cb 0.07 -0.36 0.49 0.00 -0.00 0.00 0.00 39.48 39.69 1nqt n PHE 220 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1nqt h HIS 221 N 0.00 0.57 0.00 -5.13 -0.00 -0.96 0.52 115.15 110.16 1nqt h HIS 221 Ca 0.00 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.40 1nqt h HIS 221 Cb 0.00 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.21 1nqt h HIS 221 CO -0.67 0.16 -0.25 0.78 -0.00 0.00 0.00 177.93 177.95 1nqt h GLY 222 N 0.44 -1.27 0.07 2.45 0.00 0.17 0.44 103.07 105.38 1nqt h GLY 222 Ca 0.46 0.63 0.01 0.00 0.00 0.00 0.00 47.33 48.43 1nqt h GLY 222 CO -0.18 -0.39 -0.49 -2.22 0.00 0.00 0.00 176.54 173.25 1nqt h ILE 223 N -0.31 0.00 -1.19 2.60 2.04 -0.15 -1.94 117.51 118.55 1nqt h ILE 223 Ca 0.01 0.00 0.36 0.00 1.00 0.00 0.00 64.86 66.23 1nqt h ILE 223 Cb 0.34 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.30 1nqt h ILE 223 CO -0.17 0.00 0.77 -0.08 0.00 0.00 0.00 178.15 178.67 1nqt h GLU 224 N -0.67 0.21 -0.36 2.37 4.81 0.28 0.34 114.58 121.55 1nqt h GLU 224 Ca 0.00 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1nqt h GLU 224 Cb 0.69 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1nqt h GLU 224 CO -0.29 0.14 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.02 1nqt h ASN 225 N 0.21 0.79 0.08 1.04 2.35 0.69 -3.08 115.58 117.67 1nqt h ASN 225 Ca 0.72 -0.41 -0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1nqt h ASN 225 Cb 2.11 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 40.26 1nqt h ASN 225 CO -0.36 1.03 -0.04 -0.26 -1.65 0.00 0.00 177.43 176.15 1nqt h PHE 226 N 0.56 -0.10 0.00 1.19 -1.00 -0.84 -3.27 116.94 113.47 1nqt h PHE 226 Ca 0.08 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.86 1nqt h PHE 226 Cb 0.74 0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1nqt h PHE 226 CO 0.06 0.41 0.51 0.97 -1.61 0.00 0.00 178.31 178.65 1nqt h ILE 227 N -0.92 0.00 0.00 -0.55 2.10 -0.51 1.21 117.51 118.84 1nqt h ILE 227 Ca -0.01 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1nqt h ILE 227 Cb 0.55 0.21 0.00 0.00 -1.09 0.00 0.00 36.82 36.49 1nqt h ILE 227 CO 0.02 0.00 -1.09 0.59 -1.08 0.00 0.00 178.15 176.59 1nqt n ASN 228 N -2.08 0.67 -4.62 2.19 5.03 -1.16 -4.71 115.26 110.58 1nqt n ASN 228 Ca -0.01 -0.49 -0.42 0.00 0.87 0.00 0.00 54.58 54.53 1nqt n ASN 228 Cb 0.52 0.97 -0.04 0.00 -1.02 0.00 0.00 39.78 40.21 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 -3.14 3.98 0.03 3.52 2.56 0.42 -4.95 118.70 121.11 1nqt s GLU 229 Ca 0.05 0.67 -0.09 0.00 0.00 0.00 0.00 54.97 55.59 1nqt s GLU 229 Cb 0.15 -3.73 -0.03 0.00 2.00 0.00 0.00 34.13 32.52 1nqt s GLU 229 CO 0.83 -0.72 1.15 0.00 -0.56 0.00 0.00 175.26 175.96 1nqt h ALA 230 N 8.11 -0.56 -0.41 6.30 0.00 -1.90 -1.32 119.26 129.49 1nqt h ALA 230 Ca -0.24 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1nqt h ALA 230 Cb 1.09 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1nqt h ALA 230 CO 0.91 -0.61 0.00 0.43 0.00 0.00 0.00 179.25 179.98 1nqt n SER 231 N -3.34 0.00 -0.13 0.00 7.64 -1.26 0.77 113.62 117.30 1nqt n SER 231 Ca -0.02 0.05 0.17 0.00 1.01 0.00 0.00 58.87 60.09 1nqt n SER 231 Cb 0.10 0.00 0.55 0.00 -1.01 0.00 0.00 64.21 63.85 1nqt n SER 231 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1nqt h TYR 232 N 0.00 0.37 0.00 1.43 -1.99 -1.90 0.11 116.97 114.98 1nqt h TYR 232 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1nqt h TYR 232 Cb 0.00 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 38.61 1nqt h TYR 232 CO 0.00 0.14 0.00 -1.33 -0.00 0.00 0.00 178.16 176.97 1nqt n MET 233 N -4.45 0.08 -2.50 4.88 2.81 0.23 -3.27 117.12 114.91 1nqt n MET 233 Ca 0.14 0.20 -0.25 0.00 -1.81 0.00 0.00 57.70 55.98 1nqt n MET 233 Cb 0.57 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1nqt n MET 233 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1nqt n SER 234 N -1.78 4.33 0.00 7.83 7.64 0.61 0.21 113.62 132.46 1nqt n SER 234 Ca 0.05 -3.60 0.00 0.00 1.01 0.00 0.00 58.87 56.33 1nqt n SER 234 Cb 0.28 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1nqt n SER 234 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1nqt n ILE 235 N -0.43 0.00 0.00 0.44 2.08 -1.20 -4.68 119.36 115.56 1nqt n ILE 235 Ca 0.36 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.67 1nqt n ILE 235 Cb 0.68 0.59 0.00 0.00 -0.75 0.00 0.00 39.64 40.16 1nqt n ILE 235 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1nqt n LEU 236 N 0.00 0.50 -1.54 1.39 4.77 -1.21 -4.98 117.00 115.94 1nqt n LEU 236 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1nqt n LEU 236 Cb 0.11 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1nqt n LEU 236 CO 0.00 0.08 0.01 0.61 -1.33 0.00 0.00 177.39 176.76 1nqt n GLY 237 N 3.00 -0.38 0.00 -0.72 0.00 -0.37 -5.09 105.19 101.63 1nqt n GLY 237 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.95 0.94 -4.18 1.61 2.00 0.57 -4.92 117.12 112.19 1nqt n MET 238 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 57.70 57.36 1nqt n MET 238 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.62 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 -1.37 -0.90 2.03 5.66 -1.26 -4.88 114.28 113.56 1nqt n THR 239 Ca 0.00 -0.10 -0.35 0.00 -3.05 0.00 0.00 64.05 60.55 1nqt n THR 239 Cb 0.00 -1.83 0.08 0.00 -1.55 0.00 0.00 70.33 67.03 1nqt n THR 239 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1nqt n PRO 240 N -4.40 -0.19 -0.07 1.09 -0.02 -1.26 -5.02 135.00 125.14 1nqt n PRO 240 Ca -0.00 -0.04 -0.08 0.00 -2.02 0.00 0.00 63.50 61.37 1nqt n PRO 240 Cb 0.53 -1.40 -0.09 0.00 -0.02 0.00 0.00 33.50 32.52 1nqt n PRO 240 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nqt n GLY 241 N 2.57 -0.48 0.10 -1.23 0.00 -1.26 -4.31 105.19 100.58 1nqt n GLY 241 Ca 0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.62 0.00 0.63 1.61 7.35 -1.26 -4.59 117.46 118.57 1nqt n PHE 242 Ca -0.23 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.57 1nqt n PHE 242 Cb 0.87 -0.83 0.03 0.00 0.35 0.00 0.00 39.48 39.89 1nqt n PHE 242 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nqt n GLY 243 N 2.26 -1.19 5.06 7.13 0.00 -1.26 -4.97 105.19 112.21 1nqt n GLY 243 Ca -0.34 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1nqt n GLY 243 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nqt n ASP 244 N -1.89 0.00 -3.63 1.61 -0.08 -1.26 -4.48 116.55 106.81 1nqt n ASP 244 Ca 0.02 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.17 1nqt n ASP 244 Cb 0.42 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.81 1nqt n ASP 244 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1nqt s LYS 245 N 0.00 0.82 -0.02 -0.67 1.02 -1.26 -4.11 119.74 115.51 1nqt s LYS 245 Ca 0.00 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.00 1nqt s LYS 245 Cb 0.00 0.38 0.02 0.00 -0.52 0.00 0.00 37.83 37.71 1nqt s LYS 245 CO 0.00 -0.10 0.00 0.95 -0.92 0.00 0.00 175.35 175.28 1nqt s THR 246 N 0.48 0.13 0.32 2.17 -4.23 -1.26 -0.95 115.64 112.30 1nqt s THR 246 Ca -0.01 0.08 0.03 0.00 -1.18 0.00 0.00 61.69 60.62 1nqt s THR 246 Cb -0.05 -0.22 -0.05 0.00 1.34 0.00 0.00 72.50 73.52 1nqt s THR 246 CO -0.01 0.12 0.08 0.72 -0.54 0.00 0.00 174.62 174.99 1nqt s PHE 247 N 0.86 1.81 -0.11 3.99 -0.71 -0.76 0.13 117.98 123.18 1nqt s PHE 247 Ca -0.08 -1.07 -0.06 0.00 -1.04 0.00 0.00 56.93 54.68 1nqt s PHE 247 Cb -0.12 -1.15 0.05 0.00 -1.21 0.00 0.00 43.02 40.59 1nqt s PHE 247 CO -0.02 -0.14 0.27 0.08 -1.34 0.00 0.00 175.22 174.07 1nqt s VAL 248 N -3.43 -0.04 -0.21 -2.49 1.01 0.39 -0.95 120.40 114.69 1nqt s VAL 248 Ca 0.35 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.49 1nqt s VAL 248 Cb 0.08 -0.41 0.04 0.00 0.00 0.00 0.00 36.38 36.09 1nqt s VAL 248 CO 0.15 0.06 -0.14 0.54 0.00 0.00 0.00 175.10 175.71 1nqt s VAL 249 N 1.26 1.91 -0.54 2.92 0.11 -1.07 0.17 120.40 125.16 1nqt s VAL 249 Ca -0.09 -1.15 -0.26 0.00 -2.93 0.00 0.00 61.98 57.55 1nqt s VAL 249 Cb -0.10 -1.91 0.03 0.00 -1.53 0.00 0.00 36.38 32.88 1nqt s VAL 249 CO -0.09 0.24 1.03 -1.58 -3.33 0.00 0.00 175.10 171.37 1nqt s GLN 250 N 1.29 3.45 0.00 1.54 -0.44 -0.94 -3.21 119.66 121.34 1nqt s GLN 250 Ca -0.01 0.02 0.00 0.00 -2.50 0.00 0.00 55.36 52.87 1nqt s GLN 250 Cb -0.16 -4.01 0.00 0.00 -1.64 0.00 0.00 33.01 27.20 1nqt s GLN 250 CO -0.09 -1.50 0.00 0.41 0.50 0.00 0.00 175.29 174.61 1nqt n GLY 251 N 5.05 2.95 2.72 2.59 0.00 -1.26 -0.91 105.19 116.33 1nqt n GLY 251 Ca 0.05 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 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 0.00 3.31 -0.80 1.61 -0.00 -1.26 -4.23 117.46 116.09 1nqt n PHE 252 Ca 0.00 -2.96 0.00 0.00 -0.00 0.00 0.00 57.45 54.49 1nqt n PHE 252 Cb 0.00 -0.65 0.00 0.00 -0.00 0.00 0.00 39.48 38.83 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 -0.39 1.41 0.00 7.13 0.00 -1.26 -4.72 105.19 107.35 1nqt n GLY 253 Ca 0.43 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.66 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 0.00 0.00 -0.31 1.61 5.15 -1.26 -2.29 115.26 118.16 1nqt n ASN 254 Ca 0.00 0.64 0.04 0.00 -0.60 0.00 0.00 54.58 54.66 1nqt n ASN 254 Cb 0.00 -0.21 0.12 0.00 -0.53 0.00 0.00 39.78 39.16 1nqt n ASN 254 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1nqt h VAL 255 N 0.00 0.13 0.00 3.44 3.04 -1.92 -1.77 116.25 119.17 1nqt h VAL 255 Ca 0.00 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1nqt h VAL 255 Cb 0.00 0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.41 1nqt h VAL 255 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.17 1nqt n GLY 