#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nqt s PRO 7 N 0.00 2.65 0.28 0.11 0.02 -1.26 -4.98 135.00 131.83 1nqt s PRO 7 Ca 0.00 2.01 -0.29 0.00 0.02 0.00 0.00 61.00 62.74 1nqt s PRO 7 Cb 0.00 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.56 1nqt s PRO 7 CO 0.00 -1.50 1.07 0.54 -0.33 0.00 0.00 177.00 176.78 1nqt s ASN 8 N -1.44 7.28 0.02 2.53 4.22 -1.26 -4.85 114.94 121.43 1nqt s ASN 8 Ca 0.81 2.21 -0.02 0.00 -2.14 0.00 0.00 52.86 53.72 1nqt s ASN 8 Cb -0.36 -2.62 0.01 0.00 1.28 0.00 0.00 41.25 39.56 1nqt s ASN 8 CO 0.38 -0.13 0.13 2.22 -2.04 0.00 0.00 177.10 177.66 1nqt n PHE 9 N 1.12 -0.02 -0.10 1.54 1.16 -1.26 -0.45 117.46 119.45 1nqt n PHE 9 Ca -0.01 0.10 -0.06 0.00 -1.87 0.00 0.00 57.45 55.62 1nqt n PHE 9 Cb 0.45 -0.52 0.00 0.00 -1.61 0.00 0.00 39.48 37.81 1nqt n PHE 9 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1nqt h PHE 10 N 0.00 -0.18 -0.33 2.97 3.57 -1.92 -0.31 116.94 120.74 1nqt h PHE 10 Ca 0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1nqt h PHE 10 Cb 0.04 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1nqt h PHE 10 CO -0.08 -0.15 0.05 0.87 -2.23 0.00 0.00 178.31 176.78 1nqt h LYS 11 N 0.00 0.49 0.77 1.11 1.79 -1.13 -0.61 116.57 119.00 1nqt h LYS 11 Ca 0.16 -0.09 -0.04 0.00 -2.18 0.00 0.00 60.65 58.51 1nqt h LYS 11 Cb 0.25 -0.08 0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1nqt h LYS 11 CO -0.35 0.48 -0.37 0.52 -1.08 0.00 0.00 179.45 178.65 1nqt h MET 12 N 0.48 -1.00 -0.65 3.15 2.86 -0.85 0.68 114.93 119.60 1nqt h MET 12 Ca 0.11 0.07 0.07 0.00 -2.06 0.00 0.00 59.70 57.89 1nqt h MET 12 Cb 0.24 0.23 -0.06 0.00 0.06 0.00 0.00 31.60 32.06 1nqt h MET 12 CO 0.00 -0.67 0.33 0.28 1.06 0.00 0.00 176.91 177.91 1nqt h VAL 13 N -1.26 0.89 -0.38 -2.22 2.07 -1.01 0.28 116.25 114.63 1nqt h VAL 13 Ca -0.11 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.26 1nqt h VAL 13 Cb 0.80 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1nqt h VAL 13 CO 0.17 0.11 0.12 -0.08 0.02 0.00 0.00 177.57 177.91 1nqt h GLU 14 N 0.59 0.26 0.51 1.57 4.81 -1.10 0.86 114.58 122.08 1nqt h GLU 14 Ca 0.31 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 1nqt h GLU 14 Cb 0.27 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1nqt h GLU 14 CO -0.23 0.18 -0.47 0.78 -0.73 0.00 0.00 179.01 178.54 1nqt h GLY 15 N 0.27 -1.24 -0.79 1.92 0.00 0.16 -1.15 103.07 102.24 1nqt h GLY 15 Ca 0.18 0.57 0.38 0.00 0.00 0.00 0.00 47.33 48.45 1nqt h GLY 15 CO -0.19 -0.38 0.73 0.74 0.00 0.00 0.00 176.54 177.45 1nqt h PHE 16 N -0.97 0.66 0.34 5.60 0.05 -0.22 0.21 116.94 122.61 1nqt h PHE 16 Ca -0.07 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.74 1nqt h PHE 16 Cb 0.83 -0.17 0.00 0.00 2.00 0.00 0.00 35.95 38.61 1nqt h PHE 16 CO -0.22 -0.17 -0.16 0.35 -0.18 0.00 0.00 178.31 177.92 1nqt h PHE 17 N 0.19 -0.43 -0.67 -0.55 3.57 0.03 -2.58 116.94 116.51 1nqt h PHE 17 Ca 0.76 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.45 1nqt h PHE 17 Cb 2.16 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 41.01 1nqt h PHE 17 CO -0.01 -0.14 0.54 -0.44 -2.23 0.00 0.00 178.31 176.03 1nqt h ASP 18 N -1.03 0.00 0.28 0.41 3.32 0.04 0.76 116.42 120.20 1nqt h ASP 18 Ca -0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1nqt h ASP 18 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1nqt h ASP 18 CO 0.08 0.00 -0.13 -0.09 -1.72 0.00 0.00 179.24 177.37 1nqt h ARG 19 N 0.00 -0.36 0.16 3.56 1.12 -0.57 -2.49 114.38 115.80 1nqt h ARG 19 Ca 0.32 0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 59.20 1nqt h ARG 19 Cb 1.40 0.08 0.00 0.00 -0.01 0.00 0.00 29.97 31.44 1nqt h ARG 19 CO -0.00 -0.02 -0.08 0.78 -3.11 0.00 0.00 179.97 177.54 1nqt h GLY 20 N -0.80 -0.23 -0.74 2.80 0.00 -0.47 -2.81 103.07 100.83 1nqt h GLY 20 Ca -0.04 0.08 0.14 0.00 0.00 0.00 0.00 47.33 47.52 1nqt h GLY 20 CO 0.06 -0.08 -0.19 0.00 0.00 0.00 0.00 176.54 176.33 1nqt n ALA 21 N -2.29 0.15 0.05 3.60 0.00 0.24 0.87 120.51 123.12 1nqt n ALA 21 Ca -0.09 0.80 -0.13 0.00 0.00 0.00 0.00 53.44 54.02 1nqt n ALA 21 Cb 0.18 -0.47 -0.08 0.00 0.00 0.00 0.00 19.45 19.08 1nqt n ALA 21 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nqt h SER 22 N 0.00 -0.08 -0.92 0.00 0.87 -1.37 -1.75 113.55 110.30 1nqt h SER 22 Ca 0.34 -0.24 0.15 0.00 -1.23 0.00 0.00 61.79 60.81 1nqt h SER 22 Cb 0.53 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.43 1nqt h SER 22 CO -0.75 0.20 0.59 0.40 -0.53 0.00 0.00 176.83 176.73 1nqt h ILE 23 N -0.37 0.83 0.12 2.23 2.04 0.74 -3.12 117.51 119.98 1nqt h ILE 23 Ca -0.01 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1nqt h ILE 23 Cb 0.32 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 1nqt h ILE 23 CO 0.02 0.13 -0.06 0.58 0.00 0.00 0.00 178.15 178.82 1nqt h VAL 24 N 0.73 0.31 -0.10 1.67 2.07 -0.94 -3.39 116.25 116.60 1nqt h VAL 24 Ca 0.47 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.94 1nqt h VAL 24 Cb 0.73 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1nqt h VAL 24 CO -0.23 0.10 -0.03 1.21 0.02 0.00 0.00 177.57 178.64 1nqt n GLU 25 N -4.87 -0.02 0.12 1.57 2.13 -0.66 -0.74 120.64 118.18 1nqt n GLU 25 Ca -0.04 0.16 -0.05 0.00 0.66 0.00 0.00 57.16 57.89 1nqt n GLU 25 Cb 0.14 -0.24 -0.02 0.00 0.27 0.00 0.00 31.44 31.59 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 -0.28 0.00 4.31 5.19 -1.76 -2.92 116.42 120.97 1nqt h ASP 26 Ca 0.04 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1nqt h ASP 26 Cb 0.07 0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.65 1nqt h ASP 26 CO -0.10 -0.16 0.00 0.29 -3.12 0.00 0.00 179.24 176.15 1nqt n LYS 27 N -3.10 0.70 -0.00 3.56 5.02 0.08 -1.20 118.16 123.23 1nqt n LYS 27 Ca -0.04 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.27 1nqt n LYS 27 Cb 0.13 -1.15 -0.03 0.00 -0.02 0.00 0.00 35.03 33.95 1nqt n LYS 27 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1nqt n LEU 28 N 0.65 0.10 -0.02 -0.35 7.94 -0.50 -4.61 117.00 120.21 1nqt n LEU 28 Ca 0.00 -0.22 -0.03 0.00 -1.11 0.00 0.00 56.01 54.65 1nqt n LEU 28 Cb 0.35 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.29 1nqt n LEU 28 CO 0.00 0.03 -0.24 0.52 -1.11 0.00 0.00 177.39 176.59 1nqt n VAL 29 N -1.44 0.71 0.00 1.96 0.31 -0.34 -4.56 118.33 114.98 1nqt n VAL 29 Ca -0.00 0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1nqt n VAL 29 Cb 0.11 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.30 1nqt n VAL 29 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1nqt n GLU 30 N -3.34 0.00 0.00 5.55 0.28 -1.16 -1.27 120.64 120.71 1nqt n GLU 30 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 1nqt n GLU 30 Cb 0.18 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.05 1nqt n GLU 30 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1nqt n ASP 31 N 0.00 0.00 0.00 -1.84 3.85 -1.26 -1.24 116.55 116.06 1nqt n ASP 31 Ca 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 1nqt n ASP 31 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 1nqt n ASP 31 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1nqt n LEU 32 N -0.26 0.72 0.00 -2.12 4.77 -1.19 -4.88 117.00 114.03 1nqt n LEU 32 Ca 0.00 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 1nqt n LEU 32 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1nqt n LEU 32 CO 0.00 0.18 0.00 -2.11 -1.33 0.00 0.00 177.39 174.13 1nqt n ARG 33 N -0.17 0.00 -1.66 3.23 -4.01 -0.39 -4.94 116.66 108.72 1nqt n ARG 33 Ca 0.00 0.00 -0.31 0.00 -1.04 0.00 0.00 57.85 56.50 1nqt n ARG 33 Cb 0.02 0.00 0.05 0.00 -3.04 0.00 0.00 32.46 29.49 1nqt n ARG 33 CO 0.00 0.00 0.00 2.41 -3.04 0.00 0.00 177.63 177.00 1nqt n THR 34 N 0.00 3.18 -0.04 8.89 -1.04 -0.37 -4.29 114.28 120.61 1nqt n THR 34 Ca 0.00 -3.56 -0.03 0.00 -2.04 0.00 0.00 64.05 58.43 1nqt n THR 34 Cb 0.00 -1.16 -0.07 0.00 -1.82 0.00 0.00 70.33 67.28 1nqt n THR 34 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1nqt n ARG 35 N -0.81 2.12 -3.06 -2.82 3.00 -1.26 -4.66 116.66 109.17 1nqt n ARG 35 Ca 0.55 -0.02 -0.22 0.00 -0.01 0.00 0.00 57.85 58.14 1nqt n ARG 35 Cb 0.75 -1.22 -0.03 0.00 0.00 0.00 0.00 32.46 31.95 1nqt n ARG 35 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1nqt n GLU 36 N -2.22 2.05 -2.48 5.56 1.02 -1.26 -5.10 120.64 118.20 1nqt n GLU 36 Ca -0.12 -4.08 -0.38 0.00 -0.02 0.00 0.00 57.16 52.56 1nqt n GLU 36 Cb 0.68 -1.96 -0.04 0.00 -0.02 0.00 0.00 31.44 30.10 1nqt n GLU 36 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1nqt s SER 37 N -2.94 6.89 -0.47 1.62 0.01 -1.26 -5.04 113.70 112.52 1nqt s SER 37 Ca 0.44 2.16 0.03 0.00 1.31 0.00 0.00 55.95 59.89 1nqt s SER 37 Cb 0.32 -2.60 0.14 0.00 0.21 0.00 0.00 66.02 64.09 1nqt s SER 37 CO -0.11 -0.40 0.28 -1.61 0.41 0.00 0.00 173.24 171.81 1nqt s GLU 38 N -2.12 1.38 -1.33 12.44 0.41 -1.26 -4.85 118.70 123.37 1nqt s GLU 38 Ca 0.53 -2.17 -0.02 0.00 -0.41 0.00 0.00 54.97 52.90 1nqt s GLU 38 Cb -0.27 -2.37 -0.00 0.00 -1.78 0.00 0.00 34.13 29.72 1nqt s GLU 38 CO 0.34 -1.20 0.59 0.39 -0.49 0.00 0.00 175.26 174.88 1nqt n GLU 39 N 3.29 -3.86 -0.76 1.61 -0.58 -1.26 -3.26 120.64 115.81 1nqt n GLU 39 Ca 0.12 0.52 0.00 0.00 -0.42 0.00 0.00 57.16 57.38 1nqt n GLU 39 Cb 0.36 -4.81 0.00 0.00 -0.57 0.00 0.00 31.44 26.42 1nqt n GLU 39 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1nqt n GLN 40 N -4.31 -0.39 -0.17 3.49 7.27 -1.26 -4.42 117.38 117.59 1nqt n GLN 40 Ca -0.29 0.00 0.10 0.00 0.07 0.00 0.00 57.00 56.89 1nqt n GLN 40 Cb 0.67 0.00 0.27 0.00 2.41 0.00 0.00 30.24 33.60 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1nqt n LYS 41 N -0.28 2.15 -0.02 3.69 5.02 -1.20 -3.63 118.16 123.88 1nqt n LYS 41 Ca 0.00 -1.76 0.06 0.00 -2.02 0.00 0.00 58.31 54.60 1nqt n LYS 41 Cb 0.00 -1.44 0.33 0.00 -0.02 0.00 0.00 35.03 33.90 1nqt n LYS 41 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nqt n ARG 42 N 0.95 1.14 -0.17 1.97 1.74 -1.26 -0.13 116.66 120.90 1nqt n ARG 42 Ca 0.18 -0.21 0.10 0.00 -0.77 0.00 0.00 57.85 57.15 1nqt n ARG 42 Cb 0.46 -1.21 0.19 0.00 -1.02 0.00 0.00 32.46 30.88 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 -0.48 3.19 -0.62 0.55 5.15 -1.24 -3.50 115.26 118.30 1nqt n ASN 43 Ca 0.10 -1.92 0.06 0.00 -0.60 0.00 0.00 54.58 52.21 1nqt n ASN 43 Cb 0.09 -0.22 0.16 0.00 -0.53 0.00 0.00 39.78 39.27 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 1.22 2.87 -0.71 1.20 3.00 0.82 -4.26 116.66 120.80 1nqt n ARG 44 Ca 0.16 -2.14 -0.01 0.00 -0.00 0.00 0.00 57.85 55.86 1nqt n ARG 44 Cb 0.53 -1.34 0.21 0.00 0.00 0.00 0.00 32.46 31.86 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1nqt n VAL 45 N 0.24 2.46 -0.46 5.15 3.14 -1.23 -4.20 118.33 123.43 1nqt n VAL 45 Ca 0.12 -2.66 0.10 0.00 -2.96 0.00 0.00 64.34 58.94 1nqt n VAL 45 Cb 0.49 -0.30 0.34 0.00 -1.06 0.00 0.00 33.84 33.31 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 -1.06 3.25 0.00 1.45 1.85 -1.26 -3.57 116.66 117.32 1nqt n ARG 46 Ca 0.30 -2.75 0.14 0.00 -1.00 0.00 0.00 57.85 54.54 1nqt n ARG 46 Cb 0.97 -1.75 0.44 0.00 -1.05 0.00 0.00 32.46 31.08 1nqt n ARG 46 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nqt n GLY 47 N 1.39 -0.06 0.12 2.89 0.00 -1.26 -2.97 105.19 105.30 1nqt n GLY 47 Ca 0.25 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 1nqt n GLY 47 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nqt h ILE 48 N 2.28 1.43 -0.11 -0.61 1.08 -1.91 -3.02 117.51 116.66 1nqt h ILE 48 Ca 0.00 -2.56 -0.08 0.00 -0.39 0.00 0.00 64.86 61.83 1nqt h ILE 48 Cb 0.55 3.14 -0.01 0.00 -3.07 0.00 0.00 36.82 37.43 1nqt h ILE 48 CO 0.00 0.74 -0.31 -0.07 -0.69 0.00 0.00 178.15 177.82 1nqt h LEU 49 N -0.26 0.20 0.00 1.44 4.07 -1.79 0.78 115.31 119.74 1nqt h LEU 49 Ca -0.18 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1nqt h LEU 49 Cb 1.76 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 43.44 1nqt h LEU 49 CO 0.17 0.51 0.00 -2.11 -1.08 0.00 0.00 178.44 175.93 1nqt n ARG 50 N -4.12 0.40 -0.09 1.13 1.85 -1.16 -2.27 116.66 112.41 1nqt n ARG 50 Ca -0.01 0.06 -0.23 0.00 -1.00 0.00 0.00 57.85 56.67 1nqt n ARG 50 Cb 0.39 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 30.18 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 -1.24 1.60 0.20 8.89 5.41 -0.34 -4.46 119.36 129.41 1nqt n ILE 51 Ca 0.12 -0.41 -0.15 0.00 1.00 0.00 0.00 62.75 63.32 1nqt n ILE 51 Cb 0.17 -1.78 -0.08 0.00 -0.71 0.00 0.00 39.64 37.24 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 -0.46 0.00 -0.55 1.39 2.04 -0.73 -3.32 117.51 115.88 1nqt h ILE 52 Ca -0.50 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.45 1nqt h ILE 52 Cb 1.72 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.71 1nqt h ILE 52 CO -0.14 0.00 -0.19 1.17 0.00 0.00 0.00 178.15 178.99 1nqt n LYS 53 N -4.93 -0.10 -3.61 2.37 4.81 -0.96 -4.58 118.16 111.17 1nqt n LYS 53 Ca -0.09 0.85 -0.31 0.00 -0.87 0.00 0.00 58.31 57.89 1nqt n LYS 53 Cb 0.37 -1.27 -0.05 0.00 0.02 0.00 0.00 35.03 34.10 1nqt n LYS 53 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1nqt s PRO 54 N -5.58 3.64 0.31 1.64 0.04 -1.25 -5.02 135.00 128.78 1nqt s PRO 54 Ca -0.08 -0.05 -0.30 0.00 0.04 0.00 0.00 61.00 60.62 1nqt s PRO 54 Cb 0.13 -2.80 -0.11 0.00 0.04 0.00 0.00 34.50 31.75 1nqt s PRO 54 CO 0.41 0.42 1.57 0.00 0.04 0.00 0.00 177.00 179.43 1nqt h ASN 56 N 4.45 0.00 -3.90 0.00 2.35 -1.10 -3.47 115.58 113.92 1nqt h ASN 56 Ca -0.48 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.09 1nqt h ASN 56 Cb 1.22 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.34 1nqt h ASN 56 CO 0.76 0.69 -0.51 -1.00 -1.65 0.00 0.00 177.43 175.72 1nqt s HIS 57 N -2.85 -0.17 -0.22 1.19 3.76 -1.06 -5.06 115.29 110.88 1nqt s HIS 57 Ca -0.00 0.41 -0.03 0.00 -0.15 0.00 0.00 55.06 55.29 1nqt s HIS 57 Cb 0.08 0.06 0.11 0.00 1.11 0.00 0.00 32.58 33.94 1nqt s HIS 57 CO 0.79 -0.11 0.29 0.54 -0.85 0.00 0.00 174.74 175.40 1nqt s VAL 58 N -0.03 -0.44 0.11 -0.90 0.11 -1.26 -0.63 120.40 117.35 1nqt s VAL 58 Ca -0.01 -0.11 -0.18 0.00 -2.93 0.00 0.00 61.98 58.75 1nqt s VAL 58 Cb -0.02 -0.75 -0.07 0.00 -1.53 0.00 0.00 36.38 34.02 1nqt s VAL 58 CO 0.00 -0.18 0.57 -0.22 -3.33 0.00 0.00 175.10 171.94 1nqt s LEU 59 N 2.42 4.46 -0.02 2.54 2.96 -0.21 -4.96 118.68 125.87 1nqt s LEU 59 Ca 0.09 1.21 0.02 0.00 -0.22 0.00 0.00 54.13 55.24 1nqt s LEU 59 Cb -0.16 -3.06 0.00 0.00 0.50 0.00 0.00 46.19 43.48 1nqt s LEU 59 CO -0.15 0.20 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.58 1nqt s SER 60 N -1.34 0.90 0.10 3.68 0.01 -1.26 -1.90 113.70 113.89 1nqt s SER 60 Ca 0.33 -0.13 -0.07 0.00 1.31 0.00 0.00 55.95 57.38 1nqt s SER 60 Cb -0.18 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.81 1nqt s SER 60 CO 0.19 0.04 0.17 -1.48 0.41 0.00 0.00 173.24 172.57 1nqt s LEU 61 N 0.20 1.52 -0.02 2.44 0.05 0.03 -5.01 118.68 117.90 1nqt s LEU 61 Ca -0.02 -0.79 0.06 0.00 0.05 0.00 0.00 54.13 53.42 1nqt s LEU 61 Cb -0.07 0.89 -0.01 0.00 -2.05 0.00 0.00 46.19 44.94 1nqt s LEU 61 CO -0.00 -0.74 -0.19 -0.94 -0.55 0.00 0.00 176.35 173.93 1nqt s SER 62 N -2.90 2.18 -0.09 1.48 1.04 -1.26 -1.14 113.70 113.01 1nqt s SER 62 Ca 0.09 -0.34 -0.24 0.00 0.48 0.00 0.00 55.95 55.95 1nqt s SER 62 Cb 0.05 -0.26 0.05 0.00 0.10 0.00 0.00 66.02 65.96 1nqt s SER 62 CO -0.08 0.22 0.55 0.72 0.98 0.00 0.00 173.24 175.64 1nqt s PHE 63 N -0.41 -0.52 0.25 5.02 -0.12 -0.31 -4.94 117.98 116.96 1nqt s PHE 63 Ca 0.07 1.01 0.01 0.00 -0.05 0.00 0.00 56.93 57.96 1nqt s PHE 63 Cb -0.07 0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.55 1nqt s PHE 63 CO -0.01 -0.47 0.43 -1.25 -0.05 0.00 0.00 175.22 173.88 1nqt s PRO 64 N -0.83 3.49 -0.04 1.99 0.04 -1.26 0.14 135.00 138.53 1nqt s PRO 64 Ca -0.09 -0.44 -0.15 0.00 