256 N -1.56 -2.98 0.09 3.17 0.00 -1.24 -0.55 105.19 102.12 1nqt n GLY 256 Ca 0.13 0.32 -0.02 0.00 0.00 0.00 0.00 46.02 46.45 1nqt n GLY 256 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1nqt n LEU 257 N -1.81 -0.24 -0.33 0.99 7.94 -0.72 0.18 117.00 123.01 1nqt n LEU 257 Ca 0.00 0.69 0.07 0.00 -1.11 0.00 0.00 56.01 55.66 1nqt n LEU 257 Cb 0.00 -0.20 0.27 0.00 0.53 0.00 0.00 43.42 44.02 1nqt n LEU 257 CO 0.00 -0.47 1.24 0.45 -1.11 0.00 0.00 177.39 177.50 1nqt h HIS 258 N 0.00 1.06 -0.59 1.96 3.86 -1.35 0.23 115.15 120.33 1nqt h HIS 258 Ca 0.04 0.03 0.08 0.00 -1.16 0.00 0.00 60.37 59.35 1nqt h HIS 258 Cb 0.09 -0.34 -0.06 0.00 1.06 0.00 0.00 27.41 28.16 1nqt h HIS 258 CO -0.50 0.45 0.26 0.77 0.86 0.00 0.00 177.93 179.76 1nqt h SER 259 N 0.94 0.31 0.12 2.45 0.02 0.45 0.95 113.55 118.79 1nqt h SER 259 Ca 0.46 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.46 1nqt h SER 259 Cb 0.46 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1nqt h SER 259 CO -0.22 0.20 -0.06 -0.03 -1.14 0.00 0.00 176.83 175.58 1nqt h MET 260 N 0.47 -0.15 -0.99 3.45 -1.53 0.52 -0.17 114.93 116.53 1nqt h MET 260 Ca 0.28 0.01 0.15 0.00 -3.44 0.00 0.00 59.70 56.70 1nqt h MET 260 Cb 0.28 0.03 -0.09 0.00 -0.55 0.00 0.00 31.60 31.27 1nqt h MET 260 CO -0.25 0.10 0.60 -0.09 0.14 0.00 0.00 176.91 177.41 1nqt h ARG 261 N -0.39 0.84 0.13 0.39 2.43 0.40 0.27 114.38 118.45 1nqt h ARG 261 Ca -0.02 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 58.89 1nqt h ARG 261 Cb 0.32 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1nqt h ARG 261 CO 0.03 0.56 -1.00 1.88 -1.51 0.00 0.00 179.97 179.92 1nqt h TYR 262 N 0.87 0.49 0.24 2.20 0.05 -0.84 -2.88 116.97 117.09 1nqt h TYR 262 Ca 0.53 -0.35 -0.00 0.00 0.05 0.00 0.00 58.73 58.95 1nqt h TYR 262 Cb 0.67 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 1nqt h TYR 262 CO -0.01 1.39 -0.30 1.25 -1.05 0.00 0.00 178.16 179.44 1nqt h LEU 263 N -0.38 -0.83 -0.84 3.88 7.12 -0.58 -2.95 115.31 120.73 1nqt h LEU 263 Ca -0.20 0.07 0.08 0.00 0.13 0.00 0.00 57.88 57.96 1nqt h LEU 263 Cb 1.66 0.28 -0.10 0.00 -0.53 0.00 0.00 40.66 41.97 1nqt h LEU 263 CO 0.11 -0.37 -0.50 -0.74 -0.13 0.00 0.00 178.44 176.81 1nqt h HIS 264 N -0.55 -1.61 0.00 1.25 2.76 -0.62 0.07 115.15 116.44 1nqt h HIS 264 Ca -0.03 0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1nqt h HIS 264 Cb 0.49 0.81 0.00 0.00 1.55 0.00 0.00 27.41 30.26 1nqt h HIS 264 CO -0.22 -0.32 0.78 -0.09 -1.30 0.00 0.00 177.93 176.78 1nqt h ARG 265 N -0.01 0.00 -0.18 5.26 2.43 -1.33 0.12 114.38 120.67 1nqt h ARG 265 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1nqt h ARG 265 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1nqt h ARG 265 CO -0.79 0.00 0.00 1.19 -1.51 0.00 0.00 179.97 178.86 1nqt n PHE 266 N -1.94 0.24 0.00 2.20 3.72 0.01 -5.00 117.46 116.69 1nqt n PHE 266 Ca -0.00 -0.35 0.00 0.00 -0.05 0.00 0.00 57.45 57.05 1nqt n PHE 266 Cb 0.78 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.30 1nqt n PHE 266 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nqt n GLY 267 N 0.32 2.26 3.77 1.37 0.00 0.42 -5.11 105.19 108.22 1nqt n GLY 267 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1nqt n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 268 N -2.03 3.16 -0.28 4.61 0.00 -1.25 -4.55 121.76 121.42 1nqt s ALA 268 Ca 0.00 0.81 -0.03 0.00 0.00 0.00 0.00 51.96 52.74 1nqt s ALA 268 Cb 0.00 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.83 1nqt s ALA 268 CO 0.00 -0.30 0.00 0.15 0.00 0.00 0.00 175.76 175.62 1nqt s LYS 269 N -2.25 2.81 0.17 0.00 1.02 -0.12 -4.09 119.74 117.29 1nqt s LYS 269 Ca 0.55 -1.01 -0.31 0.00 0.02 0.00 0.00 55.97 55.22 1nqt s LYS 269 Cb -0.26 -3.17 -0.09 0.00 -0.52 0.00 0.00 37.83 33.79 1nqt s LYS 269 CO 0.33 -0.47 1.36 0.00 -0.92 0.00 0.00 175.35 175.65 1nqt n ILE 271 N 3.15 0.00 -3.56 0.00 3.06 -0.13 -2.27 119.36 119.61 1nqt n ILE 271 Ca 0.08 -0.24 -0.16 0.00 -2.50 0.00 0.00 62.75 59.94 1nqt n ILE 271 Cb 0.42 0.69 -0.06 0.00 0.54 0.00 0.00 39.64 41.23 1nqt n ILE 271 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1nqt s ALA 272 N -1.81 -1.78 -0.02 1.51 0.00 -1.25 -2.46 121.76 115.95 1nqt s ALA 272 Ca -0.00 1.60 -0.01 0.00 0.00 0.00 0.00 51.96 53.56 1nqt s ALA 272 Cb 0.02 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.68 1nqt s ALA 272 CO 0.14 -0.36 0.04 0.08 0.00 0.00 0.00 175.76 175.66 1nqt s VAL 273 N -0.57 -0.03 0.00 0.00 1.01 -0.84 -2.60 120.40 117.37 1nqt s VAL 273 Ca -0.06 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1nqt s VAL 273 Cb -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.29 1nqt s VAL 273 CO 0.06 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.82 1nqt n GLY 274 N 3.65 0.58 0.00 4.51 0.00 -1.20 -0.83 105.19 111.91 1nqt n GLY 274 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1nqt n GLY 274 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nqt n GLU 275 N 0.00 0.00 -0.18 1.61 2.13 -1.26 -4.44 120.64 118.50 1nqt n GLU 275 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1nqt n GLU 275 Cb 0.00 0.00 0.06 0.00 0.27 0.00 0.00 31.44 31.77 1nqt n GLU 275 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1nqt n SER 276 N 0.00 1.32 0.00 4.31 3.41 -1.26 -4.63 113.62 116.76 1nqt n SER 276 Ca 0.00 -2.34 0.00 0.00 -0.26 0.00 0.00 58.87 56.27 1nqt n SER 276 Cb 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1nqt n SER 276 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1nqt n ASP 277 N -0.69 2.55 0.00 4.04 8.00 -1.26 -5.14 116.55 124.06 1nqt n ASP 277 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1nqt n ASP 277 Cb 0.58 0.40 0.00 0.00 -0.02 0.00 0.00 41.12 42.08 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 1.48 -0.66 0.94 0.44 0.00 -1.26 -5.07 105.19 101.07 1nqt n GLY 278 Ca 0.00 0.64 0.01 0.00 0.00 0.00 0.00 46.02 46.67 1nqt n GLY 278 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nqt n SER 279 N 0.00 -0.25 -3.64 1.61 7.64 -1.26 -4.17 113.62 113.55 1nqt n SER 279 Ca 0.00 -1.02 -0.06 0.00 1.01 0.00 0.00 58.87 58.80 1nqt n SER 279 Cb 0.00 0.38 -0.07 0.00 -1.01 0.00 0.00 64.21 63.51 1nqt n SER 279 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1nqt s ILE 280 N -2.04 0.00 0.32 0.44 1.01 -0.01 -4.33 121.20 116.59 1nqt s ILE 280 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.76 1nqt s ILE 280 Cb -0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1nqt s ILE 280 CO -0.01 0.00 0.14 0.86 0.00 0.00 0.00 174.94 175.93 1nqt s TRP 281 N 0.69 1.65 0.00 3.97 -0.11 -1.01 -1.98 118.94 122.15 1nqt s TRP 281 Ca -0.02 -1.30 0.00 0.00 1.22 0.00 0.00 56.10 56.00 1nqt s TRP 281 Cb -0.04 -0.94 0.00 0.00 -1.50 0.00 0.00 33.47 30.98 1nqt s TRP 281 CO -0.10 -0.42 0.00 -1.71 -4.62 0.00 0.00 176.95 170.10 1nqt n ASN 282 N -0.92 0.00 0.00 5.86 4.05 -1.03 -2.68 115.26 120.55 1nqt n ASN 282 Ca -0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1nqt n ASN 282 Cb 0.65 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.66 1nqt n ASN 282 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1nqt n PRO 283 N 0.00 0.00 -0.02 1.20 -0.02 -1.26 -1.60 135.00 133.30 1nqt n PRO 283 Ca 0.00 0.14 -0.11 0.00 -2.02 0.00 0.00 63.50 61.51 1nqt n PRO 283 Cb 0.00 -1.52 -0.14 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.10 1.10 0.00 2.55 10.43 -1.26 -5.04 116.55 123.23 1nqt n ASP 284 Ca 0.00 0.37 0.00 0.00 2.57 0.00 0.00 54.79 57.73 1nqt n ASP 284 Cb 0.02 -0.20 0.00 0.00 1.84 0.00 0.00 41.12 42.77 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 1.64 4.00 3.82 0.44 0.00 -0.63 -5.03 105.19 109.44 1nqt n GLY 285 Ca -0.20 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.33 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 0.00 5.28 -0.05 -0.61 1.01 -0.96 -5.02 121.20 120.86 1nqt s ILE 286 Ca 0.00 0.13 -0.16 0.00 0.00 0.00 0.00 60.65 60.61 1nqt s ILE 286 Cb 0.00 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 1nqt s ILE 286 CO 0.00 0.59 0.44 -0.62 0.00 0.00 0.00 174.94 175.36 1nqt s ASP 287 N -0.81 6.77 0.00 3.58 2.15 -1.26 -4.57 116.67 122.53 1nqt s ASP 287 Ca 0.14 0.91 0.00 0.00 0.43 0.00 0.00 52.55 54.03 1nqt s ASP 287 Cb -0.12 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1nqt s ASP 287 CO 0.03 0.19 0.80 -2.65 -0.17 0.00 0.00 175.17 173.37 1nqt n PRO 288 N 2.60 0.00 -0.04 4.34 -0.02 -1.26 -1.70 135.00 138.91 1nqt n PRO 288 Ca -0.11 0.49 -0.01 0.00 -2.02 0.00 0.00 63.50 61.85 1nqt n PRO 288 Cb 0.52 -1.30 -0.01 0.00 -0.02 0.00 0.00 33.50 32.69 1nqt n PRO 288 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1nqt n LYS 289 N -1.71 -0.05 -0.29 -0.52 3.00 -1.26 0.04 118.16 117.38 1nqt n LYS 289 Ca 0.00 0.69 -0.08 0.00 -0.00 0.00 0.00 58.31 58.92 1nqt n LYS 289 Cb 0.00 -1.02 -0.07 0.00 0.00 0.00 0.00 35.03 33.94 1nqt n LYS 289 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1nqt n GLU 290 N -3.00 -0.30 0.18 1.64 -0.58 -1.17 -0.02 120.64 117.38 1nqt n GLU 290 Ca 0.00 1.22 0.05 0.00 -0.42 0.00 0.00 57.16 58.01 1nqt n GLU 290 Cb 0.03 -1.80 0.48 0.00 -0.57 0.00 0.00 31.44 29.57 1nqt n GLU 290 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1nqt h LEU 291 N 0.00 0.11 0.10 -4.62 6.46 -0.08 -0.72 115.31 116.56 1nqt h LEU 291 Ca 0.11 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 1nqt h LEU 291 Cb 0.28 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 1nqt h LEU 291 CO -0.65 0.23 -0.05 -0.08 -0.62 0.00 0.00 178.44 177.28 1nqt h GLU 292 N 0.12 -0.13 -0.43 1.25 4.81 0.34 0.32 114.58 120.85 1nqt h GLU 292 Ca 0.03 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1nqt h GLU 292 Cb 0.26 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1nqt h GLU 292 CO 0.02 0.18 0.24 -0.44 -0.73 0.00 0.00 179.01 178.28 1nqt h ASP 293 N -0.45 0.53 0.02 1.04 3.32 -0.27 -1.80 116.42 118.82 1nqt h ASP 293 Ca -0.01 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1nqt h ASP 293 Cb 0.37 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1nqt h ASP 293 CO 0.02 0.46 -0.09 0.15 -1.72 0.00 0.00 179.24 178.06 1nqt h PHE 294 N 0.57 -0.26 -1.28 4.55 3.57 -1.06 0.81 116.94 123.84 1nqt h PHE 294 Ca 0.15 0.01 0.42 0.00 3.53 0.00 0.00 57.97 62.08 1nqt h PHE 294 Cb 0.03 0.11 -0.13 0.00 2.79 0.00 0.00 35.95 38.76 1nqt h PHE 294 CO -0.03 -0.10 0.82 -0.22 -2.23 0.00 0.00 178.31 176.55 1nqt h LYS 295 N -0.13 0.11 0.00 1.11 1.63 -0.83 -2.15 116.57 116.32 1nqt h LYS 295 Ca -0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1nqt h LYS 295 Cb 0.13 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1nqt h LYS 295 CO -0.05 0.07 0.00 -0.11 -3.45 0.00 0.00 179.45 175.92 1nqt n LEU 296 N -4.71 1.65 -0.03 5.20 -0.00 -0.48 -4.02 117.00 114.62 1nqt n LEU 296 Ca 0.36 0.23 0.02 0.00 -0.00 0.00 0.00 56.01 56.61 1nqt n LEU 296 Cb 1.37 -0.01 0.03 0.00 -0.00 0.00 0.00 43.42 44.81 1nqt n LEU 296 CO 0.20 -0.01 0.07 1.67 -0.00 0.00 0.00 177.39 179.33 1nqt n GLN 297 N -0.52 -0.01 -3.62 1.96 7.27 0.27 -4.24 117.38 118.49 1nqt n GLN 297 Ca 0.00 0.12 -0.04 0.00 0.07 0.00 0.00 57.00 57.15 1nqt n GLN 297 Cb 0.00 -0.20 -0.06 0.00 2.41 0.00 0.00 30.24 32.40 1nqt n GLN 297 CO 0.00 0.00 0.00 -3.38 0.07 0.00 0.00 177.06 173.75 1nqt s HIS 298 N -4.58 -1.01 0.00 3.69 -3.43 -0.91 -5.10 115.29 103.95 1nqt s HIS 298 Ca -0.01 1.91 0.00 0.00 -0.80 0.00 0.00 55.06 56.16 1nqt s HIS 298 Cb 0.02 0.60 0.00 0.00 -1.43 0.00 0.00 32.58 31.78 1nqt s HIS 298 CO 0.06 -0.50 0.00 0.41 -2.00 0.00 0.00 174.74 172.71 1nqt n GLY 299 N 4.57 1.65 0.49 -1.38 0.00 -1.26 -4.62 105.19 104.63 1nqt n GLY 299 Ca -0.17 0.58 -0.03 0.00 0.00 0.00 0.00 46.02 46.41 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 3.66 0.81 -0.14 1.61 3.41 -1.26 -4.77 113.62 116.95 1nqt n SER 300 Ca 0.00 -1.22 0.14 0.00 -0.26 0.00 0.00 58.87 57.53 1nqt n SER 300 Cb 0.00 -0.03 0.54 0.00 -0.26 0.00 0.00 64.21 64.46 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 -0.88 0.00 -2.14 -1.33 -6.64 -1.26 -4.33 119.36 102.78 1nqt n ILE 301 Ca 0.01 -0.07 -0.43 0.00 -1.77 0.00 0.00 62.75 60.49 1nqt n ILE 301 Cb 0.08 0.03 -0.03 0.00 -1.44 0.00 0.00 39.64 38.28 1nqt n ILE 301 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 1nqt s LEU 302 N -2.52 4.22 0.00 7.28 1.02 -1.26 -3.28 118.68 124.13 1nqt s LEU 302 Ca 0.26 1.99 0.00 0.00 0.02 0.00 0.00 54.13 56.40 1nqt s LEU 302 Cb 0.20 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.87 1nqt s LEU 302 CO 0.50 -0.93 0.00 0.61 0.02 0.00 0.00 176.35 176.55 1nqt n GLY 303 N 4.06 0.69 3.75 -3.19 0.00 -1.26 -5.09 105.19 104.15 1nqt n GLY 303 Ca 0.16 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.70 3.54 1.31 1.61 5.36 -1.21 -5.08 117.98 121.81 1nqt s PHE 304 Ca 0.00 0.80 -0.20 0.00 -0.96 0.00 0.00 56.93 56.56 1nqt s PHE 304 Cb 0.00 -2.40 0.33 0.00 -0.34 0.00 0.00 43.02 40.60 1nqt s PHE 304 CO 0.00 0.31 1.01 -2.14 -1.46 0.00 0.00 175.22 172.94 1nqt s PRO 305 N 0.16 -2.06 0.00 10.12 0.02 -1.26 -3.38 135.00 138.60 1nqt s PRO 305 Ca 0.22 0.12 0.00 0.00 0.02 0.00 0.00 61.00 61.36 1nqt s PRO 305 Cb -0.15 -1.48 0.00 0.00 0.02 0.00 0.00 34.50 32.89 1nqt s PRO 305 CO 0.08 -4.30 0.00 1.63 -0.33 0.00 0.00 177.00 174.08 1nqt n LYS 306 N -5.22 0.00 0.00 5.54 5.02 -1.26 -4.84 118.16 117.40 1nqt n LYS 306 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1nqt n LYS 306 Cb 0.59 -0.62 0.00 0.00 -0.02 0.00 0.00 35.03 34.99 1nqt n LYS 306 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt n ALA 307 N 0.00 0.00 -3.25 7.82 0.00 -1.22 -4.93 120.51 118.94 1nqt n ALA 307 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1nqt n ALA 307 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1nqt n ALA 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nqt s LYS 308 N 1.67 0.32 -0.23 0.00 2.47 -1.09 -4.96 119.74 117.92 1nqt s LYS 308 Ca 0.00 0.65 -0.36 0.00 -1.56 0.00 0.00 55.97 54.71 1nqt s LYS 308 Cb 0.00 0.38 -0.12 0.00 -1.46 0.00 0.00 37.83 36.62 1nqt s LYS 308 CO 0.00 -0.27 1.97 -2.30 0.16 0.00 0.00 175.35 174.92 1nqt n PRO 309 N 5.31 1.54 -3.25 4.03 -0.02 -1.26 -2.40 135.00 138.95 1nqt n PRO 309 Ca -0.06 0.52 -0.27 0.00 -2.02 0.00 0.00 63.50 61.67 1nqt n PRO 309 Cb 0.53 -2.48 -0.02 0.00 -0.02 0.00 0.00 33.50 31.50 1nqt n PRO 309 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1nqt s TYR 310 N 5.28 3.50 -0.11 6.00 5.04 -1.26 -4.95 117.35 130.84 1nqt s TYR 310 Ca 1.00 0.58 -0.05 0.00 -2.44 0.00 0.00 57.07 56.16 1nqt s TYR 310 Cb -0.82 -2.07 -0.04 0.00 0.35 0.00 0.00 41.96 39.38 1nqt s TYR 310 CO 0.54 0.09 0.10 -2.00 -1.34 0.00 0.00 175.55 172.94 1nqt s GLU 311 N -3.94 3.31 4.09 4.97 2.56 -1.26 -4.11 118.70 124.31 1nqt s GLU 311 Ca 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 54.97 55.19 1nqt s GLU 311 Cb -0.10 -3.07 0.00 0.00 2.00 0.00 0.00 34.13 32.95 1nqt s GLU 311 CO 0.34 0.76 0.00 0.41 -0.56 0.00 0.00 175.26 176.20 1nqt n GLY 312 N 2.00 0.80 3.18 -1.50 0.00 -1.26 -4.86 105.19 103.54 1nqt n GLY 312 Ca -0.19 -0.90 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 1nqt n GLY 312 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nqt s SER 313 N -4.00 2.30 -0.03 1.61 0.15 -1.26 -4.55 113.70 107.92 1nqt s SER 313 Ca 0.00 -0.37 -0.00 0.00 0.70 0.00 0.00 55.95 56.28 1nqt s SER 313 Cb 0.00 -0.44 0.03 0.00 -1.71 0.00 0.00 66.02 63.90 1nqt s SER 313 CO 0.00 0.21 1.79 2.30 1.20 0.00 0.00 173.24 178.74 1nqt n ILE 314 N 2.84 1.88 1.32 6.45 -0.00 -1.26 -3.88 119.36 126.70 1nqt n ILE 314 Ca -0.16 -0.52 0.13 0.00 -0.00 0.00 0.00 62.75 62.20 1nqt n ILE 314 Cb 0.53 -1.37 0.39 0.00 -0.00 0.00 0.00 39.64 39.19 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 1.15 1.60 -0.05 7.28 4.32 -1.26 -4.10 117.00 125.94 1nqt n LEU 315 Ca 0.03 -0.51 -0.07 0.00 -0.02 0.00 0.00 56.01 55.43 1nqt n LEU 315 Cb 0.52 -0.04 -0.02 0.00 -1.62 0.00 0.00 43.42 42.26 1nqt n LEU 315 CO 0.04 0.28 -0.54 -0.62 -1.22 0.00 0.00 177.39 175.33 1nqt n GLU 316 N 0.07 0.39 0.00 3.23 4.71 -1.25 -4.57 120.64 123.22 1nqt n GLU 316 Ca 0.16 0.16 0.00 0.00 -0.01 0.00 0.00 57.16 57.46 1nqt n GLU 316 Cb 0.39 -1.18 0.00 0.00 -1.01 0.00 0.00 31.44 29.64 1nqt n GLU 316 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nqt n ALA 317 N -4.18 -0.02 -2.55 0.62 0.00 -1.26 -3.10 120.51 110.02 1nqt n ALA 317 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.90 1nqt n ALA 317 Cb 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.83 1nqt n ALA 317 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nqt s ASP 318 N 0.00 6.47 0.00 0.00 2.15 -1.26 -4.38 116.67 119.65 1nqt s ASP 318 Ca 0.00 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.29 1nqt s ASP 318 Cb 0.00 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 1nqt s ASP 318 CO 0.00 -1.42 0.00 0.00 -0.17 0.00 0.00 175.17 173.58 1nqt n ASP 320 N 0.00 3.64 -3.96 0.00 10.43 0.12 -4.29 116.55 122.49 1nqt n ASP 320 Ca 0.00 -0.02 -0.27 0.00 2.57 0.00 0.00 54.79 57.06 1nqt n ASP 320 Cb 0.00 0.04 -0.17 0.00 1.84 0.00 0.00 41.12 42.83 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 -2.11 1.20 -0.29 0.53 1.01 -0.64 -1.73 121.20 119.18 1nqt s ILE 321 Ca -0.06 -0.41 -0.05 0.00 0.00 0.00 0.00 60.65 60.12 1nqt s ILE 321 Cb 0.02 -1.17 0.02 0.00 0.01 0.00 0.00 42.46 41.34 1nqt s ILE 321 CO 0.14 0.39 0.04 -0.22 0.00 0.00 0.00 174.94 175.29 1nqt s LEU 322 N 1.50 3.80 -0.47 2.97 1.98 0.91 -0.46 118.68 128.92 1nqt s LEU 322 Ca 0.02 -0.90 -0.07 0.00 -2.89 0.00 0.00 54.13 50.29 1nqt s LEU 322 Cb -0.13 -1.81 0.12 0.00 0.66 0.00 0.00 46.19 45.03 1nqt s LEU 322 CO -0.07 -0.21 0.32 0.27 -1.89 0.00 0.00 176.35 174.76 1nqt s ILE 323 N 1.41 3.92 -0.63 6.68 -4.36 0.13 -2.33 121.20 126.02 1nqt s ILE 323 Ca 0.00 -1.95 -0.26 0.00 -0.26 0.00 0.00 60.65 58.18 1nqt s ILE 323 Cb -0.18 -3.61 -0.05 0.00 1.25 0.00 0.00 42.46 39.87 1nqt s ILE 323 CO 0.00 -0.76 2.13 -2.84 0.24 0.00 0.00 174.94 173.71 1nqt s PRO 324 N 1.19 2.31 -0.68 0.37 0.02 -1.22 -2.21 135.00 134.79 1nqt s PRO 324 Ca 0.07 0.75 0.04 0.00 0.02 0.00 0.00 61.00 61.89 1nqt s PRO 324 Cb -0.24 -4.59 0.32 0.00 0.02 0.00 0.00 34.50 30.00 1nqt s PRO 324 CO -0.02 -3.21 1.05 0.00 -0.33 0.00 0.00 177.00 174.49 1nqt n ALA 325 N 14.70 4.77 -2.00 -1.55 0.00 -0.09 -0.96 120.51 135.38 1nqt n ALA 325 Ca 0.32 -4.72 0.00 0.00 0.00 0.00 0.00 53.44 49.04 1nqt n ALA 325 Cb 0.51 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 0.08 0.00 -0.55 0.00 0.00 -1.23 -4.21 120.51 114.60 1nqt n ALA 326 Ca 0.33 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.49 1nqt n ALA 326 Cb 0.37 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.02 1nqt n ALA 326 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nqt n SER 327 N 0.00 -2.72 -4.91 0.00 7.64 -1.26 -4.74 113.62 107.64 1nqt n SER 327 Ca 0.00 -0.31 -0.27 0.00 1.01 0.00 0.00 58.87 59.30 1nqt n SER 327 Cb 0.00 -0.94 -0.02 0.00 -1.01 0.00 0.00 64.21 62.24 1nqt n SER 327 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1nqt s GLU 328 N -3.77 3.59 -1.35 1.43 2.02 -1.26 -4.54 118.70 114.82 1nqt s GLU 328 Ca 0.54 0.02 -0.16 0.00 0.02 0.00 0.00 54.97 55.39 1nqt s