0.04 0.00 0.00 61.00 60.36 1nqt s PRO 64 Cb -0.03 -2.80 0.03 0.00 0.04 0.00 0.00 34.50 31.74 1nqt s PRO 64 CO 0.06 0.33 0.33 0.96 0.04 0.00 0.00 177.00 178.73 1nqt s ILE 65 N -2.03 0.04 0.18 0.56 -4.36 -0.66 -4.94 121.20 109.99 1nqt s ILE 65 Ca 0.38 -0.35 -0.14 0.00 -0.26 0.00 0.00 60.65 60.27 1nqt s ILE 65 Cb -0.10 -0.60 -0.07 0.00 1.25 0.00 0.00 42.46 42.93 1nqt s ILE 65 CO 0.31 -0.19 0.58 -0.60 0.24 0.00 0.00 174.94 175.28 1nqt s ARG 66 N -0.98 4.00 0.00 0.37 3.52 -1.26 -2.22 118.95 122.37 1nqt s ARG 66 Ca -0.10 0.53 0.00 0.00 -0.13 0.00 0.00 55.73 56.02 1nqt s ARG 66 Cb -0.04 -2.86 0.00 0.00 -1.56 0.00 0.00 34.95 30.48 1nqt s ARG 66 CO 0.04 0.43 0.00 0.54 -0.81 0.00 0.00 175.30 175.50 1nqt n ARG 67 N 0.61 0.40 0.06 5.12 1.74 0.17 -4.96 116.66 119.80 1nqt n ARG 67 Ca -0.04 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 1nqt n ARG 67 Cb 0.52 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.87 1nqt n ARG 67 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1nqt h ASP 68 N 0.00 0.00 0.00 0.55 3.45 -1.98 -3.21 116.42 115.23 1nqt h ASP 68 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1nqt h ASP 68 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 1nqt h ASP 68 CO 0.00 0.86 0.00 -0.90 -1.57 0.00 0.00 179.24 177.63 1nqt n ASP 69 N -3.24 0.00 0.00 6.45 5.68 -1.26 -4.89 116.55 119.30 1nqt n ASP 69 Ca -0.03 -1.72 0.00 0.00 -0.50 0.00 0.00 54.79 52.54 1nqt n ASP 69 Cb 0.90 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.88 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 0.58 0.92 3.88 6.12 0.00 -1.21 -5.05 105.19 110.43 1nqt n GLY 70 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.97 6.57 0.03 1.61 1.04 -1.26 -4.80 113.70 113.91 1nqt s SER 71 Ca 0.00 1.06 -0.06 0.00 0.48 0.00 0.00 55.95 57.43 1nqt s SER 71 Cb 0.00 -2.29 -0.05 0.00 0.10 0.00 0.00 66.02 63.78 1nqt s SER 71 CO 0.00 -0.29 0.28 0.26 0.98 0.00 0.00 173.24 174.46 1nqt s TRP 72 N -2.19 3.56 -0.04 5.02 0.51 -1.26 -0.65 118.94 123.89 1nqt s TRP 72 Ca 0.50 0.55 -0.14 0.00 -2.12 0.00 0.00 56.10 54.89 1nqt s TRP 72 Cb -0.10 -1.98 0.03 0.00 -0.81 0.00 0.00 33.47 30.60 1nqt s TRP 72 CO 0.27 0.59 0.32 -2.00 -0.51 0.00 0.00 176.95 175.62 1nqt s GLU 73 N -1.90 0.60 -0.17 4.98 2.12 -0.94 -4.95 118.70 118.44 1nqt s GLU 73 Ca 0.29 -0.04 -0.07 0.00 0.36 0.00 0.00 54.97 55.51 1nqt s GLU 73 Cb -0.13 0.27 -0.04 0.00 0.26 0.00 0.00 34.13 34.49 1nqt s GLU 73 CO 0.18 -0.15 0.06 0.14 -0.54 0.00 0.00 175.26 174.95 1nqt s VAL 74 N -0.98 4.80 -0.11 3.70 -7.23 -1.26 -1.65 120.40 117.67 1nqt s VAL 74 Ca -0.10 -0.03 -0.03 0.00 -1.81 0.00 0.00 61.98 60.00 1nqt s VAL 74 Cb -0.05 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 33.71 1nqt s VAL 74 CO 0.03 0.48 0.00 -0.63 -0.31 0.00 0.00 175.10 174.68 1nqt s ILE 75 N 0.19 4.31 0.11 -0.62 1.01 0.37 -4.88 121.20 121.68 1nqt s ILE 75 Ca 0.04 -0.24 0.05 0.00 0.00 0.00 0.00 60.65 60.50 1nqt s ILE 75 Cb -0.12 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 1nqt s ILE 75 CO 0.00 0.58 0.06 -1.83 0.00 0.00 0.00 174.94 173.75 1nqt s GLU 76 N -0.58 2.73 0.09 2.79 -1.05 -1.26 -1.16 118.70 120.26 1nqt s GLU 76 Ca 0.10 -0.83 -0.27 0.00 -0.15 0.00 0.00 54.97 53.82 1nqt s GLU 76 Cb -0.12 -2.61 0.08 0.00 -0.44 0.00 0.00 34.13 31.05 1nqt s GLU 76 CO 0.02 0.53 1.05 0.20 0.95 0.00 0.00 175.26 178.01 1nqt s GLY 77 N -2.59 -0.29 0.18 -3.83 0.00 -0.30 -2.09 107.32 98.40 1nqt s GLY 77 Ca 0.28 0.35 -0.07 0.00 0.00 0.00 0.00 44.72 45.28 1nqt s GLY 77 CO 0.21 0.06 0.26 -0.19 0.00 0.00 0.00 173.10 173.44 1nqt s TYR 78 N -3.03 0.59 -0.20 1.90 1.51 0.46 -0.79 117.35 117.79 1nqt s TYR 78 Ca 0.12 -0.93 -0.11 0.00 -1.01 0.00 0.00 57.07 55.15 1nqt s TYR 78 Cb 0.00 -0.16 0.07 0.00 -0.11 0.00 0.00 41.96 41.76 1nqt s TYR 78 CO -0.00 -0.73 0.49 0.50 -1.11 0.00 0.00 175.55 174.69 1nqt s ARG 79 N -4.02 0.47 -0.14 -0.62 6.06 -0.80 -0.32 118.95 119.58 1nqt s ARG 79 Ca 0.23 0.92 0.00 0.00 -2.50 0.00 0.00 55.73 54.38 1nqt s ARG 79 Cb 0.04 0.04 0.02 0.00 0.06 0.00 0.00 34.95 35.11 1nqt s ARG 79 CO 0.04 -0.16 -0.12 0.00 -2.50 0.00 0.00 175.30 172.56 1nqt s ALA 80 N 1.52 1.71 -0.32 6.12 0.00 0.16 -1.04 121.76 129.92 1nqt s ALA 80 Ca -0.09 -0.81 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 1nqt s ALA 80 Cb -0.08 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 1nqt s ALA 80 CO -0.15 -0.40 0.32 -0.65 0.00 0.00 0.00 175.76 174.88 1nqt s GLN 81 N 1.55 3.72 -0.01 0.00 -0.21 0.20 -1.18 119.66 123.73 1nqt s GLN 81 Ca 0.05 -0.33 -0.05 0.00 0.02 0.00 0.00 55.36 55.04 1nqt s GLN 81 Cb -0.13 -3.75 -0.03 0.00 1.00 0.00 0.00 33.01 30.10 1nqt s GLN 81 CO -0.10 -0.40 0.54 1.25 -2.12 0.00 0.00 175.29 174.45 1nqt h HIS 82 N 8.39 -0.18 -3.21 0.91 -0.00 0.21 -2.75 115.15 118.53 1nqt h HIS 82 Ca -0.31 -0.00 -0.49 0.00 -0.00 0.00 0.00 60.37 59.56 1nqt h HIS 82 Cb 1.16 0.06 -0.17 0.00 -0.00 0.00 0.00 27.41 28.46 1nqt h HIS 82 CO 0.71 -0.11 -0.77 0.45 -0.00 0.00 0.00 177.93 178.21 1nqt s SER 83 N -3.25 2.60 0.00 3.26 0.15 -1.24 -1.63 113.70 113.59 1nqt s SER 83 Ca -0.03 -0.90 0.03 0.00 0.70 0.00 0.00 55.95 55.76 1nqt s SER 83 Cb 0.00 -0.15 0.10 0.00 -1.71 0.00 0.00 66.02 64.26 1nqt s SER 83 CO 0.08 -0.08 1.05 1.41 1.20 0.00 0.00 173.24 176.91 1nqt n HIS 84 N 0.14 0.14 0.10 3.44 -0.00 -1.26 -4.13 115.22 113.66 1nqt n HIS 84 Ca -0.12 -0.47 0.18 0.00 -0.00 0.00 0.00 57.72 57.32 1nqt n HIS 84 Cb 0.58 -0.04 0.59 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 0.66 0.00 -4.30 -0.41 -0.00 -1.95 -3.12 115.11 105.99 1nqt h GLN 85 Ca 0.00 0.00 -0.61 0.00 -0.00 0.00 0.00 58.65 58.04 1nqt h GLN 85 Cb 0.55 0.00 -0.39 0.00 -0.00 0.00 0.00 27.48 27.64 1nqt h GLN 85 CO 0.00 0.00 -0.78 1.03 -0.00 0.00 0.00 178.83 179.08 1nqt s ARG 86 N -4.37 1.50 0.01 0.06 1.81 -1.26 -4.96 118.95 111.74 1nqt s ARG 86 Ca -0.03 -1.10 -0.01 0.00 -1.72 0.00 0.00 55.73 52.87 1nqt s ARG 86 Cb 0.12 -2.59 -0.00 0.00 -0.45 0.00 0.00 34.95 32.02 1nqt s ARG 86 CO 0.39 -0.68 0.29 2.41 -0.68 0.00 0.00 175.30 177.04 1nqt n THR 87 N 4.64 -0.03 -2.46 0.02 -1.04 -1.18 -3.04 114.28 111.20 1nqt n THR 87 Ca -0.09 0.44 -0.41 0.00 -2.04 0.00 0.00 64.05 61.95 1nqt n THR 87 Cb 0.44 -0.58 -0.03 0.00 -1.82 0.00 0.00 70.33 68.34 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 -3.35 3.30 0.21 -2.82 0.02 -1.21 -4.69 135.00 126.46 1nqt s PRO 88 Ca -0.01 0.25 -0.31 0.00 0.02 0.00 0.00 61.00 60.95 1nqt s PRO 88 Cb 0.00 -4.12 -0.10 0.00 0.02 0.00 0.00 34.50 30.30 1nqt s PRO 88 CO 0.03 -1.96 1.50 0.00 -0.33 0.00 0.00 177.00 176.24 1nqt s LYS 90 N 0.36 1.76 0.00 0.00 2.47 -0.21 0.22 119.74 124.34 1nqt s LYS 90 Ca 0.65 -0.48 0.00 0.00 -1.56 0.00 0.00 55.97 54.57 1nqt s LYS 90 Cb -0.43 -1.46 0.00 0.00 -1.46 0.00 0.00 37.83 34.48 1nqt s LYS 90 CO 0.38 0.09 0.00 0.41 0.16 0.00 0.00 175.35 176.39 1nqt n GLY 91 N 3.61 0.95 2.11 5.54 0.00 -1.21 -2.64 105.19 113.54 1nqt n GLY 91 Ca -0.21 -0.52 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 1nqt n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nqt n GLY 92 N -0.08 -1.56 3.09 -0.02 0.00 -1.26 -2.42 105.19 102.94 1nqt n GLY 92 Ca 0.00 -1.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 1nqt n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 93 N -2.53 1.57 -0.20 -0.61 1.01 0.54 -1.34 121.20 119.64 1nqt s ILE 93 Ca 0.41 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 1nqt s ILE 93 Cb -0.02 -1.41 0.01 0.00 0.01 0.00 0.00 42.46 41.06 1nqt s ILE 93 CO 0.30 0.45 -0.15 -0.60 0.00 0.00 0.00 174.94 174.94 1nqt s ARG 94 N 0.76 3.11 -0.28 2.79 3.52 -0.37 -3.42 118.95 125.05 1nqt s ARG 94 Ca -0.11 -0.77 -0.19 0.00 -0.13 0.00 0.00 55.73 54.52 1nqt s ARG 94 Cb -0.16 -2.72 -0.02 0.00 -1.56 0.00 0.00 34.95 30.49 1nqt s ARG 94 CO 0.02 -0.21 0.58 0.71 -0.81 0.00 0.00 175.30 175.59 1nqt s TYR 95 N 1.35 3.24 0.14 5.12 4.12 -1.26 -0.32 117.35 129.74 1nqt s TYR 95 Ca 0.05 0.61 -0.25 0.00 0.02 0.00 0.00 57.07 57.50 1nqt s TYR 95 Cb -0.14 -2.87 0.07 0.00 -1.52 0.00 0.00 41.96 37.51 1nqt s TYR 95 CO -0.10 -0.39 1.01 0.45 0.02 0.00 0.00 175.55 176.54 1nqt s SER 96 N 1.59 -0.14 0.00 2.29 0.15 0.16 -4.76 113.70 112.98 1nqt s SER 96 Ca 0.24 -0.40 0.19 0.00 0.70 0.00 0.00 55.95 56.68 1nqt s SER 96 Cb -0.15 0.45 -0.16 0.00 -1.71 0.00 0.00 66.02 64.45 1nqt s SER 96 CO 0.10 -0.84 0.86 0.41 1.20 0.00 0.00 173.24 174.98 1nqt n THR 97 N -0.50 0.00 -1.61 6.45 -1.04 -1.20 0.17 114.28 116.55 1nqt n THR 97 Ca -0.06 -0.11 -0.29 0.00 -2.04 0.00 0.00 64.05 61.56 1nqt n THR 97 Cb 0.61 1.06 0.06 0.00 -1.82 0.00 0.00 70.33 70.24 1nqt n THR 97 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1nqt n ASP 98 N -1.11 6.23 -4.80 8.00 10.43 -1.26 -4.86 116.55 129.18 1nqt n ASP 98 Ca 0.05 -3.77 -0.36 0.00 2.57 0.00 0.00 54.79 53.27 1nqt n ASP 98 Cb 0.33 -0.70 -0.07 0.00 1.84 0.00 0.00 41.12 42.52 1nqt n ASP 98 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 1nqt s VAL 99 N -4.62 5.40 -0.00 2.53 -7.23 -1.26 -5.06 120.40 110.15 1nqt s VAL 99 Ca 0.58 0.32 0.01 0.00 -1.81 0.00 0.00 61.98 61.08 1nqt s VAL 99 Cb 0.46 -3.49 -0.00 0.00 0.56 0.00 0.00 36.38 33.91 1nqt s VAL 99 CO 0.01 0.51 -0.03 -0.94 -0.31 0.00 0.00 175.10 174.35 1nqt s SER 100 N -0.29 0.34 0.30 4.85 1.04 -1.26 -4.84 113.70 113.85 1nqt s SER 100 Ca 0.14 -0.05 0.04 0.00 0.48 0.00 0.00 55.95 56.55 1nqt s SER 100 Cb -0.12 -0.04 0.80 0.00 0.10 0.00 0.00 66.02 66.75 1nqt s SER 100 CO 0.03 0.03 1.61 0.58 0.98 0.00 0.00 173.24 176.47 1nqt h VAL 101 N 5.10 0.16 0.00 5.02 2.07 -1.99 2.34 116.25 128.95 1nqt h VAL 101 Ca -0.26 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1nqt h VAL 101 Cb 1.20 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1nqt h VAL 101 CO 0.51 0.02 0.00 0.47 0.02 0.00 0.00 177.57 178.58 1nqt n ASP 102 N -5.34 0.30 -0.09 0.57 10.43 -1.26 -1.53 116.55 119.62 1nqt n ASP 102 Ca 0.24 0.56 -0.17 0.00 2.57 0.00 0.00 54.79 57.98 1nqt n ASP 102 Cb 0.78 -0.63 -0.10 0.00 1.84 0.00 0.00 41.12 43.02 1nqt n ASP 102 CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 1nqt h GLU 103 N 0.00 0.00 0.20 -1.24 4.81 0.35 -3.14 114.58 115.56 1nqt h GLU 103 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1nqt h GLU 103 Cb 0.39 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1nqt h GLU 103 CO 0.00 0.79 -0.41 -0.39 -0.73 0.00 0.00 179.01 178.27 1nqt h VAL 104 N -1.00 0.17 -0.91 0.32 -1.51 -1.07 0.14 116.25 112.38 1nqt h VAL 104 Ca -0.24 0.00 0.17 0.00 -1.23 0.00 0.00 66.70 65.40 1nqt h VAL 104 Cb 1.09 0.17 -0.17 0.00 -2.13 0.00 0.00 31.29 30.25 1nqt h VAL 104 CO -0.15 0.00 -0.25 0.29 -1.23 0.00 0.00 177.57 176.23 1nqt n LYS 105 N -5.47 -0.11 0.40 5.19 5.02 -0.58 0.10 118.16 122.71 1nqt n LYS 105 Ca -0.08 1.42 -0.19 0.00 -2.02 0.00 0.00 58.31 57.44 1nqt n LYS 105 Cb 0.38 -2.11 -0.09 0.00 -0.02 0.00 0.00 35.03 33.19 1nqt n LYS 105 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt h ALA 106 N 1.71 -1.02 -0.47 7.82 0.00 -1.01 -2.07 119.26 124.22 1nqt h ALA 106 Ca 0.41 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.19 1nqt h ALA 106 Cb 0.64 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 1nqt h ALA 106 CO -0.93 -1.07 0.03 -0.07 0.00 0.00 0.00 179.25 177.20 1nqt h LEU 107 N -1.02 -0.14 -0.38 0.00 3.38 0.22 -1.43 115.31 115.94 1nqt h LEU 107 Ca -0.10 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1nqt h LEU 107 Cb 0.78 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.64 1nqt h LEU 107 CO 0.16 -0.04 -0.05 0.00 0.09 0.00 0.00 178.44 178.60 1nqt h ALA 108 N 1.40 0.29 -0.17 1.53 0.00 -0.29 0.17 119.26 122.19 1nqt h ALA 108 Ca 0.24 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.33 1nqt h ALA 108 Cb 0.34 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 1nqt h ALA 108 CO -0.37 -0.43 -0.27 0.66 0.00 0.00 0.00 179.25 178.84 1nqt h SER 109 N 0.04 -0.85 -0.54 0.00 4.64 -0.64 -1.40 113.55 114.80 1nqt h SER 109 Ca 0.18 0.14 0.11 0.00 -0.47 0.00 0.00 61.79 61.75 1nqt h SER 109 Cb 0.27 0.38 -0.11 0.00 -0.31 0.00 0.00 62.40 62.64 1nqt h SER 109 CO -0.36 -0.31 -0.24 0.25 -0.87 0.00 0.00 176.83 175.30 1nqt h LEU 110 N -0.32 -0.84 -0.45 5.97 5.85 -0.23 -1.77 115.31 123.52 1nqt h LEU 110 Ca 0.11 0.19 0.09 0.00 0.84 0.00 0.00 57.88 59.12 1nqt h LEU 110 Cb 0.49 0.46 -0.09 0.00 0.37 0.00 0.00 40.66 41.89 1nqt h LEU 110 CO -0.36 -0.26 -0.12 0.24 -0.34 0.00 0.00 178.44 177.61 1nqt h MET 111 N -0.11 -0.01 -0.67 1.25 2.86 0.38 0.13 114.93 118.76 1nqt h MET 111 Ca 0.24 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 57.98 1nqt h MET 111 Cb 0.50 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.09 1nqt h MET 111 CO -0.61 -0.00 0.30 1.79 1.06 0.00 0.00 176.91 179.45 1nqt h THR 112 N -0.01 0.81 0.34 2.22 1.35 -0.82 0.18 112.91 116.98 1nqt h THR 112 Ca 0.22 -0.18 -0.02 0.00 -0.55 0.00 0.00 66.41 65.88 1nqt h THR 112 Cb 0.34 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.01 1nqt h THR 112 CO -0.47 0.09 -0.16 1.88 -0.25 0.00 0.00 175.52 176.61 1nqt h TYR 113 N 0.52 -0.42 -0.93 4.73 0.05 -1.19 -2.18 116.97 117.54 1nqt h TYR 113 Ca 0.34 -0.01 0.27 0.00 0.05 0.00 0.00 58.73 59.38 1nqt h TYR 113 Cb 0.39 0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.23 1nqt h TYR 113 CO -0.13 -0.10 0.67 -0.22 -1.05 0.00 0.00 178.16 177.33 1nqt h LYS 114 N -0.77 0.00 0.02 4.88 3.64 0.14 0.94 116.57 125.42 1nqt h LYS 114 Ca -0.05 -0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.09 1nqt h LYS 114 Cb 0.51 -0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.35 1nqt h LYS 114 CO 0.08 0.00 -0.95 0.00 -2.27 0.00 0.00 179.45 176.31 1nqt h ALA 116 N 0.36 1.21 -0.34 0.00 0.00 -0.22 0.27 119.26 120.54 1nqt h ALA 116 Ca -0.12 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.76 1nqt h ALA 116 Cb 1.62 -0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 1nqt h ALA 116 CO 0.19 0.66 -0.11 0.28 0.00 0.00 0.00 179.25 180.26 1nqt h VAL 117 N 1.31 0.60 -0.97 0.00 2.07 -1.06 -1.92 116.25 116.28 1nqt h VAL 117 Ca 0.34 0.00 -0.60 0.00 0.82 0.00 0.00 66.70 67.26 1nqt h VAL 117 Cb -0.07 0.60 -0.29 0.00 -1.52 0.00 0.00 31.29 30.01 1nqt h VAL 117 CO -0.07 0.00 0.77 1.33 0.02 0.00 0.00 177.57 179.63 1nqt n VAL 118 N -5.30 3.42 -3.24 2.57 0.24 -1.03 -4.76 118.33 110.24 1nqt n VAL 118 Ca 0.01 -2.48 -0.18 0.00 -2.04 0.00 0.00 64.34 59.65 1nqt n VAL 118 Cb 0.22 -0.91 -0.02 0.00 -1.47 0.00 0.00 33.84 31.65 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 -0.94 -2.19 -4.63 -1.34 8.00 -0.59 -4.88 116.55 109.98 1nqt n ASP 119 Ca 0.60 -0.20 -0.39 0.00 0.71 0.00 0.00 54.79 55.50 1nqt n ASP 119 Cb 1.03 -1.91 -0.08 0.00 -0.02 0.00 0.00 41.12 40.14 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 -2.62 5.11 0.00 2.53 1.01 0.85 -4.96 120.40 122.33 1nqt s VAL 120 Ca 0.32 0.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.08 1nqt s VAL 120 Cb -0.18 -3.79 -0.14 0.00 0.00 0.00 0.00 36.38 32.27 1nqt s VAL 120 CO 0.39 0.14 2.16 -0.81 0.00 0.00 0.00 175.10 176.98 1nqt n PRO 121 N 5.19 1.06 -4.35 2.72 -0.04 -1.26 -4.33 135.00 134.00 1nqt n PRO 121 Ca -0.06 -0.53 -0.20 0.00 -0.04 0.00 0.00 63.50 62.67 1nqt n PRO 121 Cb 0.50 -1.76 -0.10 0.00 -0.04 0.00 0.00 33.50 32.10 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 1.92 1.79 -0.16 0.54 2.99 -1.26 -4.52 117.98 119.28 1nqt s PHE 122 Ca 0.35 -0.51 -0.05 0.00 0.00 0.00 0.00 56.93 56.72 1nqt s PHE 122 Cb 0.17 -0.85 -0.03 0.00 0.00 0.00 0.00 43.02 42.30 1nqt s PHE 122 CO 0.00 0.37 -0.00 0.20 -0.00 0.00 0.00 175.22 175.79 1nqt s GLY 123 N -3.06 1.79 0.09 4.36 0.00 -1.17 -4.77 107.32 104.57 1nqt s GLY 123 Ca 0.20 -0.79 -0.36 0.00 0.00 0.00 0.00 44.72 43.77 1nqt s GLY 123 CO 0.07 -0.04 1.38 0.61 0.00 0.00 0.00 173.10 175.13 1nqt n GLY 124 N 3.50 0.56 3.34 0.20 0.00 -1.26 -1.05 105.19 110.48 1nqt n GLY 124 Ca -0.17 0.70 -0.09 0.00 0.00 0.00 0.00 46.02 46.46 1nqt n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 125 N 0.62 -0.18 0.25 4.61 0.00 -1.08 0.21 121.76 126.18 1nqt s ALA 125 Ca 0.84 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.86 1nqt s ALA 125 Cb -0.92 0.80 0.03 0.00 0.00 0.00 0.00 23.12 23.02 1nqt s ALA 125 CO 0.46 -0.65 0.66 0.21 0.00 0.00 0.00 175.76 176.45 1nqt s LYS 126 N -3.93 1.64 0.03 0.00 2.47 -0.32 -3.85 119.74 115.77 1nqt s LYS 126 Ca 0.14 -0.90 -0.12 0.00 -1.56 0.00 0.00 55.97 53.53 1nqt s LYS 126 Cb 0.03 0.59 0.01 0.00 -1.46 0.00 0.00 37.83 37.00 1nqt s LYS 126 CO -0.02 -0.74 0.25 0.00 0.16 0.00 0.00 175.35 175.00 1nqt s ALA 127 N -3.89 -0.55 -0.07 3.13 0.00 -0.45 0.38 121.76 120.31 1nqt s ALA 127 Ca 0.10 -0.04 -0.10 0.00 0.00 0.00 0.00 51.96 51.92 1nqt s ALA 127 Cb -0.04 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.33 1nqt s ALA 127 CO 0.02 -0.34 0.26 0.20 0.00 0.00 0.00 175.76 175.90 1nqt s GLY 128 N -1.84 -0.16 -0.36 0.00 0.00 0.56 -1.24 107.32 104.28 1nqt s GLY 128 Ca -0.08 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.21 1nqt s GLY 128 CO -0.01 0.44 0.17 0.14 0.00 0.00 0.00 173.10 173.84 1nqt s VAL 129 N -0.29 0.88 -0.76 1.40 1.01 0.56 -0.41 120.40 122.80 1nqt s VAL 129 Ca -0.04 -1.82 -0.09 0.00 0.00 0.00 0.00 61.98 60.03 1nqt s VAL 129 Cb -0.03 -1.64 -0.25 0.00 0.00 0.00 0.00 36.38 34.46 1nqt s VAL 129 CO 0.01 -0.81 1.91 1.17 0.00 0.00 0.00 175.10 177.38 1nqt n LYS 130 N 4.27 0.04 -3.59 2.72 3.00 -0.89 -2.83 118.16 120.88 1nqt n LYS 130 Ca 0.04 -0.11 -0.09 0.00 -0.00 0.00 0.00 58.31 58.15 1nqt n LYS 130 Cb 0.38 -1.28 -0.05 0.00 0.00 0.00 0.00 35.03 34.09 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 1.55 0.00 -0.28 3.15 2.07 0.45 -4.40 121.20 123.73 1nqt s ILE 131 Ca 0.98 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 60.18 1nqt s ILE 131 Cb -0.58 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.04 1nqt s ILE 131 CO 0.39 0.00 0.01 0.21 -1.91 0.00 0.00 174.94 173.64 1nqt s ASN 132 N -1.01 4.77 0.24 4.50 3.84 -1.26 0.36 114.94 126.37 1nqt s ASN 132 Ca 0.01 -0.95 -0.06 0.00 0.21 0.00 0.00 52.86 52.07 1nqt s ASN 132 Cb -0.01 -1.75 0.42 0.00 -0.55 0.00 0.00 41.25 39.36 1nqt s ASN 132 CO -0.01 -0.20 1.71 -0.65 -2.79 0.00 0.00 177.10 175.17 1nqt h PRO 133 N 8.09 0.35 0.00 0.43 0.11 -1.93 -1.41 132.00 137.63 1nqt h PRO 133 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1nqt h PRO 133 Cb 1.10 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1nqt h PRO 133 CO 0.57 0.23 0.17 1.17 -0.21 0.00 0.00 178.00 179.94 1nqt n LYS 134 N -5.07 0.00 -0.15 1.05 4.81 -1.26 0.65 118.16 118.20 1nqt n LYS 134 Ca 0.13 0.34 0.07 0.00 -0.87 0.00 0.00 58.31 57.98 1nqt n LYS 134 Cb 0.40 -1.68 0.15 0.00 0.02 0.00 0.00 35.03 33.92 1nqt n LYS 134 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1nqt n ASN 135 N -1.36 2.86 -4.22 3.14 3.02 -0.53 -4.98 115.26 113.18 1nqt n ASN 135 Ca -0.00 -1.88 -0.19 0.00 -0.03 0.00 0.00 54.58 52.48 1nqt n ASN 135 Cb 0.17 -0.20 -0.12 0.00 -0.61 0.00 0.00 39.78 39.02 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 -1.04 1.38 0.79 3.10 2.02 0.21 -5.07 117.35 118.74 1nqt s TYR 136 Ca 0.25 -0.50 -0.11 0.00 -0.37 0.00 0.00 57.07 56.34 1nqt s TYR 136 Cb 0.14 -0.75 0.06 0.00 -0.40 0.00 0.00 41.96 41.02 1nqt s TYR 136 CO 0.19 0.12 1.09 0.99 -1.57 0.00 0.00 175.55 176.37 1nqt s THR 137 N -1.71 3.29 -0.35 -0.71 2.01 -1.26 -4.76 115.64 112.15 1nqt s THR 137 Ca 0.05 0.42 0.25 0.00 0.31 0.00 0.00 61.69 62.71 1nqt s THR 137 Cb -0.07 -2.96 0.26 0.00 0.01 0.00 0.00 72.50 69.74 1nqt s THR 137 CO 0.03 -0.55 1.74 0.44 -0.69 0.00 0.00 174.62 175.59 1nqt h ASP 138 N -1.14 0.00 0.00 3.53 3.32 -1.99 0.37 116.42 120.51 1nqt h ASP 138 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1nqt h ASP 138 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1nqt h ASP 138 CO 0.53 0.00 -0.14 -1.13 -1.72 0.00 0.00 179.24 176.78 1nqt h ASN 139 N 0.00 0.00 -0.92 6.45 -0.00 -2.00 -3.22 115.58 115.89 1nqt h ASN 139 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 56.30 56.49 1nqt h ASN 139 Cb 0.30 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 38.54 1nqt h ASN 139 CO 0.00 0.52 0.59 -0.33 -0.00 0.00 0.00 177.43 178.21 1nqt h GLU 140 N -0.90 0.52 -0.36 6.67 5.08 -1.79 0.41 114.58 124.21 1nqt h GLU 140 Ca 0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1nqt h GLU 140 Cb 0.14 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1nqt h GLU 140 CO 0.00 0.34 0.17 -0.07 -1.00 0.00 0.00 179.01 178.46 1nqt h LEU 141 N 0.53 0.47 -0.13 1.33 3.38 -0.41 -1.64 115.31 118.85 1nqt h LEU 141 Ca 0.48 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.34 1nqt h LEU 141 Cb 1.02 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1nqt h LEU 141 CO -0.22 0.47 0.02 -0.08 0.09 0.00 0.00 178.44 178.72 1nqt h GLU 142 N 0.44 0.07 -0.97 1.13 4.81 -0.95 -1.10 114.58 118.01 1nqt h GLU 142 Ca 0.12 -0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.50 1nqt h GLU 142 Cb 0.12 -0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.39 1nqt h GLU 142 CO -0.02 0.05 0.59 0.87 -0.73 0.00 0.00 179.01 179.77 1nqt h LYS 143 N 0.08 0.80 0.00 1.92 1.57 -1.11 -1.28 116.57 118.55 1nqt h LYS 143 Ca 0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1nqt h LYS 143 Cb 0.05 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1nqt h LYS 143 CO -0.08 0.53 0.00 -0.89 -0.57 0.00 0.00 179.45 178.44 1nqt n ILE 144 N -4.73 0.00 -0.30 1.86 5.41 -0.59 -2.16 119.36 118.85 1nqt n ILE 144 Ca 0.20 1.21 0.25 0.00 1.00 0.00 0.00 62.75 65.42 1nqt n ILE 144 Cb 0.46 -2.19 0.47 0.00 -0.71 0.00 0.00 39.64 37.68 1nqt n ILE 144 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1nqt n THR 145 N -1.33 -0.38 0.39 1.39 -2.24 -0.52 0.86 114.28 112.45 1nqt n THR 145 Ca 0.00 1.88 0.14 0.00 -2.27 0.00 0.00 64.05 63.79 1nqt n THR 145 Cb 0.00 -2.98 0.44 0.00 -2.10 0.00 0.00 70.33 65.69 1nqt n THR 145 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1nqt h ARG 146 N 0.00 0.00 0.04 -0.78 3.08 -1.21 0.16 114.38 115.67 1nqt h ARG 146 Ca 0.72 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 60.45 1nqt h ARG 146 Cb 1.83 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.84 1nqt h ARG 146 CO -0.74 0.00 -1.83 -2.13 -1.07 0.00 0.00 179.97 174.20 1nqt n ARG 147 N -2.65 0.68 0.03 0.04 0.00 0.25 -3.32 116.66 111.69 1nqt n ARG 147 Ca 0.03 0.28 -0.12 0.00 -0.00 0.00 0.00 57.85 58.03 1nqt n ARG 147 Cb 0.37 -1.76 -0.08 0.00 0.00 0.00 0.00 32.46 31.00 1nqt n ARG 147 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 1nqt h PHE 148 N 0.02 -0.02 -0.77 -0.14 3.57 -0.91 -2.22 116.94 116.47 1nqt h PHE 148 Ca -0.34 -0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.34 1nqt h PHE 148 Cb 2.03 0.01 -0.13 0.00 2.79 0.00 0.00 35.95 40.65 1nqt h PHE 148 CO 0.03 0.17 0.08 1.15 -2.23 0.00 0.00 178.31 177.50 1nqt h THR 149 N -0.21 0.38 -0.30 4.41 2.02 -1.08 0.50 112.91 118.62 1nqt h THR 149 Ca -0.00 -0.05 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 1nqt h THR 149 Cb 0.20 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1nqt h THR 149 CO 0.00 0.03 -0.05 0.24 0.37 0.00 0.00 175.52 176.11 1nqt h MET 150 N 0.16 0.56 -0.16 6.66 2.86 -1.48 -0.49 114.93 123.04 1nqt h MET 150 Ca 0.44 -0.20 -0.15 0.00 -2.06 0.00 0.00 59.70 57.72 1nqt h MET 150 Cb 0.79 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1nqt h MET 150 CO -0.63 0.74 -0.54 0.93 1.06 0.00 0.00 176.91 178.47 1nqt h GLU 151 N 0.34 0.47 -0.86 1.72 4.39 -0.78 -0.21 114.58 119.65 1nqt h GLU 151 Ca 0.08 -0.29 -0.01 0.00 0.34 0.00 0.00 59.36 59.48 1nqt h GLU 151 Cb 0.52 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.16 1nqt h GLU 151 CO 0.02 0.89 0.51 1.25 -1.16 0.00 0.00 179.01 180.53 1nqt h LEU 152 N 0.36 1.03 0.16 1.33 5.85 -0.85 -3.10 115.31 120.09 1nqt h LEU 152 Ca 0.01 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1nqt h LEU 152 Cb 1.06 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.84 1nqt h LEU 152 CO 0.10 0.80 -0.08 0.00 -0.34 0.00 0.00 178.44 178.92 1nqt h ALA 153 N 1.38 -0.21 0.00 1.25 0.00 -0.73 0.61 119.26 121.55 1nqt h ALA 153 Ca 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1nqt h ALA 153 Cb -0.04 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1nqt h ALA 153 CO -0.06 -0.23 0.01 1.63 0.00 0.00 0.00 179.25 180.60 1nqt n LYS 154 N -4.90 0.00 -0.12 0.00 5.02 -0.12 -1.03 118.16 117.01 1nqt n LYS 154 Ca -0.06 0.04 0.01 0.00 -2.02 0.00 0.00 58.31 56.29 1nqt n LYS 154 Cb 0.20 -1.51 0.02 0.00 -0.02 0.00 0.00 35.03 33.72 1nqt n LYS 154 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1nqt n LYS 155 N -0.93 0.95 -2.45 1.97 4.76 -1.18 -5.04 118.16 116.24 1nqt n LYS 155 Ca 0.00 -1.16 -0.02 0.00 -2.87 0.00 0.00 58.31 54.26 1nqt n LYS 155 Cb 0.01 -0.77 0.01 0.00 -1.84 0.00 0.00 35.03 32.44 1nqt n LYS 155 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nqt n GLY 156 N -0.33 0.67 0.08 0.72 0.00 -0.20 -4.99 105.19 101.15 1nqt n GLY 156 Ca 0.02 -0.65 0.01 0.00 0.00 0.00 0.00 46.02 45.40 1nqt n GLY 156 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nqt n PHE 157 N -3.09 0.05 -3.68 1.61 3.72 0.21 -4.73 117.46 111.55 1nqt n PHE 157 Ca -0.01 -0.37 -0.10 0.00 -0.05 0.00 0.00 57.45 56.92 1nqt n PHE 157 Cb 0.51 -0.03 -0.11 0.00 -0.94 0.00 0.00 39.48 38.91 1nqt n PHE 157 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1nqt s ILE 158 N -0.78 -0.19 0.00 4.37 1.10 -1.19 -4.61 121.20 119.90 1nqt s ILE 158 Ca 0.03 0.12 0.00 0.00 -0.51 0.00 0.00 60.65 60.29 1nqt s ILE 158 Cb 0.02 -0.62 0.00 0.00 0.15 0.00 0.00 42.46 42.00 1nqt s ILE 158 CO 0.02 0.05 0.00 0.61 -2.11 0.00 0.00 174.94 173.51 1nqt n GLY 159 N 4.58 1.75 0.16 1.50 0.00 -0.76 -4.53 105.19 107.90 1nqt n GLY 159 Ca -0.19 0.21 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1nqt n GLY 159 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nqt n PRO 160 N -0.06 0.10 -0.05 1.61 -0.04 -1.26 -0.95 135.00 134.36 1nqt n PRO 160 Ca 0.00 0.58 -0.04 0.00 -0.04 0.00 0.00 63.50 64.00 1nqt n PRO 160 Cb 0.00 -2.07 -0.08 0.00 -0.04 0.00 0.00 33.50 31.31 1nqt n PRO 160 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nqt n GLY 161 N -1.28 -0.50 0.00 0.55 0.00 -1.26 -4.89 105.19 97.81 1nqt n GLY 161 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1nqt n GLY 161 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nqt n ILE 162 N -2.34 0.00 -3.98 -0.61 5.41 -0.12 -3.35 119.36 114.37 1nqt n ILE 162 Ca -0.15 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.38 1nqt n ILE 162 Cb 0.79 -0.19 -0.05 0.00 -0.71 0.00 0.00 39.64 39.48 1nqt n ILE 162 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1nqt s ASP 163 N -1.00 5.12 -0.36 4.38 -1.08 -0.89 0.26 116.67 123.11 1nqt s ASP 163 Ca 0.00 -0.53 0.02 0.00 -0.52 0.00 0.00 52.55 51.52 1nqt s ASP 163 Cb 0.00 -0.98 0.15 0.00 -1.46 0.00 0.00 42.92 40.63 1nqt s ASP 163 CO 0.00 -0.25 0.32 -0.69 0.52 0.00 0.00 175.17 175.06 1nqt s VAL 164 N -2.30 -0.20 1.16 1.11 1.01 0.60 -1.82 120.40 119.96 1nqt s VAL 164 Ca 0.38 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 1nqt s VAL 164 Cb -0.05 -0.83 0.28 0.00 0.00 0.00 0.00 36.38 35.77 1nqt s VAL 164 CO 0.25 -0.69 1.03 -2.84 0.00 0.00 0.00 175.10 172.85 1nqt s PRO 165 N 1.43 -0.85 0.37 2.72 0.02 -1.19 -3.32 135.00 134.17 1nqt s PRO 165 Ca 0.16 0.68 -0.06 0.00 0.02 0.00 0.00 61.00 61.81 1nqt s PRO 165 Cb -0.17 -1.57 0.02 0.00 0.02 0.00 0.00 34.50 32.80 1nqt s PRO 165 CO -0.06 -3.64 0.59 0.00 -0.33 0.00 0.00 177.00 173.56 1nqt n ALA 166 N -4.84 -0.79 -2.43 -1.55 0.00 -1.02 -1.56 120.51 108.33 1nqt n ALA 166 Ca 0.03 -1.52 -0.23 0.00 0.00 0.00 0.00 53.44 51.73 1nqt n ALA 166 Cb 0.55 1.22 0.00 0.00 0.00 0.00 0.00 19.45 21.23 1nqt n ALA 166 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1nqt s PRO 167 N -2.58 3.19 0.44 0.00 0.02 -1.26 -0.34 135.00 134.47 1nqt s PRO 167 Ca 0.25 -0.50 0.02 0.00 0.02 0.00 0.00 61.00 60.79 1nqt s PRO 167 Cb -0.02 -2.61 -0.01 0.00 0.02 0.00 0.00 34.50 31.88 1nqt s PRO 167 CO 0.18 -0.12 0.07 -3.47 -0.33 0.00 0.00 177.00 173.34 1nqt n ASP 168 N -1.95 2.23 -0.11 2.53 4.64 -1.22 -4.57 116.55 118.10 1nqt n ASP 168 Ca -0.01 -3.12 -0.06 0.00 -1.38 0.00 0.00 54.79 50.23 1nqt n ASP 168 Cb 0.57 0.69 0.01 0.00 -1.04 0.00 0.00 41.12 41.35 1nqt n ASP 168 CO 0.00 0.00 0.00 0.24 -0.82 0.00 0.00 177.20 176.62 1nqt h MET 169 N 0.00 -0.08 0.00 -0.67 2.86 -2.00 -0.06 114.93 114.98 1nqt h MET 169 Ca -0.35 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1nqt h MET 169 Cb 1.20 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1nqt h MET 169 CO 0.58 -0.05 0.00 -1.13 1.06 0.00 0.00 176.91 177.36 1nqt n SER 170 N -5.34 0.00 -4.10 1.22 3.41 -1.26 -4.71 113.62 102.83 1nqt n SER 170 Ca 0.02 0.37 -0.10 0.00 -0.26 0.00 0.00 58.87 58.91 1nqt n SER 170 Cb 0.25 -0.38 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 1nqt n SER 170 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nqt s THR 171 N -2.77 0.44 0.26 6.66 -4.23 -0.04 -4.52 115.64 111.44 1nqt s THR 171 Ca 0.01 -1.61 0.02 0.00 -1.18 0.00 0.00 61.69 58.93 1nqt s THR 171 Cb 0.01 -1.25 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 1nqt s THR 171 CO 0.02 -0.78 0.16 -0.83 -0.54 0.00 0.00 174.62 172.65 1nqt s GLY 172 N -2.54 1.79 0.29 3.99 0.00 -1.26 -3.77 107.32 105.82 1nqt s GLY 172 Ca 0.03 -1.80 -0.03 0.00 0.00 0.00 0.00 44.72 42.92 1nqt s GLY 172 CO -0.05 -1.49 1.56 1.05 0.00 0.00 0.00 173.10 174.18 1nqt h GLU 173 N 2.40 0.00 -0.77 2.90 4.11 -1.96 0.23 114.58 121.50 1nqt h GLU 173 Ca -0.34 -0.00 0.13 0.00 0.07 0.00 0.00 59.36 59.22 1nqt h GLU 173 Cb 1.25 -0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.36 1nqt h GLU 173 CO 0.51 0.00 -0.36 0.07 0.07 0.00 0.00 179.01 179.30 1nqt h ARG 174 N 0.00 -0.09 0.75 1.06 0.11 -1.96 0.77 114.38 115.01 1nqt h ARG 174 Ca 0.54 0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.59 1nqt h ARG 174 Cb 0.98 0.02 0.01 0.00 1.11 0.00 0.00 29.97 32.09 1nqt h ARG 174 CO -0.98 -0.06 -0.36 0.93 0.10 0.00 0.00 179.97 179.60 1nqt h GLU 175 N -0.09 -0.97 -0.99 0.08 5.08 -0.98 -2.57 114.58 114.14 1nqt h GLU 175 Ca 0.28 0.07 0.25 0.00 -1.00 0.00 0.00 59.36 58.96 1nqt h GLU 175 Cb 0.57 0.22 -0.18 0.00 0.50 0.00 0.00 28.75 29.86 1nqt h GLU 175 CO -0.81 -0.62 -0.04 0.52 -1.00 0.00 0.00 179.01 177.05 1nqt h MET 176 N -1.18 0.01 -0.33 2.33 2.86 -0.56 0.96 114.93 119.02 1nqt h MET 176 Ca -0.10 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1nqt h MET 176 Cb 0.79 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.40 1nqt h MET 176 CO 0.17 0.00 0.06 1.03 1.06 0.00 0.00 176.91 179.23 1nqt h SER 177 N 0.01 0.00 -0.59 1.22 0.87 0.73 0.87 113.55 116.65 1nqt h SER 177 Ca 0.57 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 61.15 1nqt h SER 177 Cb 1.10 0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1nqt h SER 177 CO -0.95 0.04 0.25 -0.50 -0.53 0.00 0.00 176.83 175.14 1nqt h TRP 178 N 0.18 0.92 0.13 2.24 6.55 0.12 0.87 115.95 126.96 1nqt h TRP 178 Ca 0.16 -0.05 -0.01 0.00 0.95 0.00 0.00 58.89 59.94 1nqt h TRP 178 Cb 0.17 -0.28 0.00 0.00 -0.86 0.00 0.00 29.16 28.19 1nqt h TRP 178 CO -0.18 0.71 -0.06 0.82 -1.05 0.00 0.00 178.44 178.67 1nqt h ILE 179 N 0.90 0.88 0.00 1.49 2.04 -0.17 0.14 117.51 122.80 1nqt h ILE 179 Ca 0.21 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1nqt h ILE 179 Cb 0.18 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1nqt h ILE 179 