GLU 328 Cb -0.12 -2.56 0.02 0.00 0.10 0.00 0.00 34.13 31.57 1nqt s GLU 328 CO 0.56 0.07 0.43 0.36 0.02 0.00 0.00 175.26 176.70 1nqt n LYS 329 N -1.51 -1.08 0.13 1.61 2.85 -1.10 -4.91 118.16 114.14 1nqt n LYS 329 Ca -0.01 0.18 0.12 0.00 -1.05 0.00 0.00 58.31 57.54 1nqt n LYS 329 Cb 0.55 -3.39 0.05 0.00 -0.65 0.00 0.00 35.03 31.58 1nqt n LYS 329 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 177.40 177.72 1nqt h GLN 330 N -2.15 0.00 -2.76 -1.58 5.75 -1.73 -3.42 115.11 109.23 1nqt h GLN 330 Ca -0.68 0.00 -0.61 0.00 -0.15 0.00 0.00 58.65 57.21 1nqt h GLN 330 Cb 1.39 0.00 -0.42 0.00 1.07 0.00 0.00 27.48 29.53 1nqt h GLN 330 CO 0.59 0.00 -0.59 1.28 -2.65 0.00 0.00 178.83 177.46 1nqt n LEU 331 N -2.73 3.16 0.00 -2.39 4.77 -0.54 -5.02 117.00 114.25 1nqt n LEU 331 Ca 0.01 -5.27 -0.25 0.00 -0.03 0.00 0.00 56.01 50.47 1nqt n LEU 331 Cb 0.54 -0.68 0.17 0.00 -2.33 0.00 0.00 43.42 41.12 1nqt n LEU 331 CO 0.39 1.86 0.73 0.35 -1.33 0.00 0.00 177.39 179.39 1nqt n THR 332 N 1.60 0.00 -0.29 -5.08 -2.24 -1.26 -3.13 114.28 103.87 1nqt n THR 332 Ca 0.24 -1.04 0.09 0.00 -2.27 0.00 0.00 64.05 61.07 1nqt n THR 332 Cb 0.38 -1.39 0.25 0.00 -2.10 0.00 0.00 70.33 67.47 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 0.47 0.00 -0.78 3.64 -1.93 -0.47 116.57 117.50 1nqt h LYS 333 Ca -0.37 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1nqt h LYS 333 Cb 1.09 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1nqt h LYS 333 CO 0.29 0.31 0.00 0.43 -2.27 0.00 0.00 179.45 178.21 1nqt n SER 334 N -4.98 0.00 0.23 4.20 7.64 -1.26 -3.47 113.62 115.98 1nqt n SER 334 Ca 0.19 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.25 1nqt n SER 334 Cb 0.53 0.00 0.82 0.00 -1.01 0.00 0.00 64.21 64.55 1nqt n SER 334 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1nqt h ASN 335 N 0.00 0.00 0.00 6.43 -0.00 -1.95 -3.33 115.58 116.73 1nqt h ASN 335 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1nqt h ASN 335 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 1nqt h ASN 335 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.43 177.43 1nqt n ALA 336 N -2.13 0.00 0.18 4.14 0.00 -0.19 0.63 120.51 123.15 1nqt n ALA 336 Ca 0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.62 1nqt n ALA 336 Cb 0.43 0.16 0.62 0.00 0.00 0.00 0.00 19.45 20.67 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 0.00 0.00 0.00 0.11 -1.76 -1.71 132.00 128.64 1nqt h PRO 337 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1nqt h PRO 337 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1nqt h PRO 337 CO 0.00 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.33 1nqt n ARG 338 N -3.16 0.17 -1.70 1.05 1.74 0.21 -4.87 116.66 110.10 1nqt n ARG 338 Ca 0.05 0.24 -0.36 0.00 -0.77 0.00 0.00 57.85 57.00 1nqt n ARG 338 Cb 0.71 -1.74 0.07 0.00 -1.02 0.00 0.00 32.46 30.48 1nqt n ARG 338 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1nqt s VAL 339 N -3.13 2.17 -0.45 1.55 -7.23 -0.65 -4.84 120.40 107.83 1nqt s VAL 339 Ca 0.09 0.10 0.04 0.00 -1.81 0.00 0.00 61.98 60.40 1nqt s VAL 339 Cb 0.12 -2.95 0.02 0.00 0.56 0.00 0.00 36.38 34.14 1nqt s VAL 339 CO 0.50 -0.03 0.56 0.29 -0.31 0.00 0.00 175.10 176.10 1nqt n LYS 340 N -2.07 0.47 -3.24 4.82 4.76 -1.18 -5.02 118.16 116.70 1nqt n LYS 340 Ca 0.15 -0.63 -0.38 0.00 -2.87 0.00 0.00 58.31 54.58 1nqt n LYS 340 Cb 0.49 -1.02 -0.06 0.00 -1.84 0.00 0.00 35.03 32.60 1nqt n LYS 340 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1nqt s ALA 341 N -0.48 3.55 -1.32 7.82 0.00 -1.26 -4.31 121.76 125.76 1nqt s ALA 341 Ca 0.04 0.05 0.23 0.00 0.00 0.00 0.00 51.96 52.29 1nqt s ALA 341 Cb 0.03 -2.67 0.17 0.00 0.00 0.00 0.00 23.12 20.65 1nqt s ALA 341 CO 0.06 0.39 1.18 1.63 0.00 0.00 0.00 175.76 179.02 1nqt n LYS 342 N 1.38 0.37 -3.69 0.00 4.76 -0.83 -4.84 118.16 115.30 1nqt n LYS 342 Ca -0.08 -0.27 -0.18 0.00 -2.87 0.00 0.00 58.31 54.91 1nqt n LYS 342 Cb 0.51 -1.49 -0.17 0.00 -1.84 0.00 0.00 35.03 32.03 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 -2.82 -0.13 -0.38 -0.18 1.01 -0.70 -2.63 121.20 115.37 1nqt s ILE 343 Ca 0.13 0.36 -0.01 0.00 0.00 0.00 0.00 60.65 61.14 1nqt s ILE 343 Cb 0.17 -0.18 0.10 0.00 0.01 0.00 0.00 42.46 42.57 1nqt s ILE 343 CO 0.71 0.15 0.15 -0.63 0.00 0.00 0.00 174.94 175.32 1nqt s ILE 344 N 1.96 3.03 -0.62 2.92 1.01 -0.20 -0.06 121.20 129.25 1nqt s ILE 344 Ca 0.01 -2.05 -0.21 0.00 0.00 0.00 0.00 60.65 58.40 1nqt s ILE 344 Cb -0.12 -3.07 0.08 0.00 0.01 0.00 0.00 42.46 39.35 1nqt s ILE 344 CO -0.04 -0.61 0.85 0.00 0.00 0.00 0.00 174.94 175.14 1nqt s ALA 345 N 1.10 3.24 -0.69 9.38 0.00 -0.98 -0.66 121.76 133.15 1nqt s ALA 345 Ca 0.07 -1.93 -0.28 0.00 0.00 0.00 0.00 51.96 49.83 1nqt s ALA 345 Cb -0.22 -3.70 -0.27 0.00 0.00 0.00 0.00 23.12 18.93 1nqt s ALA 345 CO -0.05 -2.55 1.90 0.39 0.00 0.00 0.00 175.76 175.46 1nqt n GLU 346 N 7.11 0.30 0.00 0.00 1.02 -0.17 -3.42 120.64 125.48 1nqt n GLU 346 Ca -0.06 -1.54 0.00 0.00 -0.02 0.00 0.00 57.16 55.54 1nqt n GLU 346 Cb 0.44 -3.35 0.00 0.00 -0.02 0.00 0.00 31.44 28.51 1nqt n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nqt n GLY 347 N 5.59 0.86 3.80 0.62 0.00 -0.14 -4.20 105.19 111.72 1nqt n GLY 347 Ca 0.44 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.38 1nqt n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 348 N -0.28 -0.84 -0.27 4.61 0.00 -1.10 -4.39 121.76 119.49 1nqt s ALA 348 Ca 0.00 -0.61 -0.20 0.00 0.00 0.00 0.00 51.96 51.15 1nqt s ALA 348 Cb 0.00 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 1nqt s ALA 348 CO 0.00 -0.99 0.61 -0.80 0.00 0.00 0.00 175.76 174.58 1nqt s ASN 349 N -3.01 6.54 -0.92 0.00 0.02 -1.26 -4.36 114.94 111.94 1nqt s ASN 349 Ca 0.15 0.62 0.00 0.00 -1.02 0.00 0.00 52.86 52.60 1nqt s ASN 349 Cb -0.05 -2.33 0.00 0.00 0.02 0.00 0.00 41.25 38.89 1nqt s ASN 349 CO 0.10 -0.38 0.00 0.61 0.02 0.00 0.00 177.10 177.45 1nqt n GLY 350 N 4.26 0.79 0.00 0.66 0.00 -1.26 -4.74 105.19 104.89 1nqt n GLY 350 Ca -0.01 -0.59 0.01 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.50 0.41 -4.24 1.61 -0.04 -1.26 -2.71 135.00 126.26 1nqt n PRO 351 Ca -0.10 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.18 1nqt n PRO 351 Cb 0.38 -1.10 -0.15 0.00 -0.04 0.00 0.00 33.50 32.59 1nqt n PRO 351 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1nqt s THR 352 N -2.00 0.56 0.67 0.52 -1.32 -1.26 -1.46 115.64 111.34 1nqt s THR 352 Ca 0.04 -0.25 -0.09 0.00 -1.21 0.00 0.00 61.69 60.18 1nqt s THR 352 Cb 0.02 -0.51 0.02 0.00 -1.51 0.00 0.00 72.50 70.52 1nqt s THR 352 CO 0.03 0.18 1.02 0.42 -2.21 0.00 0.00 174.62 174.06 1nqt s THR 353 N 0.18 3.36 0.08 5.08 -4.23 -1.18 -4.91 115.64 114.02 1nqt s THR 353 Ca -0.02 0.21 0.33 0.00 -1.18 0.00 0.00 61.69 61.03 1nqt s THR 353 Cb -0.07 -3.40 0.37 0.00 1.34 0.00 0.00 72.50 70.74 1nqt s THR 353 CO -0.00 -0.48 1.99 -0.65 -0.54 0.00 0.00 174.62 174.94 1nqt h PRO 354 N -0.49 0.00 0.05 3.99 0.11 -1.98 -1.53 132.00 132.14 1nqt h PRO 354 Ca -0.45 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 1nqt h PRO 354 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1nqt h PRO 354 CO 0.63 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 179.32 1nqt h GLU 355 N 0.00 -0.06 -0.64 1.05 4.39 -1.93 -3.20 114.58 114.19 1nqt h GLU 355 Ca 0.00 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.83 1nqt h GLU 355 Cb 0.38 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 28.93 1nqt h GLU 355 CO 0.00 0.43 -0.13 0.00 -1.16 0.00 0.00 179.01 178.15 1nqt h ALA 356 N -0.45 0.46 -0.36 3.43 0.00 -1.68 -1.42 119.26 119.24 1nqt h ALA 356 Ca -0.01 0.24 0.06 0.00 0.00 0.00 0.00 54.91 55.21 1nqt h ALA 356 Cb 0.52 0.46 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 1nqt h ALA 356 CO 0.01 -0.42 -0.44 -0.44 0.00 0.00 0.00 179.25 177.95 1nqt h ASP 357 N 0.02 -1.46 -1.00 0.00 3.32 -1.38 -0.25 116.42 115.66 1nqt h ASP 357 Ca 0.31 0.21 0.22 0.00 0.02 0.00 0.00 57.03 57.80 1nqt h ASP 357 Cb 0.49 0.63 -0.10 0.00 0.22 0.00 0.00 39.33 40.56 1nqt h ASP 357 CO -0.64 -0.38 0.62 0.11 -1.72 0.00 0.00 179.24 177.23 1nqt h LYS 358 N -0.36 0.57 0.19 3.56 1.57 -1.26 -0.52 116.57 120.33 1nqt h LYS 358 Ca 0.12 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1nqt h LYS 358 Cb 0.59 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1nqt h LYS 358 CO -0.55 0.38 -0.09 0.82 -0.57 0.00 0.00 179.45 179.44 1nqt h ILE 359 N 0.59 0.00 -1.40 1.86 5.03 -0.89 -2.45 117.51 120.25 1nqt h ILE 359 Ca 0.59 -0.12 0.44 0.00 -0.12 0.00 0.00 64.86 65.65 1nqt h ILE 359 Cb 1.16 0.00 -0.11 0.00 -3.03 0.00 0.00 36.82 34.83 1nqt h ILE 359 CO -0.36 0.00 0.93 -0.26 -0.68 0.00 0.00 178.15 177.78 1nqt h PHE 360 N -0.38 0.42 -0.17 1.37 0.04 -0.69 1.00 116.94 118.52 1nqt h PHE 360 Ca -0.03 0.02 -0.19 0.00 2.80 0.00 0.00 57.97 60.57 1nqt h PHE 360 Cb 0.20 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1nqt h PHE 360 CO 0.10 -0.15 -0.66 -0.07 -0.60 0.00 0.00 178.31 176.92 1nqt h LEU 361 N 0.08 0.76 -0.46 1.54 4.07 -1.09 0.54 115.31 120.73 1nqt h LEU 361 Ca 0.81 -0.45 -0.01 0.00 0.08 0.00 0.00 57.88 58.31 1nqt h LEU 361 Cb 2.70 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 44.19 1nqt h LEU 361 CO -0.33 1.21 0.26 -0.33 -1.08 0.00 0.00 178.44 178.17 1nqt h GLU 362 N 0.48 0.65 -2.08 1.13 5.08 0.15 -3.00 114.58 116.98 1nqt h GLU 362 Ca -0.02 -0.07 -0.76 0.00 -1.00 0.00 0.00 59.36 57.51 1nqt h GLU 362 Cb 1.25 -0.13 -0.29 0.00 0.50 0.00 0.00 28.75 30.08 1nqt h GLU 362 CO 0.13 0.51 0.79 2.89 -1.00 0.00 0.00 179.01 182.33 1nqt n ARG 363 N -4.68 3.89 -0.14 2.33 1.85 -0.71 -4.98 116.66 114.22 1nqt n ARG 363 Ca 0.01 -4.14 0.00 0.00 -1.00 0.00 0.00 57.85 52.72 1nqt n ARG 363 Cb 0.08 -2.34 0.00 0.00 -1.05 0.00 0.00 32.46 29.15 1nqt n ARG 363 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1nqt n ASN 364 N -0.33 0.00 -3.41 2.89 3.02 -1.14 -4.92 115.26 111.38 1nqt n ASN 364 Ca 0.48 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.87 1nqt n ASN 364 Cb 0.29 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.36 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 -0.42 -0.38 2.41 -1.09 0.17 -4.94 121.20 116.95 1nqt s ILE 365 Ca 0.00 -0.35 -0.28 0.00 -2.23 0.00 0.00 60.65 57.79 1nqt s ILE 365 Cb 0.00 -0.90 -0.01 0.00 -1.58 0.00 0.00 42.46 39.97 1nqt s ILE 365 CO 0.00 -0.36 1.71 -0.32 -1.23 0.00 0.00 174.94 174.73 1nqt s MET 366 N 2.38 3.33 -0.42 2.79 -2.45 -1.08 -4.52 119.30 119.33 1nqt s MET 366 Ca 0.09 1.22 -0.12 0.00 -1.25 0.00 0.00 55.69 55.63 1nqt s MET 366 Cb -0.14 -4.17 0.06 0.00 1.25 0.00 0.00 34.83 31.82 1nqt s MET 366 CO -0.26 -1.87 0.29 0.08 1.05 0.00 0.00 175.02 174.31 1nqt s VAL 367 N 6.73 4.70 -0.21 10.11 1.01 -1.25 -1.03 120.40 140.46 1nqt s VAL 367 Ca 0.74 -1.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1nqt s VAL 367 Cb -0.19 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1nqt s VAL 367 CO 0.32 -0.43 1.18 -0.63 0.00 0.00 0.00 175.10 175.54 1nqt s ILE 368 N 1.55 4.42 0.38 2.22 1.01 0.17 -4.11 121.20 126.84 1nqt s ILE 368 Ca 0.03 1.71 -0.25 0.00 0.00 0.00 0.00 60.65 62.13 1nqt s ILE 368 Cb -0.22 -4.14 -0.12 0.00 0.01 0.00 0.00 42.46 37.99 1nqt s ILE 368 CO 0.05 -0.20 0.99 -2.65 0.00 0.00 0.00 174.94 173.13 1nqt n PRO 369 N 6.58 1.32 -0.10 2.79 -0.02 -1.26 -1.00 135.00 143.32 1nqt n PRO 369 Ca 0.13 0.47 -0.12 0.00 -2.02 0.00 0.00 63.50 61.97 1nqt n PRO 369 Cb 0.45 -1.96 -0.04 0.00 -0.02 0.00 0.00 33.50 31.93 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 1.64 0.58 -1.12 2.55 -0.00 -1.79 0.35 116.42 118.63 1nqt h ASP 370 Ca -0.43 -0.38 0.41 0.00 -0.00 0.00 0.00 57.03 56.63 1nqt h ASP 370 Cb 1.34 -0.16 -0.14 0.00 -0.00 0.00 0.00 39.33 40.38 1nqt h ASP 370 CO 0.58 0.83 0.68 -0.11 -0.00 0.00 0.00 179.24 181.22 1nqt n LEU 371 N -4.47 0.23 -0.04 0.15 7.94 -1.26 -0.77 117.00 118.78 1nqt n LEU 371 Ca -0.03 1.32 -0.10 0.00 -1.11 0.00 0.00 56.01 56.09 1nqt n LEU 371 Cb 0.33 -0.65 -0.03 0.00 0.53 0.00 0.00 43.42 43.60 1nqt n LEU 371 CO 0.41 -1.45 -0.73 0.00 -1.11 0.00 0.00 177.39 174.51 1nqt n TYR 372 N -4.67 0.00 -0.33 1.96 4.19 -1.09 -4.43 117.16 112.79 1nqt n TYR 372 Ca 0.35 0.00 -0.03 0.00 3.31 0.00 0.00 57.90 61.53 1nqt n TYR 372 Cb 1.31 -0.36 0.09 0.00 0.49 0.00 0.00 39.34 40.88 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 -0.42 1.02 -0.21 2.98 5.85 -0.15 -2.22 115.31 122.16 1nqt h LEU 373 Ca -0.21 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.48 1nqt h LEU 373 Cb 1.02 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1nqt h LEU 373 CO -0.13 0.74 0.00 -3.20 -0.34 0.00 0.00 178.44 175.51 1nqt n ASN 374 N -4.47 0.48 0.00 1.25 5.15 0.05 -3.79 115.26 113.94 1nqt n ASN 374 Ca 0.10 0.58 0.00 0.00 -0.60 0.00 0.00 54.58 54.65 1nqt n ASN 374 Cb 0.02 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 38.57 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 -1.68 1.22 0.13 5.20 0.00 -0.84 -3.58 120.51 120.96 1nqt n ALA 375 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.35 1nqt n ALA 375 Cb 0.31 -0.81 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 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 0.00 -0.30 0.02 0.00 0.00 -1.76 -1.24 103.07 99.79 1nqt h GLY 376 Ca 0.00 0.11 0.18 0.00 0.00 0.00 0.00 47.33 47.62 1nqt h GLY 376 CO 0.00 -0.11 0.39 -1.33 0.00 0.00 0.00 176.54 175.49 1nqt h GLY 377 N -0.46 1.40 0.89 4.60 0.00 -1.55 -1.36 103.07 106.58 1nqt h GLY 377 Ca -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1nqt h GLY 377 CO 0.05 -0.15 -0.13 -2.08 0.00 0.00 0.00 176.54 174.23 1nqt h VAL 378 N 0.48 0.78 -0.53 4.60 2.07 -1.77 -1.07 116.25 120.81 1nqt h VAL 378 Ca 0.50 -0.23 0.11 0.00 0.82 0.00 0.00 66.70 67.89 1nqt h VAL 378 Cb 0.83 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.41 1nqt h VAL 378 CO -0.45 0.05 -0.13 0.74 0.02 0.00 0.00 177.57 177.80 1nqt h THR 379 N -0.47 0.47 -0.23 2.57 2.02 -0.16 -1.32 112.91 115.80 1nqt h THR 379 Ca -0.04 -0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 1nqt h THR 379 Cb 0.35 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1nqt h THR 379 CO 0.06 0.00 -0.14 0.58 0.37 0.00 0.00 175.52 176.38 1nqt h VAL 380 N 0.00 1.22 -0.55 3.16 2.07 -1.23 -2.46 116.25 118.46 1nqt h VAL 380 Ca 0.25 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1nqt h VAL 380 Cb 0.39 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1nqt h VAL 380 CO -0.54 0.31 0.33 0.77 0.02 0.00 0.00 177.57 178.46 1nqt h SER 381 N 0.35 0.66 -0.70 0.57 4.64 -0.08 0.12 113.55 119.11 1nqt h SER 381 Ca 0.07 -0.06 0.15 0.00 -0.47 0.00 0.00 61.79 61.48 1nqt h SER 381 Cb 0.47 -0.17 -0.12 0.00 -0.31 0.00 0.00 62.40 62.27 1nqt h SER 381 CO 0.03 0.52 -0.01 0.22 -0.87 0.00 0.00 176.83 176.72 1nqt h TYR 382 N 0.74 -0.07 -0.11 4.77 -0.00 -0.90 0.20 116.97 121.60 1nqt h TYR 382 Ca 0.20 0.05 -0.01 0.00 -0.00 0.00 0.00 58.73 58.97 1nqt h TYR 382 Cb -0.02 0.14 -0.00 0.00 -0.00 0.00 0.00 36.73 36.84 1nqt h TYR 382 CO -0.02 -0.21 0.04 0.74 -0.00 0.00 0.00 178.16 178.70 1nqt h PHE 383 N 0.10 0.17 -0.49 -3.82 0.05 -1.22 -1.23 116.94 110.51 1nqt h PHE 383 Ca 0.37 -0.02 0.09 0.00 3.82 0.00 0.00 57.97 62.23 1nqt h PHE 383 Cb 0.63 -0.05 -0.10 0.00 2.00 0.00 0.00 35.95 38.43 1nqt h PHE 383 CO -0.41 0.30 -0.35 1.49 -0.18 0.00 0.00 178.31 179.16 1nqt h GLU 384 N -0.01 -0.22 -0.26 1.51 4.81 0.18 0.56 114.58 121.17 1nqt h GLU 384 Ca 0.04 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1nqt h GLU 384 Cb 0.21 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 1nqt h GLU 384 CO -0.00 -0.15 -0.23 2.35 -0.73 0.00 0.00 179.01 180.25 1nqt h TRP 385 N -0.23 -0.72 -0.61 0.92 7.01 -0.21 0.21 115.95 122.33 1nqt h TRP 385 Ca 0.19 0.04 0.12 0.00 2.11 0.00 0.00 58.89 61.35 1nqt h TRP 385 Cb 0.55 0.35 -0.12 0.00 -2.10 0.00 0.00 29.16 27.84 1nqt h TRP 385 CO -0.60 -0.18 -0.22 -0.07 -2.79 0.00 0.00 178.44 174.58 1nqt h LEU 386 N -0.10 -0.79 -0.84 0.65 3.38 -0.53 0.33 115.31 117.41 1nqt h LEU 386 Ca 0.04 0.20 0.13 0.00 0.09 0.00 0.00 57.88 58.34 1nqt h LEU 386 Cb 0.21 0.46 -0.14 0.00 0.09 0.00 0.00 40.66 41.28 1nqt h LEU 386 CO -0.29 -0.25 -0.41 0.50 0.09 0.00 0.00 178.44 178.08 1nqt h LYS 387 N -0.07 -0.07 -0.57 1.13 3.64 0.22 0.99 116.57 121.83 1nqt h LYS 387 Ca 0.28 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.68 1nqt h LYS 387 Cb 0.50 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 1nqt h LYS 387 CO -0.66 -0.05 0.38 -0.91 -2.27 0.00 0.00 179.45 175.94 1nqt h ASN 388 N -0.07 0.62 0.25 4.20 2.35 -0.16 -1.44 115.58 121.33 1nqt h ASN 388 Ca 0.28 -0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 55.85 1nqt h ASN 388 Cb 0.56 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1nqt h ASN 388 CO -0.87 0.44 -0.64 -0.07 -1.65 0.00 0.00 177.43 174.65 1nqt h LEU 389 N 0.73 0.42 -0.89 1.61 3.38 0.17 -3.18 115.31 117.56 1nqt h LEU 389 Ca 0.22 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1nqt h LEU 389 Cb -0.02 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1nqt h LEU 389 CO -0.05 0.95 -0.08 0.78 0.09 0.00 0.00 178.44 180.13 1nqt h ASN 390 N 0.27 0.00 -3.28 -0.43 -0.26 0.56 -3.48 115.58 108.96 1nqt h ASN 390 Ca -0.01 0.00 -0.32 0.00 -0.56 0.00 0.00 56.30 55.41 1nqt h ASN 390 Cb 1.18 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.41 1nqt h ASN 390 CO 0.11 0.08 -0.40 1.41 -1.06 0.00 0.00 177.43 177.56 1nqt n HIS 391 N -3.16 -1.15 -3.60 1.19 8.25 -0.63 -4.95 115.22 111.16 1nqt n HIS 391 Ca 0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.33 1nqt n HIS 391 Cb 0.42 -3.25 -0.06 0.00 1.12 0.00 0.00 29.99 28.22 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 -2.76 0.03 0.32 1.59 1.01 -1.25 -5.10 120.40 114.25 1nqt s VAL 392 Ca 0.00 -0.25 -0.27 0.00 0.00 0.00 0.00 61.98 61.46 1nqt s VAL 392 Cb 0.00 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.36 1nqt s VAL 392 CO 0.00 -0.14 1.06 -0.94 0.00 0.00 0.00 175.10 175.08 1nqt s SER 393 N -1.74 7.12 -0.11 3.32 1.04 -1.26 -4.87 113.70 117.21 1nqt s SER 393 Ca -0.07 2.13 -0.29 0.00 0.48 0.00 0.00 55.95 58.20 1nqt s SER 393 Cb -0.01 -2.61 -0.07 0.00 0.10 0.00 0.00 66.02 63.43 1nqt s SER 393 CO 0.01 -0.23 2.11 -0.31 0.98 0.00 0.00 173.24 175.79 1nqt s TYR 394 N -1.37 1.22 0.00 5.02 1.51 -1.26 -1.72 117.35 120.75 1nqt s TYR 394 Ca 0.49 0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.64 1nqt s TYR 394 Cb -0.27 -4.07 0.00 0.00 -0.11 0.00 0.00 41.96 37.51 1nqt s TYR 394 CO 0.34 -4.75 0.00 0.41 -1.11 0.00 0.00 175.55 170.44 1nqt n GLY 395 N 5.22 2.60 0.00 0.71 0.00 -1.26 -4.02 105.19 108.44 1nqt n GLY 395 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.90 0.00 -0.19 1.61 0.63 -0.70 -0.53 116.66 115.58 1nqt n ARG 396 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1nqt n ARG 396 Cb 0.00 -1.36 0.00 0.00 0.45 0.00 0.00 32.46 31.55 1nqt n ARG 396 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1nqt n LEU 397 N -0.75 0.00 0.00 6.15 7.94 -1.26 -4.94 117.00 124.13 1nqt n LEU 397 Ca 0.00 -0.40 0.00 0.00 -1.11 0.00 0.00 56.01 54.50 1nqt n LEU 397 