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.14 1nqt n ALA 180 N -2.17 -0.18 -0.22 1.87 0.00 0.23 -1.30 120.51 118.74 1nqt n ALA 180 Ca -0.08 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.34 1nqt n ALA 180 Cb 0.10 0.25 0.05 0.00 0.00 0.00 0.00 19.45 19.84 1nqt n ALA 180 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1nqt h ASP 181 N 0.00 -0.79 -0.49 0.00 1.82 -0.78 -0.35 116.42 115.83 1nqt h ASP 181 Ca 0.00 0.21 0.10 0.00 -0.39 0.00 0.00 57.03 56.95 1nqt h ASP 181 Cb 0.00 0.46 -0.09 0.00 0.68 0.00 0.00 39.33 40.38 1nqt h ASP 181 CO 0.00 -0.25 -0.10 0.74 -1.61 0.00 0.00 179.24 178.02 1nqt h THR 182 N -0.06 0.53 0.00 2.25 2.02 -0.46 -0.81 112.91 116.39 1nqt h THR 182 Ca 0.29 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.46 1nqt h THR 182 Cb 0.51 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1nqt h THR 182 CO -0.68 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.21 1nqt n TYR 183 N -5.33 0.00 0.00 3.16 9.36 -0.24 -1.83 117.16 122.27 1nqt n TYR 183 Ca 0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.26 1nqt n TYR 183 Cb 0.26 -0.43 0.00 0.00 -0.63 0.00 0.00 39.34 38.54 1nqt n TYR 183 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1nqt n ALA 184 N -2.19 1.21 -0.38 2.98 0.00 -0.60 -0.29 120.51 121.23 1nqt n ALA 184 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1nqt n ALA 184 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1nqt n ALA 184 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nqt n SER 185 N -0.42 0.59 0.00 0.00 7.64 -0.37 -4.32 113.62 116.74 1nqt n SER 185 Ca 0.00 -0.98 0.00 0.00 1.01 0.00 0.00 58.87 58.90 1nqt n SER 185 Cb 0.00 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 -0.02 0.00 -0.00 0.44 -1.04 0.60 -4.82 114.28 109.44 1nqt n THR 186 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 1nqt n THR 186 Cb 0.10 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.54 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 1.29 -0.27 12.58 1.08 -1.79 -3.18 117.51 127.23 1nqt h ILE 187 Ca 0.00 -2.05 0.00 0.00 -0.39 0.00 0.00 64.86 62.42 1nqt h ILE 187 Cb 0.00 2.07 0.00 0.00 -3.07 0.00 0.00 36.82 35.82 1nqt h ILE 187 CO 0.00 0.64 0.00 0.61 -0.69 0.00 0.00 178.15 178.71 1nqt n GLY 188 N 0.75 0.30 0.32 5.37 0.00 -0.84 -4.46 105.19 106.63 1nqt n GLY 188 Ca -0.08 -0.31 0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 1.66 0.70 -0.01 1.61 6.17 -1.68 0.46 115.15 124.07 1nqt h HIS 189 Ca 0.00 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.12 1nqt h HIS 189 Cb 0.38 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.17 1nqt h HIS 189 CO 0.18 -0.44 -0.25 0.66 0.71 0.00 0.00 177.93 178.79 1nqt n TYR 190 N -5.27 0.00 -2.70 5.26 4.02 -1.26 -4.86 117.16 112.35 1nqt n TYR 190 Ca 0.35 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.82 1nqt n TYR 190 Cb 1.18 -0.13 -0.03 0.00 -0.02 0.00 0.00 39.34 40.33 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 -2.52 6.24 0.00 7.72 3.68 0.15 -4.91 116.67 127.04 1nqt s ASP 191 Ca 0.24 -0.50 -0.01 0.00 2.13 0.00 0.00 52.55 54.41 1nqt s ASP 191 Cb 0.19 -2.50 -0.07 0.00 -1.45 0.00 0.00 42.92 39.10 1nqt s ASP 191 CO 0.52 -1.56 1.45 0.00 0.13 0.00 0.00 175.17 175.71 1nqt n ILE 192 N 6.26 1.15 -1.65 4.11 3.06 -1.26 0.28 119.36 131.30 1nqt n ILE 192 Ca 0.02 -0.47 -0.01 0.00 -2.50 0.00 0.00 62.75 59.79 1nqt n ILE 192 Cb 0.48 -1.50 -0.01 0.00 0.54 0.00 0.00 39.64 39.15 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 2.31 -0.13 0.24 9.51 3.02 -1.26 -4.97 115.26 123.98 1nqt n ASN 193 Ca 0.10 -0.74 0.07 0.00 -0.03 0.00 0.00 54.58 53.98 1nqt n ASN 193 Cb 0.33 0.04 0.57 0.00 -0.61 0.00 0.00 39.78 40.10 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 1.64 0.00 5.41 0.00 -0.46 -1.08 119.26 124.77 1nqt h ALA 194 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1nqt h ALA 194 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1nqt h ALA 194 CO -0.04 0.19 0.00 0.72 0.00 0.00 0.00 179.25 180.12 1nqt n HIS 195 N -4.20 0.00 0.25 0.00 8.25 -1.26 -0.81 115.22 117.45 1nqt n HIS 195 Ca -0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.50 1nqt n HIS 195 Cb 0.23 -0.08 0.10 0.00 1.12 0.00 0.00 29.99 31.36 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 -0.07 2.37 0.33 -1.41 0.00 -0.41 -4.46 120.51 116.87 1nqt n ALA 196 Ca 0.00 -0.83 0.14 0.00 0.00 0.00 0.00 53.44 52.75 1nqt n ALA 196 Cb 0.21 -0.47 0.60 0.00 0.00 0.00 0.00 19.45 19.79 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 -3.48 0.06 0.43 0.00 0.11 -1.26 -3.19 120.40 113.06 1nqt s VAL 198 Ca 0.02 -0.50 0.07 0.00 -2.93 0.00 0.00 61.98 58.64 1nqt s VAL 198 Cb 0.09 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1nqt s VAL 198 CO 0.40 -0.27 0.21 0.42 -3.33 0.00 0.00 175.10 172.52 1nqt s THR 199 N -2.14 2.24 0.00 5.04 -4.23 -0.60 -4.66 115.64 111.28 1nqt s THR 199 Ca -0.08 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.77 1nqt s THR 199 Cb -0.02 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.92 1nqt s THR 199 CO -0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1nqt n GLY 200 N -1.31 0.75 3.90 3.99 0.00 -1.26 -4.36 105.19 106.89 1nqt n GLY 200 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1nqt n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nqt s LYS 201 N -0.49 2.20 0.42 1.61 -2.85 -1.26 -4.25 119.74 115.11 1nqt s LYS 201 Ca 0.00 0.18 -0.26 0.00 -1.00 0.00 0.00 55.97 54.89 1nqt s LYS 201 Cb 0.00 -1.98 -0.09 0.00 -2.06 0.00 0.00 37.83 33.70 1nqt s LYS 201 CO 0.00 -1.44 1.39 -2.14 0.10 0.00 0.00 175.35 173.26 1nqt s PRO 202 N -5.51 3.89 0.45 1.78 0.02 -1.26 -3.67 135.00 130.71 1nqt s PRO 202 Ca 0.61 2.34 0.13 0.00 0.02 0.00 0.00 61.00 64.10 1nqt s PRO 202 Cb -0.11 -2.77 1.04 0.00 0.02 0.00 0.00 34.50 32.69 1nqt s PRO 202 CO 0.49 -0.62 2.03 0.82 -0.33 0.00 0.00 177.00 179.40 1nqt h ILE 203 N 2.51 0.96 -0.26 2.83 1.08 -1.90 0.30 117.51 123.04 1nqt h ILE 203 Ca -0.50 -0.12 -0.05 0.00 -0.39 0.00 0.00 64.86 63.80 1nqt h ILE 203 Cb 1.25 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 35.56 1nqt h ILE 203 CO 0.62 0.07 -0.05 0.28 -0.69 0.00 0.00 178.15 178.38 1nqt h SER 204 N 0.36 0.37 -0.46 1.72 0.02 -1.92 -1.98 113.55 111.65 1nqt h SER 204 Ca 0.19 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1nqt h SER 204 Cb 0.31 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1nqt h SER 204 CO -0.05 0.48 0.00 0.00 -1.14 0.00 0.00 176.83 176.12 1nqt n GLN 205 N -4.28 2.27 0.00 3.45 1.13 0.75 -4.93 117.38 115.77 1nqt n GLN 205 Ca 0.00 -1.95 0.00 0.00 -1.94 0.00 0.00 57.00 53.12 1nqt n GLN 205 Cb 0.25 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 29.15 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 1.38 1.11 3.85 1.08 0.00 -0.49 -4.81 105.19 107.31 1nqt n GLY 206 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1nqt n GLY 206 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nqt s GLY 207 N -2.00 1.70 0.28 -0.02 0.00 0.60 -4.78 107.32 103.09 1nqt s GLY 207 Ca 0.00 -1.03 0.09 0.00 0.00 0.00 0.00 44.72 43.78 1nqt s GLY 207 CO 0.00 -0.28 0.09 -1.50 0.00 0.00 0.00 173.10 171.41 1nqt s ILE 208 N -3.62 3.62 -0.21 0.90 2.07 -1.26 -4.57 121.20 118.13 1nqt s ILE 208 Ca 0.71 -1.72 -0.22 0.00 -1.41 0.00 0.00 60.65 58.02 1nqt s ILE 208 Cb -0.07 -3.03 -0.02 0.00 0.13 0.00 0.00 42.46 39.47 1nqt s ILE 208 CO 0.53 -0.32 0.68 -1.00 -1.91 0.00 0.00 174.94 172.92 1nqt s HIS 209 N -2.30 3.35 0.00 3.50 3.76 -1.26 -3.96 115.29 118.39 1nqt s HIS 209 Ca 0.33 0.96 0.00 0.00 -0.15 0.00 0.00 55.06 56.21 1nqt s HIS 209 Cb -0.06 -2.86 0.00 0.00 1.11 0.00 0.00 32.58 30.77 1nqt s HIS 209 CO 0.22 -0.24 0.00 0.41 -0.85 0.00 0.00 174.74 174.28 1nqt n GLY 210 N 3.83 1.57 0.06 -2.22 0.00 -1.26 -3.70 105.19 103.47 1nqt n GLY 210 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1nqt n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nqt h ARG 211 N 0.00 -0.01 -0.10 1.61 2.43 -1.99 -2.99 114.38 113.33 1nqt h ARG 211 Ca 0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1nqt h ARG 211 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1nqt h ARG 211 CO 0.00 0.60 -0.06 0.82 -1.51 0.00 0.00 179.97 179.82 1nqt h ILE 212 N -0.63 0.00 -0.52 1.20 5.03 -1.95 -2.10 117.51 118.54 1nqt h ILE 212 Ca -0.00 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.81 1nqt h ILE 212 Cb 0.62 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 34.38 1nqt h ILE 212 CO 0.00 0.00 0.35 0.77 -0.68 0.00 0.00 178.15 178.59 1nqt h SER 213 N -0.00 0.37 -0.09 1.72 4.64 -2.01 -3.36 113.55 114.82 1nqt h SER 213 Ca 0.02 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1nqt h SER 213 Cb 0.04 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1nqt h SER 213 CO -0.10 0.24 -0.05 0.00 -0.87 0.00 0.00 176.83 176.05 1nqt n ALA 214 N -2.51 -0.06 -0.19 5.18 0.00 -0.79 0.17 120.51 122.31 1nqt n ALA 214 Ca 0.07 0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.70 1nqt n ALA 214 Cb 0.28 0.26 0.42 0.00 0.00 0.00 0.00 19.45 20.41 1nqt n ALA 214 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1nqt h THR 215 N 0.00 0.89 -0.03 0.00 2.02 -1.73 0.17 112.91 114.24 1nqt h THR 215 Ca 0.01 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1nqt h THR 215 Cb 0.04 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 1nqt h THR 215 CO -0.08 0.11 -0.07 1.23 0.37 0.00 0.00 175.52 177.08 1nqt h GLY 216 N 0.60 0.10 1.48 2.16 0.00 -0.94 -2.76 103.07 103.71 1nqt h GLY 216 Ca 0.36 -0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.58 1nqt h GLY 216 CO -0.13 0.12 0.33 3.21 0.00 0.00 0.00 176.54 180.06 1nqt h ARG 217 N -0.46 0.61 0.18 4.80 3.08 0.41 -1.89 114.38 121.11 1nqt h ARG 217 Ca -0.00 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.03 1nqt h ARG 217 Cb 0.67 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 1nqt h ARG 217 CO 0.01 0.40 -0.37 0.78 -1.07 0.00 0.00 179.97 179.73 1nqt h GLY 218 N 0.62 -0.76 1.05 0.04 0.00 -0.58 -0.36 103.07 103.08 1nqt h GLY 218 Ca 0.19 0.43 0.12 0.00 0.00 0.00 0.00 47.33 48.07 1nqt h GLY 218 CO -0.04 -0.27 0.36 -2.08 0.00 0.00 0.00 176.54 174.50 1nqt h VAL 219 N -0.64 0.57 0.22 4.60 2.07 -1.07 0.77 116.25 122.77 1nqt h VAL 219 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 1nqt h VAL 219 Cb 0.64 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1nqt h VAL 219 CO -0.18 0.00 -0.11 0.15 0.02 0.00 0.00 177.57 177.46 1nqt h PHE 220 N 0.00 -0.28 -0.34 1.57 -0.00 -0.49 -3.03 116.94 114.37 1nqt h PHE 220 Ca 0.20 -0.01 0.08 0.00 -0.00 0.00 0.00 57.97 58.24 1nqt h PHE 220 Cb 0.91 0.09 -0.08 0.00 -0.00 0.00 0.00 35.95 36.87 1nqt h PHE 220 CO 0.00 -0.17 -0.23 0.45 -0.00 0.00 0.00 178.31 178.36 1nqt h HIS 221 N -0.68 -0.60 -0.53 0.41 3.86 -0.81 -0.43 115.15 116.37 1nqt h HIS 221 Ca -0.03 0.04 0.05 0.00 -1.16 0.00 0.00 60.37 59.27 1nqt h HIS 221 Cb 0.23 0.32 -0.06 0.00 1.06 0.00 0.00 27.41 28.95 1nqt h HIS 221 CO 0.03 -0.31 -0.31 0.41 0.86 0.00 0.00 177.93 178.61 1nqt n GLY 222 N -1.38 -2.04 0.30 2.45 0.00 0.23 0.02 105.19 104.76 1nqt n GLY 222 Ca 0.01 0.75 -0.10 0.00 0.00 0.00 0.00 46.02 46.68 1nqt n GLY 222 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nqt h ILE 223 N 0.00 0.00 -0.82 -0.61 2.04 -1.16 -3.07 117.51 113.90 1nqt h ILE 223 Ca 0.08 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.18 1nqt h ILE 223 Cb 0.22 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.14 1nqt h ILE 223 CO -0.50 0.00 0.04 1.21 0.00 0.00 0.00 178.15 178.90 1nqt n GLU 224 N -4.26 -0.06 -0.20 2.37 2.13 0.93 0.00 120.64 121.54 1nqt n GLU 224 Ca -0.06 1.22 -0.07 0.00 0.66 0.00 0.00 57.16 58.92 1nqt n GLU 224 Cb 0.26 -1.95 0.03 0.00 0.27 0.00 0.00 31.44 30.05 1nqt n GLU 224 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1nqt h ASN 225 N 0.00 0.70 0.09 4.31 2.35 -0.31 -2.64 115.58 120.09 1nqt h ASN 225 Ca 0.51 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 56.04 1nqt h ASN 225 Cb 1.06 -0.18 0.02 0.00 0.05 0.00 0.00 38.32 39.27 1nqt h ASN 225 CO -0.76 0.56 -0.63 -0.26 -1.65 0.00 0.00 177.43 174.69 1nqt h PHE 226 N 0.79 0.46 0.00 1.19 -1.00 -0.45 -3.22 116.94 114.71 1nqt h PHE 226 Ca 0.21 -0.32 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1nqt h PHE 226 Cb -0.01 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.53 1nqt h PHE 226 CO -0.02 1.22 0.32 0.97 -1.61 0.00 0.00 178.31 179.18 1nqt h ILE 227 N -0.43 0.00 -0.17 -0.55 6.09 -0.73 0.39 117.51 122.11 1nqt h ILE 227 Ca -0.11 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.38 1nqt h ILE 227 Cb 1.46 0.34 0.00 0.00 0.47 0.00 0.00 36.82 39.09 1nqt h ILE 227 CO 0.12 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 175.79 1nqt n ASN 228 N -2.17 2.90 -4.51 2.19 3.02 -1.00 -4.70 115.26 110.98 1nqt n ASN 228 Ca -0.01 -1.87 -0.42 0.00 -0.03 0.00 0.00 54.58 52.25 1nqt n ASN 228 Cb 0.34 -0.10 -0.08 0.00 -0.61 0.00 0.00 39.78 39.32 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1nqt s GLU 229 N -1.49 3.31 0.12 3.52 2.56 0.14 -4.97 118.70 121.89 1nqt s GLU 229 Ca 0.28 -0.54 -0.34 0.00 0.00 0.00 0.00 54.97 54.37 1nqt s GLU 229 Cb 0.18 -3.90 -0.13 0.00 2.00 0.00 0.00 34.13 32.28 1nqt s GLU 229 CO 0.26 -0.76 1.55 0.00 -0.56 0.00 0.00 175.26 175.75 1nqt h ALA 230 N 8.64 -0.88 -1.64 6.30 0.00 -1.89 -1.03 119.26 128.75 1nqt h ALA 230 Ca -0.27 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1nqt h ALA 230 Cb 1.12 1.03 0.00 0.00 0.00 0.00 0.00 17.79 19.94 1nqt h ALA 230 CO 0.78 -1.09 0.00 0.43 0.00 0.00 0.00 179.25 179.37 1nqt n SER 231 N -5.41 0.00 -0.22 0.00 7.64 -1.26 -0.34 113.62 114.02 1nqt n SER 231 Ca -0.06 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1nqt n SER 231 Cb 0.37 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.65 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 -0.29 0.00 1.43 -1.99 -1.90 0.20 116.97 114.43 1nqt h TYR 232 Ca 0.00 0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1nqt h TYR 232 Cb 0.00 0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1nqt h TYR 232 CO 0.00 -0.27 0.00 -1.33 -0.00 0.00 0.00 178.16 176.56 1nqt n MET 233 N -5.42 0.33 -0.11 4.88 2.81 -0.34 -2.42 117.12 116.85 1nqt n MET 233 Ca 0.09 0.04 -0.22 0.00 -1.81 0.00 0.00 57.70 55.79 1nqt n MET 233 Cb 0.35 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.26 1nqt n MET 233 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1nqt n SER 234 N -1.06 1.88 -0.05 7.83 2.88 0.69 0.28 113.62 126.07 1nqt n SER 234 Ca 0.08 0.42 0.25 0.00 -1.33 0.00 0.00 58.87 58.29 1nqt n SER 234 Cb 0.05 -0.91 0.65 0.00 -0.75 0.00 0.00 64.21 63.25 1nqt n SER 234 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1nqt h ILE 235 N -1.00 0.23 0.00 2.46 1.08 -1.26 1.10 117.51 120.13 1nqt h ILE 235 Ca -0.39 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 63.95 1nqt h ILE 235 Cb 1.30 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 35.42 1nqt h ILE 235 CO -0.24 0.00 -2.03 0.18 -0.69 0.00 0.00 178.15 175.38 1nqt n LEU 236 N -3.57 0.00 -1.55 1.44 4.77 -1.12 -5.01 117.00 111.95 1nqt n LEU 236 Ca 0.14 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.11 1nqt n LEU 236 Cb 0.99 0.17 0.01 0.00 -2.33 0.00 0.00 43.42 42.26 1nqt n LEU 236 CO 0.27 0.17 0.01 0.61 -1.33 0.00 0.00 177.39 177.11 1nqt n GLY 237 N 1.57 0.61 0.00 -0.72 0.00 0.38 -5.09 105.19 101.95 1nqt n GLY 237 Ca -0.13 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1nqt n GLY 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nqt n MET 238 N -1.57 2.97 -3.34 1.61 2.00 0.79 -4.92 117.12 114.66 1nqt n MET 238 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.41 1nqt n MET 238 Cb 0.51 0.00 0.03 0.00 0.00 0.00 