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1nqt n LEU 397 CO 0.00 0.15 0.00 1.07 -1.11 0.00 0.00 177.39 177.50 1nqt n THR 398 N 0.00 0.00 0.00 1.96 5.66 0.31 -4.84 114.28 117.37 1nqt n THR 398 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1nqt n THR 398 Cb 0.57 -0.56 0.00 0.00 -1.55 0.00 0.00 70.33 68.79 1nqt n THR 398 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1nqt n PHE 399 N -1.87 0.00 -0.13 1.09 0.99 -0.97 0.24 117.46 116.81 1nqt n PHE 399 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.35 1nqt n PHE 399 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 38.47 1nqt n PHE 399 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1nqt h LYS 400 N 0.00 0.61 -0.84 -1.08 1.63 -1.91 0.03 116.57 115.01 1nqt h LYS 400 Ca 0.00 -0.14 0.05 0.00 -0.85 0.00 0.00 60.65 59.71 1nqt h LYS 400 Cb 0.00 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 31.49 1nqt h LYS 400 CO 0.00 0.64 0.52 -0.92 -3.45 0.00 0.00 179.45 176.24 1nqt h TYR 401 N 0.47 0.97 -0.26 1.91 3.20 0.27 -0.77 116.97 122.76 1nqt h TYR 401 Ca 0.12 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.85 1nqt h TYR 401 Cb 0.30 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1nqt h TYR 401 CO 0.02 0.51 -0.48 1.49 -1.64 0.00 0.00 178.16 178.06 1nqt h GLU 402 N 0.97 0.77 0.26 1.82 4.81 -1.51 -1.04 114.58 120.66 1nqt h GLU 402 Ca 0.36 -0.49 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1nqt h GLU 402 Cb 0.12 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 1nqt h GLU 402 CO -0.16 1.12 -0.46 -0.09 -0.73 0.00 0.00 179.01 178.69 1nqt h ARG 403 N 0.52 -0.76 -0.11 1.92 2.43 -0.22 -0.02 114.38 118.15 1nqt h ARG 403 Ca 0.01 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1nqt h ARG 403 Cb 1.08 0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.77 1nqt h ARG 403 CO 0.11 -0.51 -0.29 -0.44 -1.51 0.00 0.00 179.97 177.33 1nqt h ASP 404 N -0.79 -0.92 -1.54 -3.80 3.45 -1.13 0.12 116.42 111.81 1nqt h ASP 404 Ca -0.01 0.11 0.48 0.00 0.43 0.00 0.00 57.03 58.04 1nqt h ASP 404 Cb 0.75 0.36 -0.11 0.00 -0.56 0.00 0.00 39.33 39.78 1nqt h ASP 404 CO -0.18 -0.24 1.05 -1.28 -1.57 0.00 0.00 179.24 177.02 1nqt h SER 405 N -0.28 0.14 0.48 6.45 0.87 -0.97 0.82 113.55 121.07 1nqt h SER 405 Ca 0.02 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1nqt h SER 405 Cb 0.34 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1nqt h SER 405 CO -0.25 -0.12 -0.23 0.78 -0.53 0.00 0.00 176.83 176.48 1nqt h ASN 406 N 0.04 -0.55 -0.79 6.23 -0.26 0.12 -2.78 115.58 117.59 1nqt h ASN 406 Ca 0.85 0.02 0.19 0.00 -0.56 0.00 0.00 56.30 56.80 1nqt h ASN 406 Cb 2.99 0.14 -0.12 0.00 -1.06 0.00 0.00 38.32 40.27 1nqt h ASN 406 CO -0.26 -0.22 0.18 1.88 -1.06 0.00 0.00 177.43 177.95 1nqt h TYR 407 N -0.98 0.27 -0.11 1.19 0.05 -0.29 0.95 116.97 118.04 1nqt h TYR 407 Ca -0.07 0.05 0.03 0.00 0.05 0.00 0.00 58.73 58.79 1nqt h TYR 407 Cb 0.50 0.01 -0.00 0.00 1.01 0.00 0.00 36.73 38.24 1nqt h TYR 407 CO 0.03 -0.15 0.11 0.45 -1.05 0.00 0.00 178.16 177.55 1nqt h HIS 408 N 0.23 0.00 0.27 4.88 3.86 -1.03 0.36 115.15 123.73 1nqt h HIS 408 Ca 0.47 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.66 1nqt h HIS 408 Cb 0.85 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.33 1nqt h HIS 408 CO -0.28 0.00 -0.13 -0.07 0.86 0.00 0.00 177.93 178.31 1nqt h LEU 409 N 0.00 -0.31 -0.78 2.43 -0.00 0.12 -2.92 115.31 113.85 1nqt h LEU 409 Ca 0.05 -0.04 0.09 0.00 -0.00 0.00 0.00 57.88 57.99 1nqt h LEU 409 Cb 0.26 0.08 -0.07 0.00 -0.00 0.00 0.00 40.66 40.93 1nqt h LEU 409 CO -0.00 0.16 0.42 -0.07 -0.00 0.00 0.00 178.44 178.95 1nqt h LEU 410 N -1.08 0.59 -0.00 1.67 3.38 -0.83 -1.85 115.31 117.19 1nqt h LEU 410 Ca -0.04 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1nqt h LEU 410 Cb 0.33 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1nqt h LEU 410 CO 0.06 0.33 -0.34 0.24 0.09 0.00 0.00 178.44 178.82 1nqt h MET 411 N 0.71 -0.48 -0.24 1.13 2.86 -0.37 -0.81 114.93 117.75 1nqt h MET 411 Ca 0.38 0.03 0.03 0.00 -2.06 0.00 0.00 59.70 58.08 1nqt h MET 411 Cb 0.37 0.11 -0.05 0.00 0.06 0.00 0.00 31.60 32.08 1nqt h MET 411 CO -0.26 -0.32 -0.39 0.77 1.06 0.00 0.00 176.91 177.78 1nqt h SER 412 N -0.49 -1.29 -0.99 1.22 0.02 -1.20 0.31 113.55 111.13 1nqt h SER 412 Ca 0.06 0.16 0.35 0.00 -0.84 0.00 0.00 61.79 61.52 1nqt h SER 412 Cb 0.58 0.52 -0.16 0.00 0.14 0.00 0.00 62.40 63.48 1nqt h SER 412 CO -0.28 -0.30 0.46 0.58 -1.14 0.00 0.00 176.83 176.16 1nqt h VAL 413 N -0.31 0.15 0.00 2.27 2.07 -0.94 0.38 116.25 119.87 1nqt h VAL 413 Ca 0.04 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 413 Cb 0.43 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1nqt h VAL 413 CO -0.39 0.03 0.00 1.67 0.02 0.00 0.00 177.57 178.90 1nqt n GLN 414 N -5.20 0.00 -0.35 1.57 7.27 0.69 -1.84 117.38 119.52 1nqt n GLN 414 Ca 0.32 0.43 0.01 0.00 0.07 0.00 0.00 57.00 57.83 1nqt n GLN 414 Cb 1.05 -1.27 0.06 0.00 2.41 0.00 0.00 30.24 32.49 1nqt n GLN 414 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1nqt n GLU 415 N -1.78 -0.18 0.27 3.69 2.13 0.74 0.10 120.64 125.61 1nqt n GLU 415 Ca 0.00 1.44 0.13 0.00 0.66 0.00 0.00 57.16 59.39 1nqt n GLU 415 Cb 0.00 -2.14 0.75 0.00 0.27 0.00 0.00 31.44 30.32 1nqt n GLU 415 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1nqt h SER 416 N 0.00 0.00 0.00 4.31 0.02 -0.36 -1.07 113.55 116.45 1nqt h SER 416 Ca 0.36 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 1nqt h SER 416 Cb 0.59 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1nqt h SER 416 CO -0.94 0.10 -0.09 0.25 -1.14 0.00 0.00 176.83 175.01 1nqt h LEU 417 N 0.00 0.00 -0.99 5.07 5.85 0.15 -3.28 115.31 122.11 1nqt h LEU 417 Ca -0.00 -0.63 0.30 0.00 0.84 0.00 0.00 57.88 58.40 1nqt h LEU 417 Cb 0.27 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.15 1nqt h LEU 417 CO 0.01 0.87 0.54 -0.33 -0.34 0.00 0.00 178.44 179.19 1nqt h GLU 418 N -1.00 0.34 -0.00 1.25 5.08 -0.20 0.34 114.58 120.39 1nqt h GLU 418 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1nqt h GLU 418 Cb 0.69 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1nqt h GLU 418 CO -0.01 0.22 0.00 0.54 -1.00 0.00 0.00 179.01 178.76 1nqt n ARG 419 N -5.04 0.01 -3.15 2.33 1.74 -0.44 -0.72 116.66 111.39 1nqt n ARG 419 Ca 0.30 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 57.18 1nqt n ARG 419 Cb 0.93 -1.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.33 1nqt n ARG 419 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1nqt n LYS 420 N -0.47 1.42 0.00 5.56 5.02 0.12 -4.99 118.16 124.82 1nqt n LYS 420 Ca 0.00 -3.68 0.00 0.00 -2.02 0.00 0.00 58.31 52.61 1nqt n LYS 420 Cb 0.00 -1.77 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 1nqt n LYS 420 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1nqt n PHE 421 N 0.31 0.00 -0.78 2.13 -0.00 0.10 -5.03 117.46 114.19 1nqt n PHE 421 Ca 0.26 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.60 1nqt n PHE 421 Cb 0.59 0.00 0.01 0.00 -0.00 0.00 0.00 39.48 40.08 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 -0.81 3.49 3.76 7.13 0.00 -1.26 -4.88 105.19 112.62 1nqt n GLY 422 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.05 2.18 -0.07 1.61 2.47 -1.26 -5.08 119.74 118.54 1nqt s LYS 423 Ca 0.23 -2.07 0.21 0.00 -1.56 0.00 0.00 55.97 52.78 1nqt s LYS 423 Cb 0.16 -1.83 0.43 0.00 -1.46 0.00 0.00 37.83 35.13 1nqt s LYS 423 CO -0.01 -0.27 1.18 0.72 0.16 0.00 0.00 175.35 177.13 1nqt n HIS 424 N -1.31 0.04 0.00 4.03 8.25 -1.26 -4.78 115.22 120.20 1nqt n HIS 424 Ca -0.07 -0.85 0.00 0.00 -0.26 0.00 0.00 57.72 56.54 1nqt n HIS 424 Cb 0.66 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1nqt n HIS 424 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nqt n GLY 425 N -0.03 0.00 0.00 -1.41 0.00 -1.26 -5.08 105.19 97.41 1nqt n GLY 425 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.89 3.76 -0.02 0.00 -1.26 -4.72 105.19 100.06 1nqt n GLY 426 Ca 0.00 0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.82 2.87 -0.52 2.61 2.01 -1.26 -5.01 115.64 115.52 1nqt s THR 427 Ca 0.00 0.81 0.05 0.00 0.31 0.00 0.00 61.69 62.86 1nqt s THR 427 Cb 0.00 -3.51 0.37 0.00 0.01 0.00 0.00 72.50 69.37 1nqt s THR 427 CO 0.00 0.16 1.01 2.30 -0.69 0.00 0.00 174.62 177.41 1nqt n ILE 428 N 1.56 2.76 0.27 1.82 -0.00 -1.26 -4.85 119.36 119.67 1nqt n ILE 428 Ca 0.03 -5.31 0.13 0.00 -0.00 0.00 0.00 62.75 57.60 1nqt n ILE 428 Cb 0.42 -1.33 0.77 0.00 -0.00 0.00 0.00 39.64 39.50 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 2.82 0.00 0.00 6.28 0.11 -1.92 -3.15 132.00 136.14 1nqt h PRO 429 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1nqt h PRO 429 Cb 0.68 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1nqt h PRO 429 CO 0.83 0.10 0.00 0.44 -0.21 0.00 0.00 178.00 179.15 1nqt n ILE 430 N -3.66 0.00 -4.03 4.15 -5.35 -1.26 -4.38 119.36 104.84 1nqt n ILE 430 Ca -0.02 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.12 1nqt n ILE 430 Cb 0.21 -0.61 -0.15 0.00 -1.74 0.00 0.00 39.64 37.35 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 2.56 0.23 7.28 0.11 -1.19 -4.89 120.40 123.43 1nqt s VAL 431 Ca 0.00 -0.95 -0.30 0.00 -2.93 0.00 0.00 61.98 57.80 1nqt s VAL 431 Cb 0.00 -2.21 -0.09 0.00 -1.53 0.00 0.00 36.38 32.56 1nqt s VAL 431 CO 0.00 0.36 1.21 -2.84 -3.33 0.00 0.00 175.10 170.50 1nqt s PRO 432 N 1.32 4.49 0.63 1.54 0.02 -1.26 -5.00 135.00 136.74 1nqt s PRO 432 Ca 0.02 1.94 -0.18 0.00 0.02 0.00 0.00 61.00 62.80 1nqt s PRO 432 Cb -0.15 -3.20 -0.13 0.00 0.02 0.00 0.00 34.50 31.05 1nqt s PRO 432 CO -0.08 -0.06 -0.07 0.25 -0.33 0.00 0.00 177.00 176.72 1nqt n THR 433 N 1.95 0.53 -0.31 0.99 -2.24 -1.26 -4.43 114.28 109.51 1nqt n THR 433 Ca 0.03 -0.48 0.02 0.00 -2.27 0.00 0.00 64.05 61.35 1nqt n THR 433 Cb 0.44 -0.19 0.21 0.00 -2.10 0.00 0.00 70.33 68.69 1nqt n THR 433 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nqt h ALA 434 N -0.21 1.46 0.21 6.98 0.00 -1.99 -0.01 119.26 125.70 1nqt h ALA 434 Ca -0.43 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1nqt h ALA 434 Cb 1.40 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1nqt h ALA 434 CO 0.39 0.43 -0.10 0.93 0.00 0.00 0.00 179.25 180.90 1nqt h GLU 435 N 1.10 -0.28 -0.37 0.00 3.07 -1.99 0.69 114.58 116.80 1nqt h GLU 435 Ca 0.37 0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.29 1nqt h GLU 435 Cb 0.09 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1nqt h GLU 435 CO -0.12 -0.11 0.25 0.35 -1.40 0.00 0.00 179.01 177.97 1nqt h PHE 436 N -0.39 0.33 -0.13 4.33 -0.00 -1.67 0.12 116.94 119.53 1nqt h PHE 436 Ca -0.03 0.01 -0.19 0.00 -0.00 0.00 0.00 57.97 57.76 1nqt h PHE 436 Cb 0.30 -0.11 -0.00 0.00 -0.00 0.00 0.00 35.95 36.14 1nqt h PHE 436 CO -0.03 0.19 -0.70 0.37 -0.00 0.00 0.00 178.31 178.14 1nqt h GLN 437 N 0.34 0.57 0.12 1.11 5.75 -0.55 -0.44 115.11 122.01 1nqt h GLN 437 Ca 0.16 -0.44 -0.00 0.00 -0.15 0.00 0.00 58.65 58.21 1nqt h GLN 437 Cb 0.20 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.83 1nqt h GLN 437 CO -0.03 1.06 -0.08 -0.44 -2.65 0.00 0.00 178.83 176.69 1nqt h ASP 438 N 0.40 -0.20 -0.94 -0.69 3.45 0.12 -1.04 116.42 117.52 1nqt h ASP 438 Ca -0.03 0.01 0.26 0.00 0.43 0.00 0.00 57.03 57.70 1nqt h ASP 438 Cb 1.29 0.06 -0.17 0.00 -0.56 0.00 0.00 39.33 39.95 1nqt h ASP 438 CO 0.13 -0.12 0.09 -0.09 -1.57 0.00 0.00 179.24 177.68 1nqt h ARG 439 N -0.18 0.06 -0.37 3.56 2.43 -0.85 0.37 114.38 119.40 1nqt h ARG 439 Ca -0.02 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 1nqt h ARG 439 Cb 0.15 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1nqt h ARG 439 CO 0.01 0.04 -0.19 0.82 -1.51 0.00 0.00 179.97 179.14 1nqt h ILE 440 N 0.06 1.26 -0.08 1.20 2.04 -0.98 -2.54 117.51 118.47 1nqt h ILE 440 Ca 0.58 -1.24 -0.12 0.00 1.00 0.00 0.00 64.86 65.07 1nqt h ILE 440 Cb 1.19 1.18 0.01 0.00 -0.74 0.00 0.00 36.82 38.46 1nqt h ILE 440 CO -0.83 0.41 -0.42 0.28 0.00 0.00 0.00 178.15 177.60 1nqt h SER 441 N 0.61 0.50 -1.73 1.72 0.02 0.39 -3.35 113.55 111.72 1nqt h SER 441 Ca 0.09 -0.66 -0.69 0.00 -0.84 0.00 0.00 61.79 59.70 1nqt h SER 441 Cb 0.65 -0.15 -0.33 0.00 0.14 0.00 0.00 62.40 62.71 1nqt h SER 441 CO 0.05 1.08 0.33 0.61 -1.14 0.00 0.00 176.83 177.75 1nqt n GLY 442 N 0.74 5.75 3.64 -3.77 0.00 -0.38 -4.98 105.19 106.19 1nqt n GLY 442 Ca -0.08 -2.59 -0.43 0.00 0.00 0.00 0.00 46.02 42.92 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 -3.85 3.53 0.27 4.61 0.00 -0.96 -4.91 121.76 120.45 1nqt s ALA 443 Ca 0.51 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.55 1nqt s ALA 443 Cb 0.43 -3.66 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 1nqt s ALA 443 CO -0.30 -1.41 0.12 -1.12 0.00 0.00 0.00 175.76 173.05 1nqt s SER 444 N 1.75 1.21 0.27 0.00 0.01 -1.26 -5.04 113.70 110.65 1nqt s SER 444 Ca 0.48 -1.45 0.01 0.00 1.31 0.00 0.00 55.95 56.30 1nqt s SER 444 Cb -0.14 0.26 0.60 0.00 0.21 0.00 0.00 66.02 66.96 1nqt s SER 444 CO 0.15 -0.80 1.75 -0.08 0.41 0.00 0.00 173.24 174.67 1nqt h GLU 445 N 2.35 0.57 -0.71 12.44 4.81 -1.95 -1.44 114.58 130.65 1nqt h GLU 445 Ca -0.36 -0.03 0.15 0.00 -0.13 0.00 0.00 59.36 58.99 1nqt h GLU 445 Cb 1.25 -0.13 -0.13 0.00 0.63 0.00 0.00 28.75 30.37 1nqt h GLU 445 CO 0.57 0.38 -0.04 1.57 -0.73 0.00 0.00 179.01 180.76 1nqt h LYS 446 N 0.59 0.08 -0.63 1.92 2.10 -1.90 -0.76 116.57 117.97 1nqt h LYS 446 Ca 0.50 -0.00 0.13 0.00 -2.00 0.00 0.00 60.65 59.28 1nqt h LYS 446 Cb 0.78 -0.02 -0.10 0.00 -0.90 0.00 0.00 32.23 31.99 1nqt h LYS 446 CO -0.40 0.05 0.04 -0.44 -2.00 0.00 0.00 179.45 176.70 1nqt h ASP 447 N 0.08 -0.20 -0.43 7.07 3.32 -1.60 0.37 116.42 125.03 1nqt h ASP 447 Ca 0.37 0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.48 1nqt h ASP 447 Cb 0.63 0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1nqt h ASP 447 CO -0.64 -0.09 -0.09 0.40 -1.72 0.00 0.00 179.24 177.10 1nqt h ILE 448 N 0.15 1.27 0.90 0.35 1.08 -1.27 -1.27 117.51 118.73 1nqt h ILE 448 Ca 0.33 -1.19 -0.04 0.00 -0.39 0.00 0.00 64.86 63.57 1nqt h ILE 448 Cb 0.54 1.16 0.01 0.00 -3.07 0.00 0.00 36.82 35.45 1nqt h ILE 448 CO -0.51 0.40 -0.43 0.58 -0.69 0.00 0.00 178.15 177.50 1nqt h VAL 449 N 0.65 0.01 -0.53 1.67 2.07 0.08 0.16 116.25 120.35 1nqt h VAL 449 Ca 0.11 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1nqt h VAL 449 Cb 0.62 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 1nqt h VAL 449 CO 0.04 0.00 -0.47 0.45 0.02 0.00 0.00 177.57 177.61 1nqt h HIS 450 N -1.32 -1.42 -0.30 1.57 3.86 -0.36 0.21 115.15 117.40 1nqt h HIS 450 Ca -0.12 0.08 0.06 0.00 -1.16 0.00 0.00 60.37 59.23 1nqt h HIS 450 Cb 0.93 0.69 -0.08 0.00 1.06 0.00 0.00 27.41 30.01 1nqt h HIS 450 CO -0.00 -0.44 -0.37 1.03 0.86 0.00 0.00 177.93 179.01 1nqt h SER 451 N -0.27 -1.21 -0.71 2.45 0.87 -1.13 0.24 113.55 113.79 1nqt h SER 451 Ca 0.15 0.19 0.15 0.00 -1.23 0.00 0.00 61.79 61.04 1nqt h SER 451 Cb 0.57 0.53 -0.10 0.00 -0.44 0.00 0.00 62.40 62.95 1nqt h SER 451 CO -0.66 -0.36 0.16 1.23 -0.53 0.00 0.00 176.83 176.67 1nqt h GLY 452 N -0.35 0.96 0.00 5.77 0.00 0.97 0.36 103.07 110.79 1nqt h GLY 452 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1nqt h GLY 452 CO -0.49 -0.18 0.00 -0.10 0.00 0.00 0.00 176.54 175.77 1nqt n LEU 453 N -5.15 0.00 -0.23 3.11 0.00 0.57 -1.14 117.00 114.15 1nqt n LEU 453 Ca 0.13 0.77 0.06 0.00 0.00 0.00 0.00 56.01 56.97 1nqt n LEU 453 Cb 0.43 -0.27 0.12 0.00 0.00 0.00 0.00 43.42 43.69 1nqt n LEU 453 CO 0.14 -0.27 0.46 0.00 0.00 0.00 0.00 177.39 177.71 1nqt n ALA 454 N -1.65 0.21 -0.04 1.96 0.00 0.32 0.22 120.51 121.53 1nqt n ALA 454 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 53.44 54.16 1nqt n ALA 454 Cb 0.00 -0.46 0.30 0.00 0.00 0.00 0.00 19.45 19.29 1nqt n ALA 454 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1nqt h TYR 455 N 0.00 0.63 -0.00 0.00 -0.00 -0.32 -2.11 116.97 115.17 1nqt h TYR 455 Ca 0.34 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.73 59.03 1nqt h TYR 455 Cb 0.58 -0.19 0.00 0.00 -0.00 0.00 0.00 36.73 37.12 1nqt h TYR 455 CO -0.46 0.53 -0.01 1.15 -0.00 0.00 0.00 178.16 179.37 1nqt h THR 456 N 0.61 1.49 -0.61 1.81 2.02 0.42 -2.40 112.91 116.25 1nqt h THR 456 Ca 0.14 -1.45 0.12 0.00 0.77 0.00 0.00 66.41 66.00 1nqt h THR 456 Cb 0.20 2.46 -0.11 0.00 -1.74 0.00 0.00 68.15 68.96 1nqt h THR 456 CO -0.01 0.38 -0.12 0.24 0.37 0.00 0.00 175.52 176.38 1nqt h MET 457 N -0.59 0.02 0.82 6.66 2.86 -1.10 0.30 114.93 123.89 1nqt h MET 457 Ca -0.00 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1nqt h MET 457 Cb 0.62 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.29 1nqt h MET 457 CO 0.00 0.01 -0.39 1.49 1.06 0.00 0.00 176.91 179.08 1nqt h GLU 458 N 0.02 -1.06 -0.72 1.72 4.81 -1.46 0.22 114.58 118.11 1nqt h GLU 458 Ca 0.30 0.07 0.20 0.00 -0.13 0.00 0.00 59.36 59.80 1nqt h GLU 458 Cb 0.46 0.24 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 1nqt h GLU 458 CO -0.61 -0.71 0.51 -0.09 -0.73 0.00 0.00 179.01 177.39 1nqt h ARG 459 N -1.16 0.07 -0.01 1.92 2.43 -1.12 0.18 114.38 116.69 1nqt h ARG 459 Ca -0.11 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.94 1nqt h ARG 459 Cb 0.84 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.38 1nqt h ARG 459 CO 0.18 0.05 -0.45 0.77 -1.51 0.00 0.00 179.97 179.01 1nqt h SER 460 N 0.07 0.41 -0.36 -3.80 0.02 -0.10 -2.83 113.55 106.96 1nqt h SER 460 Ca 0.35 -0.76 0.07 0.00 -0.84 0.00 0.00 61.79 60.61 1nqt h SER 460 Cb 1.28 -0.13 -0.07 0.00 0.14 0.00 0.00 62.40 63.63 1nqt h SER 460 CO -0.03 1.11 -0.08 0.00 -1.14 0.00 0.00 176.83 176.70 1nqt h ALA 461 N 0.31 0.26 -0.60 3.77 0.00 0.22 0.42 119.26 123.63 1nqt h ALA 461 Ca -0.05 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1nqt h ALA 461 Cb 1.18 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 19.18 1nqt h ALA 461 CO 0.09 -0.45 0.32 0.00 0.00 0.00 0.00 179.25 179.21 1nqt h ARG 462 N 0.02 0.58 -0.98 0.00 2.47 -1.08 -0.77 114.38 114.60 1nqt h ARG 462 Ca 0.18 -0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.90 1nqt h ARG 462 Cb 0.26 -0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 28.39 1nqt h ARG 462 CO -0.36 0.38 0.64 1.96 0.56 0.00 0.00 179.97 183.15 1nqt h GLN 463 N 0.60 1.19 0.15 0.04 4.20 -0.98 0.25 115.11 120.56 1nqt h GLN 463 Ca 0.27 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 1nqt h GLN 463 Cb 0.17 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1nqt h GLN 463 CO -0.18 0.79 -0.07 0.82 -0.67 0.00 0.00 178.83 179.51 1nqt h ILE 464 N 1.22 0.99 -0.54 2.54 2.04 -0.20 -1.57 117.51 121.99 1nqt h ILE 464 Ca 0.40 -0.85 0.09 0.00 1.00 0.00 0.00 64.86 65.50 1nqt h ILE 464 Cb 0.04 1.49 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 1nqt h ILE 464 CO -0.13 0.19 0.16 0.24 0.00 0.00 0.00 178.15 178.61 1nqt h MET 465 N -0.63 0.31 0.11 2.37 2.86 -0.94 -0.09 114.93 118.92 1nqt h MET 465 Ca -0.02 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1nqt h MET 465 Cb 0.47 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1nqt h MET 465 CO 0.03 0.20 -0.05 -0.09 1.06 0.00 0.00 176.91 178.07 1nqt h ARG 466 N 