0.00 33.22 33.76 1nqt n MET 238 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1nqt n THR 239 N 0.00 -6.10 -3.60 2.03 5.66 -1.26 -4.81 114.28 106.20 1nqt n THR 239 Ca 0.00 0.27 -0.34 0.00 -3.05 0.00 0.00 64.05 60.93 1nqt n THR 239 Cb 0.00 -4.66 -0.05 0.00 -1.55 0.00 0.00 70.33 64.07 1nqt n THR 239 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1nqt s PRO 240 N -2.79 3.73 0.00 1.09 0.05 -1.26 -5.06 135.00 130.76 1nqt s PRO 240 Ca 0.29 0.12 0.19 0.00 0.05 0.00 0.00 61.00 61.66 1nqt s PRO 240 Cb -0.04 -2.98 0.40 0.00 0.05 0.00 0.00 34.50 31.93 1nqt s PRO 240 CO 0.85 0.55 1.33 0.41 0.05 0.00 0.00 177.00 180.18 1nqt n GLY 241 N 0.79 1.83 0.00 0.56 0.00 -1.26 -3.53 105.19 103.58 1nqt n GLY 241 Ca -0.07 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1nqt n GLY 241 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqt n PHE 242 N 1.23 0.00 0.46 1.61 7.35 -1.26 -4.82 117.46 122.02 1nqt n PHE 242 Ca 0.17 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.92 1nqt n PHE 242 Cb 0.54 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.29 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 2.54 -0.21 5.25 7.13 0.00 -1.26 -5.01 105.19 113.62 1nqt n GLY 243 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.40 0.00 -3.68 1.61 -0.08 -1.23 -4.45 116.55 107.32 1nqt n ASP 244 Ca 0.01 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.18 1nqt n ASP 244 Cb 0.21 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.58 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 0.59 -0.04 -0.67 1.02 -1.26 -4.18 119.74 115.20 1nqt s LYS 245 Ca 0.00 0.86 0.02 0.00 0.02 0.00 0.00 55.97 56.87 1nqt s LYS 245 Cb 0.00 0.20 0.01 0.00 -0.52 0.00 0.00 37.83 37.52 1nqt s LYS 245 CO 0.00 -0.11 -0.07 0.95 -0.92 0.00 0.00 175.35 175.20 1nqt s THR 246 N 0.83 0.71 0.04 2.17 -4.23 -1.26 -0.94 115.64 112.95 1nqt s THR 246 Ca -0.04 -0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.19 1nqt s THR 246 Cb -0.05 -0.67 -0.03 0.00 1.34 0.00 0.00 72.50 73.09 1nqt s THR 246 CO -0.07 0.25 -0.02 0.72 -0.54 0.00 0.00 174.62 174.96 1nqt s PHE 247 N 0.55 0.38 0.13 3.99 -0.71 0.87 -1.10 117.98 122.08 1nqt s PHE 247 Ca -0.08 -0.78 0.09 0.00 -1.04 0.00 0.00 56.93 55.11 1nqt s PHE 247 Cb -0.12 -0.28 -0.04 0.00 -1.21 0.00 0.00 43.02 41.37 1nqt s PHE 247 CO 0.01 -0.30 -0.20 0.08 -1.34 0.00 0.00 175.22 173.47 1nqt s VAL 248 N -2.72 1.79 -0.04 -2.49 1.01 -0.00 -1.62 120.40 116.34 1nqt s VAL 248 Ca -0.04 -1.70 0.01 0.00 0.00 0.00 0.00 61.98 60.24 1nqt s VAL 248 Cb -0.01 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.70 1nqt s VAL 248 CO -0.06 -0.15 -0.03 0.54 0.00 0.00 0.00 175.10 175.41 1nqt s VAL 249 N -1.49 0.39 -0.27 2.92 0.11 -1.17 -0.18 120.40 120.70 1nqt s VAL 249 Ca 0.10 -0.04 -0.10 0.00 -2.93 0.00 0.00 61.98 59.02 1nqt s VAL 249 Cb -0.08 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1nqt s VAL 249 CO 0.05 0.19 0.14 -1.58 -3.33 0.00 0.00 175.10 170.58 1nqt s GLN 250 N 0.93 3.78 0.00 1.54 -0.44 -1.07 -1.99 119.66 122.41 1nqt s GLN 250 Ca -0.11 -0.42 0.00 0.00 -2.50 0.00 0.00 55.36 52.33 1nqt s GLN 250 Cb -0.14 -3.53 0.00 0.00 -1.64 0.00 0.00 33.01 27.70 1nqt s GLN 250 CO -0.00 -0.21 0.00 0.41 0.50 0.00 0.00 175.29 175.99 1nqt n GLY 251 N 5.00 0.73 2.28 2.59 0.00 0.47 -0.59 105.19 115.68 1nqt n GLY 251 Ca -0.15 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 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 1.06 -0.71 1.61 -0.00 -1.24 -3.85 117.46 114.34 1nqt n PHE 252 Ca 0.00 -1.97 0.00 0.00 -0.00 0.00 0.00 57.45 55.48 1nqt n PHE 252 Cb 0.00 -1.79 0.00 0.00 -0.00 0.00 0.00 39.48 37.69 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 3.17 1.52 0.00 7.13 0.00 -1.26 -4.69 105.19 111.06 1nqt n GLY 253 Ca 0.51 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.81 115.26 118.63 1nqt n ASN 254 Ca 0.00 0.75 0.02 0.00 -0.60 0.00 0.00 54.58 54.75 1nqt n ASN 254 Cb 0.00 -0.36 0.08 0.00 -0.53 0.00 0.00 39.78 38.97 1nqt n ASN 254 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 1nqt n VAL 255 N -1.57 -0.39 0.04 3.44 3.14 -1.26 -0.17 118.33 121.56 1nqt n VAL 255 Ca 0.00 1.94 -0.12 0.00 -2.96 0.00 0.00 64.34 63.20 1nqt n VAL 255 Cb 0.00 -2.63 -0.07 0.00 -1.06 0.00 0.00 33.84 30.08 1nqt n VAL 255 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1nqt h GLY 256 N 0.00 0.00 0.01 7.55 0.00 -1.67 0.74 103.07 109.71 1nqt h GLY 256 Ca 0.35 -0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 1nqt h GLY 256 CO -0.85 0.00 -0.01 -2.00 0.00 0.00 0.00 176.54 173.68 1nqt h LEU 257 N -0.03 -0.04 -0.68 3.11 5.85 0.24 -0.61 115.31 123.16 1nqt h LEU 257 Ca 0.00 0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.86 1nqt h LEU 257 Cb 0.03 0.01 -0.13 0.00 0.37 0.00 0.00 40.66 40.94 1nqt h LEU 257 CO -0.00 -0.02 -0.20 0.45 -0.34 0.00 0.00 178.44 178.33 1nqt h HIS 258 N -0.02 -0.47 -0.79 1.25 3.86 -1.25 0.71 115.15 118.44 1nqt h HIS 258 Ca -0.00 0.06 0.15 0.00 -1.16 0.00 0.00 60.37 59.42 1nqt h HIS 258 Cb 0.02 0.31 -0.15 0.00 1.06 0.00 0.00 27.41 28.66 1nqt h HIS 258 CO -0.18 -0.32 -0.28 0.77 0.86 0.00 0.00 177.93 178.78 1nqt h SER 259 N -0.03 -1.01 -0.38 2.45 0.02 -0.52 0.89 113.55 114.97 1nqt h SER 259 Ca 0.32 0.25 0.04 0.00 -0.84 0.00 0.00 61.79 61.56 1nqt h SER 259 Cb 0.52 0.58 -0.04 0.00 0.14 0.00 0.00 62.40 63.60 1nqt h SER 259 CO -0.72 -0.28 0.15 -0.03 -1.14 0.00 0.00 176.83 174.81 1nqt h MET 260 N -0.05 0.31 -0.00 3.45 -1.53 0.19 -0.31 114.93 116.99 1nqt h MET 260 Ca 0.34 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.58 1nqt h MET 260 Cb 0.59 -0.07 -0.00 0.00 -0.55 0.00 0.00 31.60 31.56 1nqt h MET 260 CO -0.83 0.20 -0.04 -0.09 0.14 0.00 0.00 176.91 176.29 1nqt h ARG 261 N 0.32 -0.05 -0.07 0.39 2.43 0.28 0.11 114.38 117.79 1nqt h ARG 261 Ca 0.17 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.38 1nqt h ARG 261 Cb 0.13 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1nqt h ARG 261 CO -0.16 -0.03 -0.22 1.88 -1.51 0.00 0.00 179.97 179.93 1nqt h TYR 262 N -0.05 -0.59 -0.43 2.20 0.05 -0.77 0.97 116.97 118.36 1nqt h TYR 262 Ca 0.00 0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.89 1nqt h TYR 262 Cb 0.05 0.27 -0.09 0.00 1.01 0.00 0.00 36.73 37.97 1nqt h TYR 262 CO -0.40 -0.31 -0.26 -0.07 -1.05 0.00 0.00 178.16 176.07 1nqt h LEU 263 N -0.32 -0.88 -0.02 3.88 -0.00 -1.00 -2.38 115.31 114.60 1nqt h LEU 263 Ca 0.08 0.18 0.01 0.00 -0.00 0.00 0.00 57.88 58.15 1nqt h LEU 263 Cb 0.43 0.44 -0.01 0.00 -0.00 0.00 0.00 40.66 41.53 1nqt h LEU 263 CO -0.25 -0.28 -0.03 -0.74 -0.00 0.00 0.00 178.44 177.15 1nqt h HIS 264 N -0.18 -0.06 0.00 1.13 2.76 -0.37 -1.30 115.15 117.13 1nqt h HIS 264 Ca 0.20 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 1nqt h HIS 264 Cb 0.49 0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.48 1nqt h HIS 264 CO -0.50 -0.04 0.00 -2.13 -1.30 0.00 0.00 177.93 173.96 1nqt n ARG 265 N -5.13 0.00 -0.38 5.26 0.63 0.28 -1.29 116.66 116.02 1nqt n ARG 265 Ca -0.06 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.90 1nqt n ARG 265 Cb 0.07 -1.10 0.05 0.00 0.45 0.00 0.00 32.46 31.92 1nqt n ARG 265 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1nqt n PHE 266 N -0.58 0.00 0.00 -0.14 3.72 -0.50 -5.02 117.46 114.94 1nqt n PHE 266 Ca 0.00 -0.33 0.00 0.00 -0.05 0.00 0.00 57.45 57.07 1nqt n PHE 266 Cb 0.00 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 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 -0.44 2.68 3.53 1.37 0.00 -0.41 -5.07 105.19 106.84 1nqt n GLY 267 Ca 0.05 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 1nqt n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 268 N 0.00 -1.73 -3.98 4.61 0.00 -1.18 -4.66 120.51 113.58 1nqt n ALA 268 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 53.44 52.59 1nqt n ALA 268 Cb 0.00 -1.98 -0.16 0.00 0.00 0.00 0.00 19.45 17.31 1nqt n ALA 268 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nqt s LYS 269 N -4.00 1.95 -0.41 0.00 2.20 -0.12 -4.41 119.74 114.96 1nqt s LYS 269 Ca 0.62 -0.68 -0.29 0.00 -0.36 0.00 0.00 55.97 55.26 1nqt s LYS 269 Cb -0.23 -2.22 0.01 0.00 -1.51 0.00 0.00 37.83 33.88 1nqt s LYS 269 CO 0.62 -0.38 1.29 0.00 -0.36 0.00 0.00 175.35 176.53 1nqt n ILE 271 N 6.78 0.20 -3.58 0.00 3.06 -0.64 -1.07 119.36 124.11 1nqt n ILE 271 Ca 0.15 -0.36 -0.14 0.00 -2.50 0.00 0.00 62.75 59.89 1nqt n ILE 271 Cb 0.48 0.09 -0.06 0.00 0.54 0.00 0.00 39.64 40.69 1nqt n ILE 271 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1nqt s ALA 272 N -3.31 -1.33 -0.25 1.51 0.00 -1.26 -1.62 121.76 115.50 1nqt s ALA 272 Ca -0.00 0.64 -0.03 0.00 0.00 0.00 0.00 51.96 52.56 1nqt s ALA 272 Cb 0.13 0.33 0.14 0.00 0.00 0.00 0.00 23.12 23.73 1nqt s ALA 272 CO 0.83 -0.48 0.45 0.08 0.00 0.00 0.00 175.76 176.65 1nqt s VAL 273 N -2.28 -0.73 0.06 0.00 1.01 -1.11 -3.07 120.40 114.28 1nqt s VAL 273 Ca -0.06 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 61.97 1nqt s VAL 273 Cb -0.01 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1nqt s VAL 273 CO -0.00 -0.05 -0.10 -0.83 0.00 0.00 0.00 175.10 174.11 1nqt s GLY 274 N 2.65 1.75 0.10 4.51 0.00 -0.84 -2.40 107.32 113.08 1nqt s GLY 274 Ca 0.11 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1nqt s GLY 274 CO -0.17 -1.09 0.00 1.18 0.00 0.00 0.00 173.10 173.03 1nqt n GLU 275 N 1.12 1.65 0.13 2.90 -0.58 -0.75 0.18 120.64 125.29 1nqt n GLU 275 Ca -0.14 -0.76 0.12 0.00 -0.42 0.00 0.00 57.16 55.96 1nqt n GLU 275 Cb 0.52 0.22 0.49 0.00 -0.57 0.00 0.00 31.44 32.11 1nqt n GLU 275 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1nqt n SER 276 N -1.16 0.70 -0.00 1.62 3.41 -1.26 -3.15 113.62 113.79 1nqt n SER 276 Ca -0.04 0.67 0.07 0.00 -0.26 0.00 0.00 58.87 59.30 1nqt n SER 276 Cb 0.13 -0.82 -0.08 0.00 -0.26 0.00 0.00 64.21 63.18 1nqt n SER 276 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1nqt n ASP 277 N -2.27 0.79 0.00 4.04 5.75 -1.26 -5.10 116.55 118.51 1nqt n ASP 277 Ca 0.02 -0.73 0.00 0.00 -0.01 0.00 0.00 54.79 54.08 1nqt n ASP 277 Cb 0.24 1.08 0.00 0.00 -1.03 0.00 0.00 41.12 41.41 1nqt n ASP 277 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nqt n GLY 278 N 1.37 -0.74 3.54 6.12 0.00 -1.19 -5.06 105.19 109.24 1nqt n GLY 278 Ca 0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 1nqt n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt s SER 279 N -4.00 -0.37 0.22 1.61 0.01 -1.26 -1.81 113.70 108.10 1nqt s SER 279 Ca 0.00 0.19 0.11 0.00 1.31 0.00 0.00 55.95 57.56 1nqt s SER 279 Cb 0.00 0.35 -0.05 0.00 0.21 0.00 0.00 66.02 66.54 1nqt s SER 279 CO 0.00 -0.50 -0.22 -0.63 0.41 0.00 0.00 173.24 172.30 1nqt s ILE 280 N -2.23 2.34 0.19 1.44 1.01 -1.01 -1.46 121.20 121.48 1nqt s ILE 280 Ca 0.02 -2.13 -0.07 0.00 0.00 0.00 0.00 60.65 58.47 1nqt s ILE 280 Cb -0.01 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 1nqt s ILE 280 CO -0.04 -0.22 0.25 0.86 0.00 0.00 0.00 174.94 175.79 1nqt s TRP 281 N -1.95 0.65 0.00 3.97 -0.11 -0.73 -2.76 118.94 118.01 1nqt s TRP 281 Ca 0.23 -0.98 0.00 0.00 1.22 0.00 0.00 56.10 56.57 1nqt s TRP 281 Cb -0.07 -0.20 0.00 0.00 -1.50 0.00 0.00 33.47 31.70 1nqt s TRP 281 CO 0.11 -0.73 0.00 -1.71 -4.62 0.00 0.00 176.95 170.00 1nqt n ASN 282 N -0.24 0.00 0.11 5.86 2.85 -0.64 -2.68 115.26 120.51 1nqt n ASN 282 Ca -0.03 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.46 1nqt n ASN 282 Cb 0.64 0.00 0.12 0.00 1.24 0.00 0.00 39.78 41.78 1nqt n ASN 282 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1nqt n PRO 283 N 0.00 0.04 -0.34 1.20 -0.02 -1.26 -0.18 135.00 134.44 1nqt n PRO 283 Ca 0.00 0.40 0.12 0.00 -2.02 0.00 0.00 63.50 61.99 1nqt n PRO 283 Cb 0.00 -2.07 0.30 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.65 3.88 0.00 2.55 10.43 -1.26 -5.00 116.55 125.50 1nqt n ASP 284 Ca -0.00 -2.00 0.00 0.00 2.57 0.00 0.00 54.79 55.36 1nqt n ASP 284 Cb 0.46 -0.44 0.00 0.00 1.84 0.00 0.00 41.12 42.98 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 0.85 3.44 0.44 0.00 0.75 -5.07 105.19 107.23 1nqt n GLY 285 Ca 0.24 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 1nqt n GLY 285 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 286 N -1.28 2.67 -0.24 -0.61 1.01 -0.23 -4.98 121.20 117.53 1nqt s ILE 286 Ca 0.00 -1.23 -0.11 0.00 0.00 0.00 0.00 60.65 59.31 1nqt s ILE 286 Cb 0.00 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 1nqt s ILE 286 CO 0.00 0.34 0.18 -0.62 0.00 0.00 0.00 174.94 174.84 1nqt s ASP 287 N -1.41 6.13 0.00 3.58 2.15 -1.26 -4.52 116.67 121.35 1nqt s ASP 287 Ca 0.14 0.13 0.00 0.00 0.43 0.00 0.00 52.55 53.26 1nqt s ASP 287 Cb -0.10 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.40 1nqt s ASP 287 CO 0.05 0.05 0.85 -2.65 -0.17 0.00 0.00 175.17 173.30 1nqt n PRO 288 N 4.36 0.00 -0.26 4.34 -0.02 -1.26 -1.55 135.00 140.60 1nqt n PRO 288 Ca -0.14 0.69 -0.05 0.00 -2.02 0.00 0.00 63.50 61.97 1nqt n PRO 288 Cb 0.52 -1.35 -0.04 0.00 -0.02 0.00 0.00 33.50 32.61 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 -2.13 -0.24 0.00 -0.52 3.00 -1.26 -0.25 118.16 116.76 1nqt n LYS 289 Ca 0.00 0.98 -0.01 0.00 -0.00 0.00 0.00 58.31 59.28 1nqt n LYS 289 Cb 0.00 -1.44 -0.01 0.00 0.00 0.00 0.00 35.03 33.58 1nqt n LYS 289 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1nqt h GLU 290 N 0.00 -0.05 -0.81 1.64 5.08 -1.87 -0.05 114.58 118.53 1nqt h GLU 290 Ca 0.14 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.66 1nqt h GLU 290 Cb 0.30 0.01 -0.15 0.00 0.50 0.00 0.00 28.75 29.41 1nqt h GLU 290 CO -0.62 -0.03 -0.26 1.25 -1.00 0.00 0.00 179.01 178.35 1nqt h LEU 291 N -0.05 -0.94 -0.23 1.33 5.85 0.14 -0.56 115.31 120.84 1nqt h LEU 291 Ca 0.00 0.25 0.06 0.00 0.84 0.00 0.00 57.88 59.03 1nqt h LEU 291 Cb 0.05 0.56 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 1nqt h LEU 291 CO -0.03 -0.28 -0.32 -0.08 -0.34 0.00 0.00 178.44 177.38 1nqt h GLU 292 N -0.03 -0.33 0.37 1.25 4.81 -0.05 0.42 114.58 121.01 1nqt h GLU 292 Ca 0.36 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1nqt h GLU 292 Cb 0.59 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1nqt h GLU 292 CO -0.84 -0.22 -0.38 -0.44 -0.73 0.00 0.00 179.01 176.40 1nqt h ASP 293 N -0.34 -1.05 0.00 1.04 3.32 0.31 -1.22 116.42 118.47 1nqt h ASP 293 Ca 0.12 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1nqt h ASP 293 Cb 0.54 0.35 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1nqt h ASP 293 CO -0.42 -0.50 0.00 0.33 -1.72 0.00 0.00 179.24 176.93 1nqt n PHE 294 N -4.71 0.00 -0.28 4.55 7.35 -0.35 0.26 117.46 124.28 1nqt n PHE 294 Ca -0.09 0.00 0.25 0.00 -0.76 0.00 0.00 57.45 56.85 1nqt n PHE 294 Cb 0.35 -0.02 0.43 0.00 0.35 0.00 0.00 39.48 40.58 1nqt n PHE 294 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 1nqt n LYS 295 N -0.93 -0.03 -0.00 -4.13 3.00 0.08 -0.18 118.16 115.97 1nqt n LYS 295 Ca 0.00 0.84 -0.02 0.00 -0.00 0.00 0.00 58.31 59.13 1nqt n LYS 295 Cb 0.00 -1.61 -0.01 0.00 0.00 0.00 0.00 35.03 33.41 1nqt n LYS 295 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1nqt h LEU 296 N 0.00 -0.09 -1.24 3.14 7.12 0.49 -3.35 115.31 121.38 1nqt h LEU 296 Ca 0.57 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.55 1nqt h LEU 296 Cb 1.74 0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.90 1nqt h LEU 296 CO -0.35 0.41 0.55 -0.61 -0.13 0.00 0.00 178.44 178.30 1nqt h GLN 297 N -1.03 0.00 -0.28 1.25 4.15 0.30 -3.39 115.11 116.12 1nqt h GLN 297 Ca -0.01 0.00 0.24 0.00 0.77 0.00 0.00 58.65 59.65 1nqt h GLN 297 Cb 0.11 0.00 -0.21 0.00 0.21 0.00 0.00 27.48 27.59 1nqt h GLN 297 CO 0.02 0.00 0.12 -3.38 -1.93 0.00 0.00 178.83 173.66 1nqt s HIS 298 N -3.97 -0.46 0.00 3.99 -3.43 -0.96 -5.08 115.29 105.38 1nqt s HIS 298 Ca -0.02 0.44 0.00 0.00 -0.80 0.00 0.00 55.06 54.68 1nqt s HIS 298 Cb 0.05 0.14 0.00 0.00 -1.43 0.00 0.00 32.58 31.35 1nqt s HIS 298 CO 0.17 -0.26 0.00 0.41 -2.00 0.00 0.00 174.74 173.06 1nqt n GLY 299 N 5.40 0.35 3.14 -1.38 0.00 -1.26 -4.71 105.19 106.74 1nqt n GLY 299 Ca -0.04 0.63 -0.12 0.00 0.00 0.00 0.00 46.02 46.49 1nqt n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nqt s SER 300 N -4.00 1.12 0.00 1.61 1.04 -1.26 -4.88 113.70 107.33 1nqt s SER 300 Ca 0.00 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.58 1nqt s SER 300 Cb 0.00 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1nqt s SER 300 CO 0.00 -0.36 0.16 2.30 0.98 0.00 0.00 173.24 176.31 1nqt n ILE 301 N 0.45 0.00 -3.03 -1.02 -5.35 -1.26 -4.68 119.36 104.47 1nqt n ILE 301 Ca -0.16 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 61.91 1nqt n ILE 301 Cb 0.59 -0.73 -0.06 0.00 -1.74 0.00 0.00 39.64 37.70 1nqt n ILE 301 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1nqt s LEU 302 N -1.14 4.14 0.00 7.28 1.02 -1.26 -3.73 118.68 124.99 1nqt s LEU 302 Ca 0.00 0.44 0.00 0.00 0.02 0.00 0.00 54.13 54.59 1nqt s LEU 302 Cb 0.00 -2.94 0.00 0.00 0.02 0.00 0.00 46.19 43.27 1nqt s LEU 302 CO 0.00 -0.59 0.00 0.61 0.02 0.00 0.00 176.35 176.39 1nqt n GLY 303 N 4.42 0.96 3.81 -3.19 0.00 -1.26 -5.10 105.19 104.82 1nqt n GLY 303 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1nqt n GLY 303 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nqt s PHE 304 N -1.87 3.75 0.00 1.61 5.36 -1.24 -5.08 117.98 120.52 1nqt s PHE 304 Ca 0.00 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 57.13 1nqt s PHE 304 Cb 0.00 -2.45 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 1nqt s PHE 304 CO 0.00 0.56 0.00 -2.30 -1.46 0.00 0.00 175.22 172.02 1nqt n PRO 305 N 1.97 -0.56 -1.68 10.12 -0.02 -1.26 -3.63 135.00 139.94 1nqt n PRO 305 Ca -0.11 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.31 1nqt n PRO 305 Cb 0.51 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.98 1nqt n PRO 305 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1nqt n LYS 306 N -1.06 -1.28 -3.60 -0.52 5.02 -1.26 -4.73 118.16 110.72 1nqt n LYS 306 Ca 0.00 0.02 -0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1nqt n LYS 306 Cb 0.00 -1.35 -0.06 0.00 -0.02 0.00 0.00 35.03 33.60 1nqt n LYS 306 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt s ALA 307 N -1.07 -2.47 -0.09 7.82 0.00 -1.24 -4.93 121.76 119.78 1nqt s ALA 307 Ca 0.11 2.11 -0.19 0.00 0.00 0.00 0.00 51.96 53.99 1nqt s ALA 307 Cb -0.07 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 1nqt s ALA 307 CO 0.14 -0.42 0.53 0.21 0.00 0.00 0.00 175.76 176.22 1nqt s LYS 308 N 1.40 4.35 0.54 0.00 2.47 -1.09 -4.60 119.74 122.80 1nqt s LYS 308 Ca -0.08 0.57 -0.21 0.00 -1.56 0.00 0.00 55.97 54.69 1nqt s LYS 308 Cb -0.03 -3.42 -0.06 0.00 -1.46 0.00 0.00 37.83 32.85 1nqt s LYS 308 CO -0.14 0.17 1.09 -2.30 0.16 0.00 0.00 175.35 174.33 1nqt n PRO 309 N 3.55 1.25 -4.44 4.03 -0.02 -1.26 -1.77 135.00 136.34 1nqt n PRO 309 Ca -0.06 0.47 -0.25 0.00 -2.02 0.00 0.00 63.50 61.63 1nqt n PRO 309 Cb 0.51 -2.25 -0.11 0.00 -0.02 0.00 0.00 33.50 31.64 1nqt n PRO 309 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1nqt s TYR 310 N -1.39 2.32 -0.23 6.00 5.04 -0.53 -4.81 117.35 123.75 1nqt s TYR 310 Ca 0.71 -0.34 -0.06 0.00 -2.44 0.00 0.00 57.07 54.94 1nqt s TYR 310 Cb -0.45 -1.08 -0.02 0.00 0.35 0.00 0.00 41.96 40.76 1nqt s TYR 310 CO 0.50 0.60 0.03 -2.00 -1.34 0.00 0.00 175.55 173.34 1nqt s GLU 311 N -3.08 3.58 0.00 4.97 2.56 -1.26 -4.06 118.70 121.40 1nqt s GLU 311 Ca 0.25 -0.52 0.00 0.00 0.00 0.00 0.00 54.97 54.70 1nqt s GLU 311 Cb -0.07 -3.19 0.00 0.00 2.00 0.00 0.00 34.13 32.87 1nqt s GLU 311 CO 0.13 -0.15 0.00 0.41 -0.56 0.00 0.00 175.26 175.09 1nqt n GLY 312 N 4.74 -0.15 2.58 -1.50 0.00 -1.26 -4.99 105.19 104.61 1nqt n GLY 312 Ca -0.17 -1.84 -0.20 0.00 0.00 0.00 0.00 46.02 43.82 1nqt n GLY 312 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nqt n SER 313 N 0.00 0.05 -0.01 1.61 7.64 -1.26 -4.36 113.62 117.29 1nqt n SER 313 Ca 0.00 -1.32 0.03 0.00 1.01 0.00 0.00 58.87 58.60 1nqt n SER 313 Cb 0.00 -0.68 -0.04 0.00 -1.01 0.00 0.00 64.21 62.48 1nqt n SER 313 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1nqt n ILE 314 N -3.24 0.00 -0.33 0.44 -0.00 -1.26 -4.69 119.36 110.29 1nqt n ILE 314 Ca 0.11 -0.34 0.26 0.00 -0.00 0.00 0.00 62.75 62.78 1nqt n ILE 314 Cb 0.39 1.00 0.49 0.00 -0.00 0.00 0.00 39.64 41.52 1nqt n ILE 314 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1nqt h LEU 315 N 0.04 0.14 0.00 7.28 4.07 -1.96 0.95 115.31 125.83 1nqt h LEU 315 Ca 0.00 0.25 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1nqt h LEU 315 Cb 0.17 0.31 0.00 0.00 1.08 0.00 0.00 40.66 42.21 1nqt h LEU 315 CO 0.00 -0.37 -0.36 -0.62 -1.08 0.00 0.00 178.44 176.00 1nqt n GLU 316 N -5.29 0.08 -1.19 1.13 1.02 -1.26 -4.48 120.64 110.65 1nqt n GLU 316 Ca 0.33 0.03 -0.37 0.00 -0.02 0.00 0.00 57.16 57.13 1nqt n GLU 316 Cb 1.10 -1.56 0.04 0.00 -0.02 0.00 0.00 31.44 31.01 1nqt n GLU 316 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nqt n ALA 317 N -1.59 -3.03 -2.56 0.62 0.00 0.33 -4.11 120.51 110.18 1nqt n ALA 317 Ca 0.05 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.80 1nqt n ALA 317 Cb 0.36 -1.52 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 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 -1.19 6.43 0.00 0.00 2.15 -1.26 -4.21 116.67 118.59 1nqt s ASP 318 Ca 0.56 0.03 0.00 0.00 0.43 0.00 0.00 52.55 53.58 1nqt s ASP 318 Cb -0.36 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 1nqt s ASP 318 CO 0.67 -0.76 0.00 0.00 -0.17 0.00 0.00 175.17 174.91 1nqt n ASP 320 N -0.68 1.71 -4.53 0.00 10.43 -0.26 -4.10 116.55 119.11 1nqt n ASP 320 Ca 0.00 0.28 -0.36 0.00 2.57 0.00 0.00 54.79 57.28 1nqt n ASP 320 Cb 0.00 -0.65 -0.11 0.00 1.84 0.00 0.00 41.12 42.19 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 -2.64 4.68 -0.20 0.53 1.01 -0.76 -1.29 121.20 122.53 1nqt s ILE 321 Ca -0.25 -0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 1nqt s ILE 321 Cb 0.05 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 1nqt s ILE 321 CO 0.35 0.34 0.00 -0.22 0.00 0.00 0.00 174.94 175.42 1nqt s LEU 322 N 1.36 3.29 -0.62 2.97 0.20 0.62 -0.82 118.68 125.68 1nqt s LEU 322 Ca 0.06 -0.19 0.03 0.00 0.69 0.00 0.00 54.13 54.72 1nqt s LEU 322 Cb -0.15 -1.83 0.15 0.00 -0.43 0.00 0.00 46.19 43.93 1nqt s LEU 322 CO 0.05 0.07 0.40 -0.63 -0.29 0.00 0.00 176.35 175.95 1nqt s ILE 323 N 0.97 3.01 -0.52 6.68 1.01 0.74 -0.27 121.20 132.82 1nqt s ILE 323 Ca 0.02 -3.58 -0.26 0.00 0.00 0.00 0.00 60.65 56.83 1nqt s ILE 323 Cb -0.14 -3.01 -0.07 0.00 0.01 0.00 0.00 42.46 39.25 1nqt s ILE 323 CO 0.02 -0.89 2.35 -2.84 0.00 0.00 0.00 174.94 173.57 1nqt s PRO 324 N -0.67 2.13 -0.59 2.79 0.02 -1.20 -2.59 135.00 134.89 1nqt s PRO 324 Ca 0.20 1.28 0.04 0.00 0.02 0.00 0.00 61.00 62.54 1nqt s PRO 324 Cb -0.18 -4.57 0.37 0.00 0.02 0.00 0.00 34.50 30.14 1nqt s PRO 324 CO -0.06 -3.27 1.15 0.00 -0.33 0.00 0.00 177.00 174.49 1nqt n ALA 325 N 15.69 5.06 -2.01 -1.55 0.00 0.25 -0.26 120.51 137.68 1nqt n ALA 325 Ca 0.35 -4.53 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1nqt n ALA 325 Cb 0.54 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.12 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 -0.33 0.00 -0.92 0.00 0.00 -1.25 -4.41 120.51 113.61 1nqt n ALA 326 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1nqt n ALA 326 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1nqt n ALA 326 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nqt n SER 327 N 0.00 0.00 -3.71 0.00 3.41 -1.26 -4.70 113.62 107.35 1nqt n SER 327 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 1nqt n SER 327 Cb 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.78 1nqt n SER 327 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1nqt s GLU 328 N 0.00 -0.04 -0.40 4.33 2.12 -1.26 -4.71 118.70 118.75 1nqt s GLU 328 Ca 0.00 0.29 -0.00 0.00 0.36 0.00 0.00 54.97 55.62 1nqt s GLU 328 Cb 0.00 -0.42 -0.00 0.00 0.26 0.00 0.00 34.13 33.96 1nqt s GLU 328 CO 0.00 -0.26 0.34 1.63 -0.54 0.00 0.00 175.26 176.42 1nqt n LYS 329 N 4.85 -1.95 0.10 4.30 5.02 -0.27 -4.96 118.16 125.24 1nqt n LYS 329 Ca -0.13 0.29 0.12 0.00 -2.02 0.00 0.00 58.31 56.57 1nqt n LYS 329 Cb 0.50 -3.51 0.07 0.00 -0.02 0.00 0.00 35.03 32.07 1nqt n LYS 329 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1nqt h GLN 330 N -0.59 0.00 -4.98 1.97 1.08 -1.08 -3.43 115.11 108.08 1nqt h GLN 330 Ca -0.20 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 56.33 1nqt h GLN 330 Cb 1.11 0.00 -0.34 0.00 -0.05 0.00 0.00 27.48 28.21 1nqt h GLN 330 CO 0.17 0.00 -0.80 -0.51 -0.95 0.00 0.00 178.83 176.73 1nqt s LEU 331 N -4.99 2.72 0.34 1.46 1.43 0.30 -5.01 118.68 114.93 1nqt s LEU 331 Ca 0.03 -0.80 0.04 0.00 -1.03 0.00 0.00 54.13 52.36 1nqt s LEU 331 Cb 0.11 -1.57 -0.06 0.00 0.03 0.00 0.00 46.19 44.69 1nqt s LEU 331 CO 0.76 -0.07 0.06 0.42 0.23 0.00 0.00 176.35 177.75 1nqt s THR 332 N 1.29 1.14 0.41 5.49 -4.23 -1.26 -1.53 115.64 116.95 1nqt s THR 332 Ca 0.02 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.77 1nqt s THR 332 Cb -0.15 -2.74 0.43 0.00 1.34 0.00 0.00 72.50 71.38 1nqt s THR 332 CO -0.08 0.00 1.64 0.50 -0.54 0.00 0.00 174.62 176.14 1nqt h LYS 333 N 2.06 0.14 0.39 3.99 3.64 -1.90 0.10 116.57 125.00 1nqt h LYS 333 Ca -0.40 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.95 1nqt h LYS 333 Cb 1.25 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1nqt h LYS 333 CO 0.69 0.10 -0.19 1.03 -2.27 0.00 0.00 179.45 178.81 1nqt h SER 334 N 0.15 -0.44 0.60 4.20 0.87 -1.97 -3.35 113.55 113.60 1nqt h SER 334 Ca 0.79 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 61.25 1nqt h SER 334 Cb 2.27 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 64.34 1nqt h SER 334 CO -0.48 -0.00 -0.36 -0.46 -0.53 0.00 0.00 176.83 174.99 1nqt n ASN 335 N -5.14 0.41 -0.08 6.23 2.04 -0.96 -4.33 115.26 113.43 1nqt n ASN 335 Ca -0.08 -0.12 0.26 0.00 -0.44 0.00 0.00 54.58 54.19 1nqt n ASN 335 Cb 0.26 0.06 0.71 0.00 -2.53 0.00 0.00 39.78 38.29 1nqt n ASN 335 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nqt h ALA 336 N 3.05 2.58 -0.02 -2.53 0.00 -1.13 -0.20 119.26 121.03 1nqt h ALA 336 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1nqt h ALA 336 Cb 0.49 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1nqt h ALA 336 CO 0.00 -1.00 -0.32 -2.30 0.00 0.00 0.00 179.25 175.63 1nqt n PRO 337 N -3.96 1.29 -0.68 0.00 -0.02 -1.26 -4.03 135.00 126.34 1nqt n PRO 337 Ca 0.15 -0.98 0.09 0.00 -2.02 0.00 0.00 63.50 60.74 1nqt n PRO 337 Cb 0.89 -1.48 0.37 0.00 -0.02 0.00 0.00 33.50 33.26 1nqt n PRO 337 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nqt n ARG 338 N 0.00 3.98 -3.36 -0.52 1.74 -0.09 -4.94 116.66 113.48 1nqt n ARG 338 Ca 0.11 -2.93 -0.38 0.00 -0.77 0.00 0.00 57.85 53.88 1nqt n ARG 338 Cb 0.44 -1.98 -0.06 0.00 -1.02 0.00 0.00 32.46 29.85 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 -2.03 5.08 -1.85 1.55 -7.23 -1.23 -4.66 120.40 110.03 1nqt s VAL 339 Ca 0.52 0.96 0.27 0.00 -1.81 0.00 0.00 61.98 61.92 1nqt s VAL 339 Cb 0.35 -3.80 0.31 0.00 0.56 0.00 0.00 36.38 33.80 1nqt s VAL 339 CO 0.23 0.43 1.60 0.29 -0.31 0.00 0.00 175.10 177.33 1nqt n LYS 340 N 2.91 0.94 -1.85 4.82 4.76 -1.26 -4.93 118.16 123.55 1nqt n LYS 340 Ca -0.09 -0.55 -0.31 0.00 -2.87 0.00 0.00 58.31 54.49 1nqt n LYS 340 Cb 0.52 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 32.23 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 -2.44 2.99 -0.74 7.82 0.00 -1.26 -4.38 121.76 123.76 1nqt s ALA 341 Ca 0.26 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1nqt s ALA 341 Cb 0.19 -3.11 0.07 0.00 0.00 0.00 0.00 23.12 20.27 1nqt s ALA 341 CO 0.49 -0.77 0.76 1.63 0.00 0.00 0.00 175.76 177.87 1nqt n LYS 342 N -2.71 0.30 -3.68 0.00 4.76 -0.41 -4.96 118.16 111.46 1nqt n LYS 342 Ca 0.06 -1.00 -0.13 0.00 -2.87 0.00 0.00 58.31 54.38 1nqt n LYS 342 Cb 0.54 -1.12 -0.13 0.00 -1.84 0.00 0.00 35.03 32.48 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 -0.59 -0.34 -0.22 -0.18 1.01 -1.03 -2.45 121.20 117.40 1nqt s ILE 343 Ca 0.08 0.23 -0.05 0.00 0.00 0.00 0.00 60.65 60.91 1nqt s ILE 343 Cb 0.05 -0.46 -0.02 0.00 0.01 0.00 0.00 42.46 42.04 1nqt s ILE 343 CO 0.08 0.10 -0.01 -0.63 0.00 0.00 0.00 174.94 174.48 1nqt s ILE 344 N 2.15 3.71 -0.44 2.92 -1.09 0.27 -0.27 121.20 128.44 1nqt s ILE 344 Ca -0.02 -0.38 -0.06 0.00 -2.23 0.00 0.00 60.65 57.96 1nqt s ILE 344 Cb -0.11 -2.70 0.11 0.00 -1.58 0.00 0.00 42.46 38.18 1nqt s ILE 344 CO -0.09 0.41 0.27 0.00 -1.23 0.00 0.00 174.94 174.29 1nqt s ALA 345 N 1.40 3.27 -0.74 9.38 0.00 0.62 -0.01 121.76 135.67 1nqt s ALA 345 Ca 0.05 -2.51 -0.26 0.00 0.00 0.00 0.00 51.96 49.24 1nqt s ALA 345 Cb -0.15 -2.61 -0.09 0.00 0.00 0.00 0.00 23.12 20.28 1nqt s ALA 345 CO -0.00 -1.84 2.21 -1.21 0.00 0.00 0.00 175.76 174.92 1nqt s GLU 346 N 1.26 2.08 -0.25 0.00 2.02 -0.56 -3.25 118.70 120.00 1nqt s GLU 346 Ca 0.07 0.46 0.02 0.00 0.02 0.00 0.00 54.97 55.53 1nqt s GLU 346 Cb -0.24 -4.77 0.33 0.00 0.10 0.00 0.00 34.13 29.54 1nqt s GLU 346 CO -0.02 -3.73 1.55 0.41 0.02 0.00 0.00 175.26 173.48 1nqt n GLY 347 N 6.54 3.41 3.80 -1.39 0.00 0.65 -3.90 105.19 114.30 1nqt n GLY 347 Ca 0.40 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.73 -1.82 -0.05 4.61 0.00 -1.17 -4.39 121.76 117.20 1nqt s ALA 348 Ca 0.30 0.05 -0.19 0.00 0.00 0.00 0.00 51.96 52.12 1nqt s ALA 348 Cb 0.25 0.66 -0.05 0.00 0.00 0.00 0.00 23.12 23.97 1nqt s ALA 348 CO 0.05 -1.06 0.52 -0.80 0.00 0.00 0.00 175.76 174.46 1nqt s ASN 349 N -3.21 6.82 -1.27 0.00 0.01 -1.26 -4.46 114.94 111.57 1nqt s ASN 349 Ca 0.18 0.98 -0.13 0.00 -0.71 0.00 0.00 52.86 53.18 1nqt s ASN 349 Cb -0.01 -2.31 0.00 0.00 0.41 0.00 0.00 41.25 39.34 1nqt s ASN 349 CO 0.02 0.09 0.60 0.61 -1.51 0.00 0.00 177.10 176.90 1nqt n GLY 350 N 2.72 -0.61 0.10 0.66 0.00 -1.26 -4.72 105.19 102.09 1nqt n GLY 350 Ca -0.08 0.30 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1nqt n GLY 350 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt h PRO 351 N -1.95 0.00 -6.37 1.61 0.13 -1.84 -0.70 132.00 122.88 1nqt h PRO 351 Ca -0.66 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 63.88 1nqt h PRO 351 Cb 1.37 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.29 1nqt h PRO 351 CO 0.55 0.00 -0.83 0.95 -0.23 0.00 0.00 178.00 178.44 1nqt s THR 352 N -3.18 1.91 0.06 1.56 -4.23 -1.26 -0.54 115.64 109.95 1nqt s THR 352 Ca 0.07 -1.67 -0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1nqt s THR 352 Cb 0.11 -1.74 -0.04 0.00 1.34 0.00 0.00 72.50 72.18 1nqt s THR 352 CO 0.69 -0.05 0.21 0.42 -0.54 0.00 0.00 174.62 175.35 1nqt s THR 353 N -1.25 5.39 0.36 3.99 -4.23 -0.58 -4.84 115.64 114.47 1nqt s THR 353 Ca 0.10 -0.39 0.17 0.00 -1.18 0.00 0.00 61.69 60.40 1nqt s THR 353 Cb -0.09 -3.63 0.36 0.00 1.34 0.00 0.00 72.50 70.48 1nqt s THR 353 CO 0.05 0.14 1.57 -2.65 -0.54 0.00 0.00 174.62 173.20 1nqt n PRO 354 N 0.29 -0.06 0.18 3.99 -0.02 -1.26 0.33 135.00 138.44 1nqt n PRO 354 Ca -0.05 1.40 0.05 0.00 -2.02 0.00 0.00 63.50 62.88 1nqt n PRO 354 Cb 0.51 -2.46 0.33 0.00 -0.02 0.00 0.00 33.50 31.86 1nqt n PRO 354 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1nqt h GLU 355 N 0.00 0.00 -0.06 -0.52 4.39 -1.95 -2.80 114.58 113.64 1nqt h GLU 355 Ca 0.80 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 60.33 1nqt h GLU 355 Cb 2.06 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.70 1nqt h GLU 355 CO -0.80 0.40 -0.69 0.00 -1.16 0.00 0.00 179.01 176.76 1nqt h ALA 356 N 1.60 0.70 0.41 3.43 0.00 -0.42 -3.01 119.26 121.96 1nqt h ALA 356 Ca -0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 1nqt h ALA 356 Cb 0.89 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1nqt h ALA 356 CO 0.05 0.77 -0.20 -0.44 0.00 0.00 0.00 179.25 179.44 1nqt h ASP 357 N 0.21 -0.46 -0.76 0.00 3.32 -1.20 0.03 116.42 117.55 1nqt h ASP 357 Ca -0.02 -0.06 0.11 0.00 0.02 0.00 0.00 57.03 57.07 1nqt h ASP 357 Cb 1.24 0.12 -0.12 0.00 0.22 0.00 0.00 39.33 40.79 1nqt h ASP 357 CO 0.11 -0.22 -0.43 0.50 -1.72 0.00 0.00 179.24 177.48 1nqt h LYS 358 N -0.70 -0.12 0.08 3.56 3.64 -1.50 0.25 116.57 121.79 1nqt h LYS 358 Ca -0.06 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1nqt h LYS 358 Cb 0.50 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1nqt h LYS 358 CO 0.09 -0.08 -0.10 0.82 -2.27 0.00 0.00 179.45 177.91 1nqt h ILE 359 N -0.12 0.00 -1.55 2.00 2.04 -1.39 -0.20 117.51 118.29 1nqt h ILE 359 Ca 0.23 0.00 0.47 0.00 1.00 0.00 0.00 64.86 66.56 1nqt h ILE 359 Cb 0.55 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.53 1nqt h ILE 359 CO -0.81 0.00 1.06 -0.26 0.00 0.00 0.00 178.15 178.15 1nqt h PHE 360 N -0.19 0.26 -0.08 1.37 0.04 -0.19 2.13 116.94 120.29 1nqt h PHE 360 Ca -0.01 0.01 -0.21 0.00 2.80 0.00 0.00 57.97 60.56 1nqt h PHE 360 Cb 0.17 -0.06 0.01 0.00 2.20 0.00 0.00 35.95 38.27 1nqt h PHE 360 CO -0.15 -0.10 -0.76 -0.07 -0.60 0.00 0.00 178.31 176.63 1nqt h LEU 361 N 0.05 0.80 -2.05 1.54 3.38 0.17 0.37 115.31 119.57 1nqt h LEU 361 Ca 0.83 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1nqt h LEU 361 Cb 2.97 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 43.48 1nqt h LEU 361 CO -0.21 1.36 -0.04 -0.33 0.09 0.00 0.00 178.44 179.31 1nqt h GLU 362 N 0.31 0.00 -0.50 1.13 5.08 0.53 -2.46 114.58 118.67 1nqt h GLU 362 Ca -0.07 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 57.99 1nqt h GLU 362 Cb 1.41 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.48 1nqt h GLU 362 CO 0.15 0.04 -0.05 2.89 -1.00 0.00 0.00 179.01 181.04 1nqt n ARG 363 N -4.25 2.16 -3.28 2.33 1.85 -0.60 -4.99 116.66 109.89 1nqt n ARG 363 Ca -0.03 -3.33 -0.26 0.00 -1.00 0.00 0.00 57.85 53.23 1nqt n ARG 363 Cb 0.13 -1.94 0.03 0.00 -1.05 0.00 0.00 32.46 29.62 1nqt n ARG 363 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1nqt n ASN 364 N -1.06 -6.32 -3.87 2.89 3.02 -0.93 -5.00 115.26 104.00 1nqt n ASN 364 Ca 0.39 0.13 -0.20 0.00 -0.03 0.00 0.00 54.58 54.87 1nqt n ASN 364 Cb 1.04 -2.73 -0.17 0.00 -0.61 0.00 0.00 39.78 37.31 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 -1.72 0.51 -0.31 2.41 -1.09 0.13 -4.92 121.20 116.22 1nqt s ILE 365 Ca 0.30 -0.08 -0.17 0.00 -2.23 0.00 0.00 60.65 58.47 1nqt s ILE 365 Cb -0.04 -0.56 -0.02 0.00 -1.58 0.00 0.00 42.46 40.26 1nqt s ILE 365 CO 0.76 0.23 0.44 -0.32 -1.23 0.00 0.00 174.94 174.83 1nqt s MET 366 N 1.10 3.81 -0.32 2.79 -2.45 -1.03 -4.49 119.30 118.71 1nqt s MET 366 Ca -0.08 -0.06 -0.08 0.00 -1.25 0.00 0.00 55.69 54.22 1nqt s MET 366 Cb -0.14 -3.73 0.02 0.00 1.25 0.00 0.00 34.83 32.23 1nqt s MET 366 CO -0.01 -0.46 0.12 0.08 1.05 0.00 0.00 175.02 175.80 1nqt s VAL 367 N 2.21 4.10 -0.45 10.11 1.01 -1.26 0.95 120.40 137.07 1nqt s VAL 367 Ca 0.17 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 1nqt s VAL 367 Cb -0.16 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 33.06 1nqt s VAL 367 CO 0.11 -0.04 0.61 -0.63 0.00 0.00 0.00 175.10 175.15 1nqt s ILE 368 N 1.50 4.87 0.09 2.22 1.01 0.98 -4.32 121.20 127.55 1nqt s ILE 368 Ca 0.02 -0.05 -0.36 0.00 0.00 0.00 0.00 60.65 60.25 1nqt s ILE 368 Cb -0.18 -4.20 -0.17 0.00 0.01 0.00 0.00 42.46 37.92 1nqt s ILE 368 CO 0.04 -0.60 1.25 -2.65 0.00 0.00 0.00 174.94 172.97 1nqt n PRO 369 N 6.15 0.94 -0.26 2.79 -0.02 -1.26 -1.50 135.00 141.84 1nqt n PRO 369 Ca -0.03 0.34 0.03 0.00 -2.02 0.00 0.00 63.50 61.81 1nqt n PRO 369 Cb 0.47 -1.92 0.16 0.00 -0.02 0.00 0.00 33.50 32.20 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 4.01 0.50 -0.97 2.55 3.04 -1.80 0.62 116.42 124.38 1nqt h ASP 370 Ca -0.47 0.07 0.28 0.00 -3.24 0.00 0.00 57.03 53.67 1nqt h ASP 370 Cb 1.35 -0.02 -0.04 0.00 -1.04 0.00 0.00 39.33 39.59 1nqt h ASP 370 CO 0.74 0.27 0.99 0.25 -2.04 0.00 0.00 179.24 179.45 1nqt h LEU 371 N 0.63 0.00 0.00 0.15 5.85 -1.92 -2.59 115.31 117.44 1nqt h LEU 371 Ca 0.38 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.10 1nqt h LEU 371 Cb 0.43 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1nqt h LEU 371 CO -0.29 0.00 -0.76 0.00 -0.34 0.00 0.00 178.44 177.05 1nqt n TYR 372 N -3.53 0.00 -0.08 1.25 4.19 0.16 -4.41 117.16 114.74 1nqt n TYR 372 Ca 0.21 0.00 -0.15 0.00 3.31 0.00 0.00 57.90 61.27 1nqt n TYR 372 Cb 1.30 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 41.09 1nqt n TYR 372 CO 0.00 0.00 0.00 1.25 0.91 0.00 0.00 176.86 179.02 1nqt h LEU 373 N 0.00 0.97 -4.69 2.98 5.85 0.33 -3.16 115.31 117.58 1nqt h LEU 373 Ca 0.00 -0.53 -0.73 0.00 0.84 0.00 0.00 57.88 57.46 1nqt h LEU 373 Cb 0.76 -0.28 -0.29 0.00 0.37 0.00 0.00 40.66 41.23 1nqt h LEU 373 CO 0.00 1.32 0.89 -0.46 -0.34 0.00 0.00 178.44 179.85 1nqt n ASN 374 N -4.02 7.39 -0.60 1.25 2.04 -0.99 -3.45 115.26 116.87 1nqt n ASN 374 Ca -0.04 -3.82 0.07 0.00 -0.44 0.00 0.00 54.58 50.35 1nqt n ASN 374 Cb 0.62 -1.00 0.09 0.00 -2.53 0.00 0.00 39.78 36.96 1nqt n ASN 374 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nqt n ALA 375 N -0.64 2.42 0.34 -2.53 0.00 -1.20 -4.57 120.51 114.33 1nqt n ALA 375 Ca 0.55 -0.74 -0.17 0.00 0.00 0.00 0.00 53.44 53.09 1nqt n ALA 375 Cb 0.38 -0.48 -0.09 0.00 0.00 0.00 0.00 19.45 19.26 1nqt n ALA 375 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1nqt h GLY 376 N 2.64 -1.23 -0.55 0.00 0.00 -1.82 -1.58 103.07 100.53 1nqt h GLY 376 Ca 0.00 0.53 0.05 0.00 0.00 0.00 0.00 47.33 47.91 1nqt h GLY 376 CO 0.00 -0.40 -0.33 0.61 0.00 0.00 0.00 176.54 176.43 1nqt n GLY 377 N -1.54 -2.05 0.23 4.60 0.00 -1.26 0.02 105.19 105.19 1nqt n GLY 377 Ca -0.12 0.77 -0.07 0.00 0.00 0.00 0.00 46.02 46.60 1nqt n GLY 377 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nqt h VAL 378 N 0.00 0.00 -0.88 1.61 2.07 -1.83 0.06 116.25 117.27 1nqt h VAL 378 Ca 0.09 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.70 1nqt h VAL 378 Cb 0.23 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.88 1nqt h VAL 378 CO -0.52 0.00 -0.48 0.41 0.02 0.00 0.00 177.57 177.00 1nqt n THR 379 N -4.08 -0.57 -0.27 2.57 -1.04 0.10 0.77 114.28 111.76 1nqt n THR 379 Ca -0.01 2.12 -0.02 0.00 -2.04 0.00 0.00 64.05 64.09 1nqt n THR 379 Cb 0.17 -2.66 0.10 0.00 -1.82 0.00 0.00 70.33 66.11 1nqt n THR 379 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1nqt h VAL 380 N 0.00 1.09 -0.05 12.58 2.07 -0.24 -2.07 116.25 129.62 1nqt h VAL 380 Ca 0.18 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1nqt h VAL 380 Cb 0.40 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1nqt h VAL 380 CO -0.84 0.17 0.06 0.77 0.02 0.00 0.00 177.57 177.74 1nqt h SER 381 N 0.92 0.00 0.04 0.57 4.64 0.23 0.30 113.55 120.25 1nqt h SER 381 Ca 0.31 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1nqt h SER 381 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1nqt h SER 381 CO -0.13 0.00 -0.02 0.22 -0.87 0.00 0.00 176.83 176.03 1nqt h TYR 382 N 0.00 -0.05 -0.20 4.77 -0.00 -0.48 -1.25 116.97 119.75 1nqt h TYR 382 Ca 0.03 -0.00 0.05 0.00 -0.00 0.00 0.00 58.73 58.80 1nqt h TYR 382 Cb 0.14 0.02 -0.05 0.00 -0.00 0.00 0.00 36.73 36.84 1nqt h TYR 382 CO 0.00 0.16 -0.11 0.74 -0.00 0.00 0.00 178.16 178.95 1nqt h PHE 383 N -0.26 -0.27 -0.66 -3.82 0.05 -0.42 0.81 116.94 112.37 1nqt h PHE 383 Ca -0.01 0.02 0.13 0.00 3.82 0.00 0.00 57.97 61.93 1nqt h PHE 383 Cb 0.23 0.15 -0.09 0.00 2.00 0.00 0.00 35.95 38.24 1nqt h PHE 383 CO -0.01 -0.17 0.18 1.49 -0.18 0.00 0.00 178.31 179.62 1nqt h GLU 384 N -0.09 0.30 0.25 1.51 4.81 -0.86 0.91 114.58 121.40 1nqt h GLU 384 Ca 0.11 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1nqt h GLU 384 Cb 0.26 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1nqt h GLU 384 CO -0.27 0.20 -0.39 2.35 -0.73 0.00 0.00 179.01 180.17 1nqt h TRP 385 N 0.31 -1.09 -0.97 0.92 7.01 0.33 0.31 115.95 122.76 1nqt h TRP 385 Ca 0.35 0.02 0.17 0.00 2.11 0.00 0.00 58.89 61.54 1nqt h TRP 385 Cb 0.54 0.44 -0.09 0.00 -2.10 0.00 0.00 29.16 27.96 1nqt h TRP 385 CO -0.23 -0.48 0.61 -0.07 -2.79 0.00 0.00 178.44 175.48 1nqt h LEU 386 N -0.67 0.74 -0.04 0.65 3.38 -0.32 0.21 115.31 119.25 1nqt h LEU 386 Ca -0.03 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1nqt h LEU 386 Cb 0.61 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1nqt h LEU 386 CO -0.12 0.32 -0.21 0.50 0.09 0.00 0.00 178.44 179.01 1nqt h LYS 387 N 0.75 -0.30 -0.17 1.13 3.64 0.21 0.24 116.57 122.07 1nqt h LYS 387 Ca 0.52 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.97 1nqt h LYS 387 Cb 0.82 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 1nqt h LYS 387 CO -0.29 -0.20 0.13 -0.91 -2.27 0.00 0.00 179.45 175.91 1nqt h ASN 388 N -0.31 0.00 1.30 4.20 2.35 0.14 -0.76 115.58 122.50 1nqt h ASN 388 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1nqt h ASN 388 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1nqt h ASN 388 CO -0.22 0.00 -0.58 -0.07 -1.65 0.00 0.00 177.43 174.90 1nqt h LEU 389 N 0.00 0.00 0.00 1.61 3.38 0.07 -3.23 115.31 117.14 1nqt h LEU 389 Ca 0.08 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1nqt h LEU 389 Cb 0.34 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1nqt h LEU 389 CO -0.00 0.02 -0.95 0.78 0.09 0.00 0.00 178.44 178.38 1nqt h ASN 390 N 0.00 0.00 -1.51 -0.43 2.35 0.69 -3.48 115.58 113.20 1nqt h ASN 390 Ca 0.00 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.40 1nqt h ASN 390 Cb 0.94 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.22 1nqt h ASN 390 CO 0.00 0.48 -0.37 1.41 -1.65 0.00 0.00 177.43 177.29 1nqt n HIS 391 N -3.02 -0.34 -3.73 1.19 8.25 -0.42 -4.97 115.22 112.17 1nqt n HIS 391 Ca -0.03 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.30 1nqt n HIS 391 Cb 0.76 -3.20 -0.10 0.00 1.12 0.00 0.00 29.99 28.57 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 -2.74 -0.00 0.54 1.59 1.01 -1.25 -5.09 120.40 114.46 1nqt s VAL 392 Ca 0.00 0.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.77 1nqt s VAL 392 Cb 0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.77 1nqt s VAL 392 CO 0.00 0.00 1.37 -0.94 0.00 0.00 0.00 175.10 175.54 1nqt s SER 393 N 0.31 5.31 0.31 3.32 1.04 -1.26 -4.86 113.70 117.87 1nqt s SER 393 Ca -0.01 2.80 -0.29 0.00 0.48 0.00 0.00 55.95 58.93 1nqt s SER 393 Cb -0.03 -2.64 -0.10 0.00 0.10 0.00 0.00 66.02 63.35 1nqt s SER 393 CO -0.01 -1.55 1.36 -0.31 0.98 0.00 0.00 173.24 173.72 1nqt s TYR 394 N -1.28 3.00 0.00 5.02 1.51 -1.26 -2.63 117.35 121.70 1nqt s TYR 394 Ca 0.71 1.27 0.00 0.00 -1.01 0.00 0.00 57.07 58.04 1nqt s TYR 394 Cb -0.41 -3.76 0.00 0.00 -0.11 0.00 0.00 41.96 37.68 1nqt s TYR 394 CO 0.49 -2.21 0.00 0.41 -1.11 0.00 0.00 175.55 173.13 1nqt n GLY 395 N 1.22 0.67 0.36 0.71 0.00 -1.26 -4.23 105.19 102.65 1nqt n GLY 395 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 1nqt n GLY 395 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nqt h ARG 396 N 1.80 1.27 0.00 1.61 1.12 -1.88 -2.85 114.38 115.45 1nqt h ARG 396 Ca 0.00 -0.10 0.00 0.00 -1.11 0.00 0.00 59.98 58.77 1nqt h ARG 396 Cb 0.06 -0.28 0.00 0.00 -0.01 0.00 0.00 29.97 29.75 1nqt h ARG 396 CO 0.00 0.87 -0.72 1.28 -3.11 0.00 0.00 179.97 178.29 1nqt n LEU 397 N -4.39 0.62 -0.06 3.80 4.32 -1.26 -4.71 117.00 115.31 1nqt n LEU 397 Ca 0.11 -0.03 -0.06 0.00 -0.02 0.00 0.00 56.01 56.00 1nqt n LEU 397 Cb 0.04 -0.17 -0.02 0.00 -1.62 0.00 0.00 43.42 41.65 1nqt n LEU 397 CO 0.37 0.09 -0.45 0.35 -1.22 0.00 0.00 177.39 176.54 1nqt n THR 398 N -1.71 1.03 0.00 -5.08 -2.24 -1.12 -4.67 114.28 100.49 1nqt n THR 398 Ca 0.04 0.26 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1nqt n THR 398 Cb 0.38 -2.09 0.00 0.00 -2.10 0.00 0.00 70.33 66.52 1nqt n THR 398 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1nqt n PHE 399 N -3.86 0.00 0.35 4.78 0.99 -1.09 0.20 117.46 118.83 1nqt n PHE 399 Ca -0.09 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.18 1nqt n PHE 399 Cb 0.35 -0.20 -0.09 0.00 -1.00 0.00 0.00 39.48 38.54 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 -0.91 -0.64 -1.08 1.63 -1.86 0.10 116.57 113.81 1nqt h LYS 400 Ca 0.00 0.06 0.13 0.00 -0.85 0.00 0.00 60.65 60.00 1nqt h LYS 400 Cb 0.00 0.21 -0.10 0.00 -0.60 0.00 0.00 32.23 31.73 1nqt h LYS 400 CO 0.00 -0.61 0.04 -0.92 -3.45 0.00 0.00 179.45 174.51 1nqt h TYR 401 N -0.95 0.03 0.00 1.91 3.20 0.20 0.39 116.97 121.75 1nqt h TYR 401 Ca -0.08 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.79 1nqt h TYR 401 Cb 0.77 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 1nqt h TYR 401 CO -0.09 -0.14 -0.24 1.49 -1.64 0.00 0.00 178.16 177.53 1nqt h GLU 402 N 0.15 0.00 -0.05 1.82 4.22 -1.11 0.17 114.58 119.79 1nqt h GLU 402 Ca 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.76 1nqt h GLU 402 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1nqt h GLU 402 CO -0.52 0.24 -0.03 -0.09 -2.18 0.00 0.00 179.01 176.43 1nqt h ARG 403 N 0.00 0.10 0.13 1.92 2.43 0.23 -2.67 114.38 116.52 1nqt h ARG 403 Ca -0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1nqt h ARG 403 Cb 0.60 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1nqt h ARG 403 CO 0.03 0.52 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.50 1nqt h ASP 404 N -0.32 -0.16 -0.48 -3.80 3.45 -0.71 -1.92 116.42 112.48 1nqt h ASP 404 Ca 0.01 0.01 0.04 0.00 0.43 0.00 0.00 57.03 57.52 1nqt h ASP 404 Cb 0.49 0.04 -0.06 0.00 -0.56 0.00 0.00 39.33 39.25 1nqt h ASP 404 CO 0.01 -0.11 -0.28 -0.24 -1.57 0.00 0.00 179.24 177.04 1nqt n SER 405 N -2.52 -0.51 -0.18 6.45 2.88 0.56 -0.00 113.62 120.30 1nqt n SER 405 Ca -0.02 0.87 -0.04 0.00 -1.33 0.00 0.00 58.87 58.34 1nqt n SER 405 Cb 0.07 -0.12 0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1nqt n SER 405 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1nqt h ASN 406 N 0.00 -0.92 -0.26 -3.46 -0.26 -1.21 0.19 115.58 109.67 1nqt h ASN 406 Ca 0.08 0.20 -0.03 0.00 -0.56 0.00 0.00 56.30 55.99 1nqt h ASN 406 Cb 0.20 0.49 -0.02 0.00 -1.06 0.00 0.00 38.32 37.93 1nqt h ASN 406 CO -0.45 -0.27 0.09 1.88 -1.06 0.00 0.00 177.43 177.61 1nqt h TYR 407 N -0.13 0.48 -0.66 1.19 0.05 0.38 -1.16 116.97 117.12 1nqt h TYR 407 Ca 0.24 -0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.94 1nqt h TYR 407 Cb 0.51 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.08 1nqt h TYR 407 CO -0.56 0.41 0.18 0.45 -1.05 0.00 0.00 178.16 177.59 1nqt h HIS 408 N 0.47 1.06 0.66 4.88 3.86 0.68 0.23 115.15 126.98 1nqt h HIS 408 Ca 0.11 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1nqt h HIS 408 Cb 0.17 -0.31 0.01 0.00 1.06 0.00 0.00 27.41 28.34 1nqt h HIS 408 CO 0.01 0.86 -0.31 -0.07 0.86 0.00 0.00 177.93 179.27 1nqt h LEU 409 N 0.98 -0.75 -0.86 2.43 -0.00 0.17 -1.61 115.31 115.69 1nqt h LEU 409 Ca 0.21 0.03 0.20 0.00 -0.00 0.00 0.00 57.88 58.31 1nqt h LEU 409 Cb 0.32 0.19 -0.12 0.00 -0.00 0.00 0.00 40.66 41.05 1nqt h LEU 409 CO -0.00 -0.48 0.35 -0.07 -0.00 0.00 0.00 178.44 178.24 1nqt h LEU 410 N -0.99 0.29 -1.99 1.67 3.38 -1.23 0.27 115.31 116.72 1nqt h LEU 410 Ca -0.09 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1nqt h LEU 410 Cb 0.67 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1nqt h LEU 410 CO 0.15 0.03 -0.10 0.24 0.09 0.00 