0.32 -0.14 0.00 1.72 2.43 -0.96 -1.05 114.38 116.70 1nqt h ARG 466 Ca 0.27 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 1nqt h ARG 466 Cb 0.34 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1nqt h ARG 466 CO -0.31 -0.09 0.00 2.41 -1.51 0.00 0.00 179.97 180.47 1nqt n THR 467 N -5.15 1.09 -0.03 0.20 -1.04 -0.59 -1.03 114.28 107.72 1nqt n THR 467 Ca -0.08 0.30 -0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1nqt n THR 467 Cb 0.09 -1.12 -0.00 0.00 -1.82 0.00 0.00 70.33 67.47 1nqt n THR 467 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nqt h ALA 468 N 2.37 -0.01 -1.34 2.41 0.00 0.02 -3.20 119.26 119.50 1nqt h ALA 468 Ca 0.00 -0.00 0.39 0.00 0.00 0.00 0.00 54.91 55.30 1nqt h ALA 468 Cb 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 1nqt h ALA 468 CO 0.00 -0.01 0.93 0.52 0.00 0.00 0.00 179.25 180.69 1nqt h MET 469 N -0.72 0.08 -0.01 0.00 2.07 -0.87 0.26 114.93 115.74 1nqt h MET 469 Ca -0.00 -0.01 -0.13 0.00 -2.07 0.00 0.00 59.70 57.49 1nqt h MET 469 Cb 0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 29.70 1nqt h MET 469 CO 0.00 0.06 -0.62 -0.22 1.07 0.00 0.00 176.91 177.20 1nqt h LYS 470 N 0.09 0.06 -0.70 1.72 3.64 -1.18 -2.98 116.57 117.21 1nqt h LYS 470 Ca 0.69 -0.04 -0.49 0.00 -1.27 0.00 0.00 60.65 59.54 1nqt h LYS 470 Cb 2.49 0.01 -0.33 0.00 -0.41 0.00 0.00 32.23 33.99 1nqt h LYS 470 CO -0.14 0.66 -0.35 0.66 -2.27 0.00 0.00 179.45 178.01 1nqt n TYR 471 N -3.82 2.47 -2.70 1.91 4.01 0.81 -4.98 117.16 114.86 1nqt n TYR 471 Ca -0.01 -2.26 -0.02 0.00 -0.16 0.00 0.00 57.90 55.44 1nqt n TYR 471 Cb 0.62 -0.59 -0.01 0.00 -0.31 0.00 0.00 39.34 39.06 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 -0.83 0.04 -4.93 7.72 4.13 -0.64 -4.87 115.26 115.87 1nqt n ASN 472 Ca 0.45 -0.08 -0.25 0.00 1.68 0.00 0.00 54.58 56.38 1nqt n ASN 472 Cb 0.90 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 39.05 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 -3.41 3.69 0.00 3.41 1.43 -0.99 -5.00 118.68 117.80 1nqt s LEU 473 Ca 0.00 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 1nqt s LEU 473 Cb -0.00 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.75 1nqt s LEU 473 CO 0.06 -0.60 0.00 0.61 0.23 0.00 0.00 176.35 176.65 1nqt n GLY 474 N -2.12 -0.15 0.51 -3.19 0.00 -1.26 -4.41 105.19 94.56 1nqt n GLY 474 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.43 1.49 -1.69 0.99 4.32 -1.26 -4.73 117.00 113.69 1nqt n LEU 475 Ca 0.00 -2.43 -0.12 0.00 -0.02 0.00 0.00 56.01 53.44 1nqt n LEU 475 Cb 0.00 -0.25 0.05 0.00 -1.62 0.00 0.00 43.42 41.59 1nqt n LEU 475 CO 0.00 0.66 1.04 -0.67 -1.22 0.00 0.00 177.39 177.20 1nqt n ASP 476 N -0.65 5.14 -0.06 -1.43 2.03 -1.26 -3.95 116.55 116.36 1nqt n ASP 476 Ca 0.10 -2.82 -0.02 0.00 0.52 0.00 0.00 54.79 52.58 1nqt n ASP 476 Cb 0.74 -0.91 -0.01 0.00 -0.72 0.00 0.00 41.12 40.22 1nqt n ASP 476 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1nqt n LEU 477 N 0.30 -0.15 0.00 -2.67 4.32 -1.26 -1.11 117.00 116.43 1nqt n LEU 477 Ca 0.24 0.35 0.00 0.00 -0.02 0.00 0.00 56.01 56.58 1nqt n LEU 477 Cb 0.71 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.43 1nqt n LEU 477 CO 0.28 -0.26 0.27 -1.14 -1.22 0.00 0.00 177.39 175.32 1nqt n ARG 478 N -3.52 0.00 0.28 3.23 0.63 -1.26 0.59 116.66 116.61 1nqt n ARG 478 Ca 0.00 0.54 0.18 0.00 -0.92 0.00 0.00 57.85 57.65 1nqt n ARG 478 Cb 0.04 -0.90 0.90 0.00 0.45 0.00 0.00 32.46 32.94 1nqt n ARG 478 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1nqt h THR 479 N 0.00 0.14 -0.34 5.15 1.35 -1.50 0.84 112.91 118.55 1nqt h THR 479 Ca 0.00 0.00 -0.12 0.00 -0.55 0.00 0.00 66.41 65.74 1nqt h THR 479 Cb 0.00 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.18 1nqt h THR 479 CO 0.00 0.00 -0.28 0.00 -0.25 0.00 0.00 175.52 174.99 1nqt h ALA 480 N 1.58 0.49 0.85 6.62 0.00 0.50 -1.38 119.26 127.91 1nqt h ALA 480 Ca 0.04 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1nqt h ALA 480 Cb 0.54 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1nqt h ALA 480 CO -0.00 0.50 -0.41 0.00 0.00 0.00 0.00 179.25 179.34 1nqt h ALA 481 N 0.75 -1.14 -0.92 0.00 0.00 0.26 0.65 119.26 118.85 1nqt h ALA 481 Ca 0.06 -0.25 0.22 0.00 0.00 0.00 0.00 54.91 54.94 1nqt h ALA 481 Cb 0.85 0.44 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 1nqt h ALA 481 CO 0.07 -1.06 0.61 1.88 0.00 0.00 0.00 179.25 180.75 1nqt h TYR 482 N -1.30 0.52 0.17 0.00 0.05 -1.30 0.78 116.97 115.88 1nqt h TYR 482 Ca -0.12 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.67 1nqt h TYR 482 Cb 0.87 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1nqt h TYR 482 CO 0.00 0.12 -0.08 0.28 -1.05 0.00 0.00 178.16 177.43 1nqt h VAL 483 N 0.38 0.95 -0.66 -2.88 2.07 -0.94 -1.19 116.25 113.98 1nqt h VAL 483 Ca 0.48 -0.62 0.13 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 483 Cb 1.25 1.32 -0.13 0.00 -1.52 0.00 0.00 31.29 32.22 1nqt h VAL 483 CO -0.18 0.14 -0.19 -1.13 0.02 0.00 0.00 177.57 176.24 1nqt h ASN 484 N -0.53 -0.69 0.00 0.57 -1.24 0.11 -0.54 115.58 113.26 1nqt h ASN 484 Ca -0.02 0.20 0.00 0.00 0.71 0.00 0.00 56.30 57.19 1nqt h ASN 484 Cb 0.41 0.44 0.00 0.00 0.73 0.00 0.00 38.32 39.89 1nqt h ASN 484 CO 0.04 -0.23 0.00 0.00 -1.29 0.00 0.00 177.43 175.94 1nqt n ALA 485 N -3.13 -0.40 -0.28 1.57 0.00 0.06 -2.09 120.51 116.25 1nqt n ALA 485 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.48 1nqt n ALA 485 Cb 0.35 0.08 -0.02 0.00 0.00 0.00 0.00 19.45 19.86 1nqt n ALA 485 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1nqt n ILE 486 N -2.11 -0.42 -0.23 0.00 2.08 -0.46 0.23 119.36 118.45 1nqt n ILE 486 Ca 0.00 1.66 0.03 0.00 0.56 0.00 0.00 62.75 65.00 1nqt n ILE 486 Cb 0.00 -2.11 0.15 0.00 -0.75 0.00 0.00 39.64 36.92 1nqt n ILE 486 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1nqt h GLU 487 N 0.00 0.23 0.40 0.38 4.81 -1.02 0.42 114.58 119.80 1nqt h GLU 487 Ca 0.17 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1nqt h GLU 487 Cb 0.35 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1nqt h GLU 487 CO -0.67 0.15 -0.19 0.87 -0.73 0.00 0.00 179.01 178.44 1nqt h LYS 488 N 0.24 -0.51 -1.21 1.92 1.57 0.35 -1.58 116.57 117.34 1nqt h LYS 488 Ca 0.37 0.03 0.35 0.00 -1.87 0.00 0.00 60.65 59.54 1nqt h LYS 488 Cb 0.61 0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 1nqt h LYS 488 CO -0.49 -0.34 1.10 0.28 -0.57 0.00 0.00 179.45 179.44 1nqt h VAL 489 N -0.63 0.12 0.07 0.50 2.07 -0.37 0.14 116.25 118.15 1nqt h VAL 489 Ca -0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1nqt h VAL 489 Cb 0.41 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1nqt h VAL 489 CO 0.09 0.00 -0.03 0.15 0.02 0.00 0.00 177.57 177.80 1nqt h PHE 490 N 0.00 -0.09 -0.85 1.57 3.57 0.17 -3.26 116.94 118.06 1nqt h PHE 490 Ca 0.57 -0.00 0.22 0.00 3.53 0.00 0.00 57.97 62.29 1nqt h PHE 490 Cb 2.77 0.03 -0.13 0.00 2.79 0.00 0.00 35.95 41.41 1nqt h PHE 490 CO 0.00 0.38 0.23 -0.22 -2.23 0.00 0.00 178.31 176.47 1nqt h LYS 491 N -0.96 0.23 0.16 1.11 3.64 0.04 0.81 116.57 121.60 1nqt h LYS 491 Ca -0.01 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1nqt h LYS 491 Cb 0.50 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1nqt h LYS 491 CO 0.02 0.15 -0.27 0.28 -2.27 0.00 0.00 179.45 177.36 1nqt h VAL 492 N 0.23 0.00 -0.01 2.00 2.07 -1.64 0.58 116.25 119.48 1nqt h VAL 492 Ca 0.52 0.00 0.02 0.00 0.82 0.00 0.00 66.70 68.07 1nqt h VAL 492 Cb 1.02 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 1nqt h VAL 492 CO -0.62 0.00 -0.53 1.88 0.02 0.00 0.00 177.57 178.32 1nqt h TYR 493 N -0.46 -1.54 -0.14 1.57 0.05 -1.11 -2.77 116.97 112.56 1nqt h TYR 493 Ca -0.02 0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.84 1nqt h TYR 493 Cb 0.43 0.67 -0.05 0.00 1.01 0.00 0.00 36.73 38.79 1nqt h TYR 493 CO -0.27 -0.57 -0.39 -0.97 -1.05 0.00 0.00 178.16 174.92 1nqt h ASN 494 N -0.66 -1.24 0.00 3.88 -0.00 0.70 0.79 115.58 119.05 1nqt h ASN 494 Ca 0.02 0.15 -0.02 0.00 -0.00 0.00 0.00 56.30 56.45 1nqt h ASN 494 Cb 0.72 0.49 -0.01 0.00 -0.00 0.00 0.00 38.32 39.52 1nqt h ASN 494 CO -0.36 -0.33 0.20 -0.62 -0.00 0.00 0.00 177.43 176.32 1nqt n GLU 495 N -4.58 0.28 0.02 6.67 1.02 0.20 -2.95 120.64 121.30 1nqt n GLU 495 Ca -0.04 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1nqt n GLU 495 Cb 0.26 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 2.50 0.00 0.00 0.62 0.00 -1.06 -4.96 120.51 117.61 1nqt n ALA 496 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1nqt n ALA 496 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 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 -1.41 0.53 2.00 0.00 0.00 0.25 -3.72 105.19 102.83 1nqt n GLY 497 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 -4.66 118.33 114.19 1nqt n VAL 498 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 1nqt n VAL 498 Cb 0.00 -0.33 -0.06 0.00 -1.47 0.00 0.00 33.84 31.98 1nqt n VAL 498 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1nqt n THR 499 N -3.18 0.76 -2.86 3.34 -1.04 -1.26 -4.37 114.28 105.67 1nqt n THR 499 Ca 0.00 -0.27 -0.40 0.00 -2.04 0.00 0.00 64.05 61.34 1nqt n THR 499 Cb 0.00 -1.13 0.00 0.00 -1.82 0.00 0.00 70.33 67.38 1nqt n THR 499 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1nqt n PHE 500 N -3.06 2.71 0.63 -1.42 0.99 -1.26 -5.27 117.46 110.78 1nqt n PHE 500 Ca -0.24 -2.79 0.08 0.00 -0.00 0.00 0.00 57.45 54.49 1nqt n PHE 500 Cb 0.74 -1.12 0.06 0.00 -1.00 0.00 0.00 39.48 38.16 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39