0.00 178.44 178.85 1nqt h MET 411 N 0.41 0.00 0.02 1.13 2.86 -0.90 0.19 114.93 118.64 1nqt h MET 411 Ca 0.51 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 58.11 1nqt h MET 411 Cb 0.92 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.58 1nqt h MET 411 CO -0.50 0.10 -0.20 0.77 1.06 0.00 0.00 176.91 178.14 1nqt h SER 412 N 0.00 0.08 -0.96 1.22 0.02 0.53 -2.65 113.55 111.79 1nqt h SER 412 Ca -0.00 -0.97 0.12 0.00 -0.84 0.00 0.00 61.79 60.10 1nqt h SER 412 Cb 0.31 -0.02 -0.08 0.00 0.14 0.00 0.00 62.40 62.74 1nqt h SER 412 CO 0.01 1.09 0.59 0.58 -1.14 0.00 0.00 176.83 177.96 1nqt h VAL 413 N -0.90 0.90 0.27 2.27 2.07 -0.93 0.41 116.25 120.33 1nqt h VAL 413 Ca -0.04 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1nqt h VAL 413 Cb 1.12 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1nqt h VAL 413 CO 0.01 0.17 -0.13 -0.61 0.02 0.00 0.00 177.57 177.03 1nqt h GLN 414 N 0.92 -0.34 0.13 1.57 4.15 -0.65 0.30 115.11 121.19 1nqt h GLN 414 Ca 0.48 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.92 1nqt h GLN 414 Cb 0.49 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.26 1nqt h GLN 414 CO -0.27 -0.21 -0.06 0.93 -1.93 0.00 0.00 178.83 177.29 1nqt h GLU 415 N -0.39 -0.16 -0.97 1.69 5.08 -0.98 -1.43 114.58 117.42 1nqt h GLU 415 Ca -0.04 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.51 1nqt h GLU 415 Cb 0.30 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.49 1nqt h GLU 415 CO 0.06 -0.06 0.61 0.77 -1.00 0.00 0.00 179.01 179.39 1nqt h SER 416 N -0.23 0.72 1.47 1.42 0.02 -0.10 0.34 113.55 117.18 1nqt h SER 416 Ca -0.02 0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 1nqt h SER 416 Cb 0.18 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1nqt h SER 416 CO 0.03 0.30 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.67 1nqt h LEU 417 N 0.72 0.00 -0.15 5.07 4.07 -0.60 -2.98 115.31 121.43 1nqt h LEU 417 Ca 0.53 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 58.28 1nqt h LEU 417 Cb 0.87 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.60 1nqt h LEU 417 CO -0.30 0.27 -0.96 -0.33 -1.08 0.00 0.00 178.44 176.05 1nqt h GLU 418 N 0.00 0.10 -5.28 1.13 5.08 0.65 -3.32 114.58 112.95 1nqt h GLU 418 Ca -0.00 -0.14 -0.70 0.00 -1.00 0.00 0.00 59.36 57.51 1nqt h GLU 418 Cb 1.08 0.05 -0.11 0.00 0.50 0.00 0.00 28.75 30.27 1nqt h GLU 418 CO 0.04 0.98 2.03 0.54 -1.00 0.00 0.00 179.01 181.59 1nqt n ARG 419 N -3.52 3.24 0.00 2.33 1.74 0.18 -1.77 116.66 118.86 1nqt n ARG 419 Ca -0.03 -3.40 0.00 0.00 -0.77 0.00 0.00 57.85 53.65 1nqt n ARG 419 Cb 0.88 -3.32 0.00 0.00 -1.02 0.00 0.00 32.46 28.99 1nqt n ARG 419 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1nqt n LYS 420 N 7.20 0.00 0.00 5.56 4.81 -1.25 -4.93 118.16 129.56 1nqt n LYS 420 Ca 0.45 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1nqt n LYS 420 Cb 0.44 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.49 1nqt n LYS 420 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1nqt n PHE 421 N 0.00 0.00 -1.54 5.64 -0.00 -0.73 -5.06 117.46 115.77 1nqt n PHE 421 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 57.04 1nqt n PHE 421 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 39.48 39.47 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 -0.03 4.18 3.30 7.13 0.00 -1.26 -4.84 105.19 113.66 1nqt n GLY 422 Ca 0.00 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.37 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 3.11 0.79 0.13 1.61 2.47 -1.26 -5.08 119.74 121.52 1nqt s LYS 423 Ca 0.53 -0.19 0.23 0.00 -1.56 0.00 0.00 55.97 54.99 1nqt s LYS 423 Cb 0.15 0.36 0.13 0.00 -1.46 0.00 0.00 37.83 37.00 1nqt s LYS 423 CO -0.06 -0.24 1.13 0.72 0.16 0.00 0.00 175.35 177.05 1nqt n HIS 424 N 0.99 0.64 -1.50 4.03 8.25 -1.26 -4.50 115.22 121.87 1nqt n HIS 424 Ca -0.20 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1nqt n HIS 424 Cb 0.57 -0.72 0.00 0.00 1.12 0.00 0.00 29.99 30.96 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 1.28 -1.12 0.32 -1.41 0.00 -1.26 -4.96 105.19 98.05 1nqt n GLY 425 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 1nqt n GLY 425 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nqt h GLY 426 N 0.00 1.36 -5.28 -0.02 0.00 -1.97 -3.41 103.07 93.75 1nqt h GLY 426 Ca 0.00 -0.37 -0.68 0.00 0.00 0.00 0.00 47.33 46.29 1nqt h GLY 426 CO 0.00 0.19 -0.66 -1.59 0.00 0.00 0.00 176.54 174.48 1nqt s THR 427 N -6.03 4.02 -0.57 4.70 2.01 -1.26 -5.07 115.64 113.43 1nqt s THR 427 Ca -0.12 -0.35 0.04 0.00 0.31 0.00 0.00 61.69 61.57 1nqt s THR 427 Cb 0.20 -2.68 0.37 0.00 0.01 0.00 0.00 72.50 70.39 1nqt s THR 427 CO 0.79 0.59 1.10 2.30 -0.69 0.00 0.00 174.62 178.71 1nqt n ILE 428 N 2.34 3.07 -0.37 1.82 -0.00 -1.26 -4.83 119.36 120.12 1nqt n ILE 428 Ca -0.18 -5.35 0.01 0.00 -0.00 0.00 0.00 62.75 57.23 1nqt n ILE 428 Cb 0.53 -1.36 0.16 0.00 -0.00 0.00 0.00 39.64 38.97 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 2.93 1.20 -0.27 6.28 0.11 -1.90 -3.16 132.00 137.18 1nqt h PRO 429 Ca 0.23 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1nqt h PRO 429 Cb 0.61 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1nqt h PRO 429 CO 0.88 0.79 0.00 0.44 -0.21 0.00 0.00 178.00 179.90 1nqt n ILE 430 N -4.47 0.00 -3.98 4.15 -5.35 -1.25 -4.33 119.36 104.13 1nqt n ILE 430 Ca 0.15 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.33 1nqt n ILE 430 Cb 0.14 -0.01 -0.16 0.00 -1.74 0.00 0.00 39.64 37.87 1nqt n ILE 430 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1nqt s VAL 431 N -0.02 1.46 0.56 7.28 0.11 -1.20 -4.95 120.40 123.64 1nqt s VAL 431 Ca 0.00 -0.67 -0.17 0.00 -2.93 0.00 0.00 61.98 58.21 1nqt s VAL 431 Cb 0.00 -1.45 -0.05 0.00 -1.53 0.00 0.00 36.38 33.35 1nqt s VAL 431 CO 0.00 0.34 1.05 -2.84 -3.33 0.00 0.00 175.10 170.32 1nqt s PRO 432 N 1.51 3.49 0.44 1.54 0.02 -1.26 -4.97 135.00 135.76 1nqt s PRO 432 Ca 0.03 1.25 -0.26 0.00 0.02 0.00 0.00 61.00 62.05 1nqt s PRO 432 Cb -0.14 -2.05 -0.08 0.00 0.02 0.00 0.00 34.50 32.24 1nqt s PRO 432 CO -0.09 -0.68 1.39 0.95 -0.33 0.00 0.00 177.00 178.24 1nqt s THR 433 N -2.30 2.25 0.14 0.99 -4.23 -1.26 -4.66 115.64 106.57 1nqt s THR 433 Ca 0.65 0.22 -0.17 0.00 -1.18 0.00 0.00 61.69 61.21 1nqt s THR 433 Cb -0.16 -3.13 0.08 0.00 1.34 0.00 0.00 72.50 70.63 1nqt s THR 433 CO 0.31 0.03 1.11 0.00 -0.54 0.00 0.00 174.62 175.53 1nqt n ALA 434 N -0.09 -0.25 -0.27 3.99 0.00 -1.26 0.56 120.51 123.20 1nqt n ALA 434 Ca 0.05 0.67 0.10 0.00 0.00 0.00 0.00 53.44 54.26 1nqt n ALA 434 Cb 0.42 -0.22 0.35 0.00 0.00 0.00 0.00 19.45 20.00 1nqt n ALA 434 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1nqt h GLU 435 N 0.00 0.73 0.02 0.00 4.81 -1.99 -1.72 114.58 116.43 1nqt h GLU 435 Ca 0.19 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1nqt h GLU 435 Cb 0.37 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1nqt h GLU 435 CO -0.69 0.48 -0.01 0.35 -0.73 0.00 0.00 179.01 178.41 1nqt h PHE 436 N 0.75 -0.03 0.05 0.92 -0.00 -0.21 -1.91 116.94 116.51 1nqt h PHE 436 Ca 0.43 -0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.42 1nqt h PHE 436 Cb 0.60 0.01 -0.05 0.00 -0.00 0.00 0.00 35.95 36.51 1nqt h PHE 436 CO -0.00 0.23 -0.51 0.37 -0.00 0.00 0.00 178.31 178.40 1nqt h GLN 437 N -0.28 -0.65 -0.90 1.11 5.75 -0.76 0.69 115.11 120.07 1nqt h GLN 437 Ca -0.00 0.04 0.25 0.00 -0.15 0.00 0.00 58.65 58.79 1nqt h GLN 437 Cb 0.27 0.15 -0.05 0.00 1.07 0.00 0.00 27.48 28.92 1nqt h GLN 437 CO 0.00 -0.43 0.63 -0.44 -2.65 0.00 0.00 178.83 175.94 1nqt h ASP 438 N -0.68 0.12 -0.00 -0.69 3.45 -1.29 0.86 116.42 118.19 1nqt h ASP 438 Ca 0.00 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.47 1nqt h ASP 438 Cb 0.71 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.47 1nqt h ASP 438 CO -0.32 0.04 -0.05 -0.09 -1.57 0.00 0.00 179.24 177.25 1nqt h ARG 439 N 0.11 0.04 0.00 3.56 2.43 -0.18 -2.55 114.38 117.79 1nqt h ARG 439 Ca 0.44 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.52 1nqt h ARG 439 Cb 1.57 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.12 1nqt h ARG 439 CO -0.06 0.78 -0.27 0.82 -1.51 0.00 0.00 179.97 179.73 1nqt h ILE 440 N -0.69 0.76 0.06 1.20 2.04 0.27 -1.64 117.51 119.51 1nqt h ILE 440 Ca -0.01 -1.13 -0.00 0.00 1.00 0.00 0.00 64.86 64.72 1nqt h ILE 440 Cb 0.80 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 1nqt h ILE 440 CO 0.01 0.26 -0.03 0.28 0.00 0.00 0.00 178.15 178.67 1nqt h SER 441 N 0.00 -0.07 -0.18 1.72 0.02 0.54 -3.37 113.55 112.21 1nqt h SER 441 Ca -0.00 -0.55 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 1nqt h SER 441 Cb 0.69 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1nqt h SER 441 CO 0.03 0.63 0.00 0.61 -1.14 0.00 0.00 176.83 176.97 1nqt n GLY 442 N 1.12 0.23 3.60 -3.77 0.00 -0.96 -4.98 105.19 100.43 1nqt n GLY 442 Ca -0.07 -0.39 -0.57 0.00 0.00 0.00 0.00 46.02 44.99 1nqt n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 443 N 0.27 -1.75 -2.68 4.61 0.00 -0.62 -4.94 120.51 115.40 1nqt n ALA 443 Ca 0.15 0.52 -0.17 0.00 0.00 0.00 0.00 53.44 53.95 1nqt n ALA 443 Cb 0.30 -1.98 -0.05 0.00 0.00 0.00 0.00 19.45 17.72 1nqt n ALA 443 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nqt s SER 444 N 1.12 1.21 0.09 0.00 1.04 -1.26 -5.07 113.70 110.84 1nqt s SER 444 Ca 0.91 -1.60 -0.31 0.00 0.48 0.00 0.00 55.95 55.43 1nqt s SER 444 Cb -1.14 0.63 -0.13 0.00 0.10 0.00 0.00 66.02 65.48 1nqt s SER 444 CO 0.57 -1.23 1.61 -0.08 0.98 0.00 0.00 173.24 175.09 1nqt h GLU 445 N 2.11 -0.73 -0.63 4.02 4.81 -1.92 -2.65 114.58 119.59 1nqt h GLU 445 Ca -0.27 0.05 0.18 0.00 -0.13 0.00 0.00 59.36 59.19 1nqt h GLU 445 Cb 1.24 0.17 -0.12 0.00 0.63 0.00 0.00 28.75 30.66 1nqt h GLU 445 CO 0.38 -0.49 0.05 1.17 -0.73 0.00 0.00 179.01 179.39 1nqt n LYS 446 N -5.47 -0.05 -0.09 1.92 4.81 -1.24 0.11 118.16 118.15 1nqt n LYS 446 Ca -0.10 0.94 -0.08 0.00 -0.87 0.00 0.00 58.31 58.20 1nqt n LYS 446 Cb 0.37 -1.51 -0.01 0.00 0.02 0.00 0.00 35.03 33.90 1nqt n LYS 446 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1nqt h ASP 447 N 0.00 0.31 -0.12 3.14 3.32 -1.79 0.36 116.42 121.64 1nqt h ASP 447 Ca 0.40 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 1nqt h ASP 447 Cb 0.86 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 1nqt h ASP 447 CO -0.58 0.22 0.02 0.40 -1.72 0.00 0.00 179.24 177.58 1nqt h ILE 448 N 0.38 1.20 0.26 0.35 1.08 0.69 -2.27 117.51 119.20 1nqt h ILE 448 Ca 0.12 -0.64 0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1nqt h ILE 448 Cb -0.01 1.41 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 1nqt h ILE 448 CO -0.05 0.19 -0.29 0.58 -0.69 0.00 0.00 178.15 177.88 1nqt h VAL 449 N -0.02 0.38 -0.22 1.67 2.07 -0.93 -0.26 116.25 118.95 1nqt h VAL 449 Ca 0.04 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.62 1nqt h VAL 449 Cb 0.27 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1nqt h VAL 449 CO 0.00 0.00 0.26 0.45 0.02 0.00 0.00 177.57 178.30 1nqt h HIS 450 N -0.59 0.00 0.06 1.57 3.86 -0.23 0.35 115.15 120.16 1nqt h HIS 450 Ca -0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1nqt h HIS 450 Cb 0.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.03 1nqt h HIS 450 CO -0.20 0.00 -0.03 0.66 0.86 0.00 0.00 177.93 179.22 1nqt h SER 451 N 0.00 -0.07 -0.53 2.45 4.64 -0.75 -2.66 113.55 116.64 1nqt h SER 451 Ca 0.10 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.58 1nqt h SER 451 Cb 0.62 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1nqt h SER 451 CO -0.00 0.18 0.80 1.23 -0.87 0.00 0.00 176.83 178.16 1nqt h GLY 452 N -0.54 0.00 0.67 -0.77 0.00 -0.18 0.84 103.07 103.09 1nqt h GLY 452 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 1nqt h GLY 452 CO 0.01 0.00 -0.62 -2.00 0.00 0.00 0.00 176.54 173.93 1nqt h LEU 453 N 0.00 0.45 -0.33 3.11 6.46 -0.35 -3.05 115.31 121.61 1nqt h LEU 453 Ca 0.25 -0.86 -0.00 0.00 -0.12 0.00 0.00 57.88 57.15 1nqt h LEU 453 Cb 1.84 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 41.61 1nqt h LEU 453 CO -0.00 1.26 0.20 0.00 -0.62 0.00 0.00 178.44 179.27 1nqt h ALA 454 N 0.20 0.42 -0.40 1.25 0.00 0.98 -2.07 119.26 119.64 1nqt h ALA 454 Ca -0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1nqt h ALA 454 Cb 1.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1nqt h ALA 454 CO 0.12 -0.09 0.14 -0.92 0.00 0.00 0.00 179.25 178.50 1nqt h TYR 455 N 0.42 0.56 -0.06 0.00 5.03 -1.13 -1.84 116.97 119.96 1nqt h TYR 455 Ca 0.12 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.38 1nqt h TYR 455 Cb 0.00 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.11 1nqt h TYR 455 CO -0.04 0.46 -0.05 1.15 -1.32 0.00 0.00 178.16 178.36 1nqt h THR 456 N 0.56 1.36 0.00 1.81 2.02 -1.38 -2.26 112.91 115.02 1nqt h THR 456 Ca 0.14 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.16 1nqt h THR 456 Cb 0.14 2.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.55 1nqt h THR 456 CO -0.01 0.31 -0.02 0.24 0.37 0.00 0.00 175.52 176.41 1nqt h MET 457 N -0.29 0.00 0.00 6.66 2.86 -1.01 0.15 114.93 123.31 1nqt h MET 457 Ca 0.01 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1nqt h MET 457 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1nqt h MET 457 CO 0.01 0.02 -0.39 1.49 1.06 0.00 0.00 176.91 179.10 1nqt h GLU 458 N 0.00 0.00 -0.85 1.72 4.22 -1.30 -2.26 114.58 116.11 1nqt h GLU 458 Ca -0.00 0.00 0.15 0.00 0.08 0.00 0.00 59.36 59.59 1nqt h GLU 458 Cb 0.14 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 1nqt h GLU 458 CO 0.00 0.28 0.43 -0.09 -2.18 0.00 0.00 179.01 177.45 1nqt h ARG 459 N -1.00 0.58 0.00 1.92 2.43 -1.27 0.29 114.38 117.33 1nqt h ARG 459 Ca -0.05 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 1nqt h ARG 459 Cb 0.52 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1nqt h ARG 459 CO -0.03 0.39 -0.49 0.77 -1.51 0.00 0.00 179.97 179.10 1nqt h SER 460 N 0.60 0.00 -0.23 -3.80 0.02 -0.82 -1.05 113.55 108.28 1nqt h SER 460 Ca 0.47 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.34 1nqt h SER 460 Cb 0.69 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 1nqt h SER 460 CO -0.38 0.49 -0.16 0.00 -1.14 0.00 0.00 176.83 175.64 1nqt h ALA 461 N 1.51 0.33 -0.33 3.77 0.00 0.12 -2.43 119.26 122.24 1nqt h ALA 461 Ca -0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 1nqt h ALA 461 Cb 1.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1nqt h ALA 461 CO 0.06 0.24 0.04 0.00 0.00 0.00 0.00 179.25 179.59 1nqt h ARG 462 N 0.23 0.50 -0.32 0.00 2.47 -0.91 0.43 114.38 116.77 1nqt h ARG 462 Ca 0.05 -0.09 -0.05 0.00 -1.26 0.00 0.00 59.98 58.63 1nqt h ARG 462 Cb 0.69 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 1nqt h ARG 462 CO 0.04 0.49 -0.01 1.96 0.56 0.00 0.00 179.97 183.02 1nqt h GLN 463 N 0.48 0.50 -0.07 0.04 4.20 -1.05 -0.24 115.11 118.99 1nqt h GLN 463 Ca 0.11 -0.11 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 1nqt h GLN 463 Cb 0.25 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 27.97 1nqt h GLN 463 CO 0.00 0.54 -0.85 0.82 -0.67 0.00 0.00 178.83 178.67 1nqt h ILE 464 N 0.48 1.34 0.47 2.54 2.04 -0.70 -2.34 117.51 121.35 1nqt h ILE 464 Ca 0.10 -2.19 -0.02 0.00 1.00 0.00 0.00 64.86 63.75 1nqt h ILE 464 Cb 0.33 2.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.61 1nqt h ILE 464 CO 0.01 0.67 -0.23 0.24 0.00 0.00 0.00 178.15 178.84 1nqt h MET 465 N 0.36 -0.61 -0.62 2.37 2.86 -0.43 -2.23 114.93 116.62 1nqt h MET 465 Ca -0.07 0.04 0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1nqt h MET 465 Cb 1.47 0.14 -0.08 0.00 0.06 0.00 0.00 31.60 33.19 1nqt h MET 465 CO 0.16 -0.31 0.20 0.00 1.06 0.00 0.00 176.91 178.03 1nqt h ARG 466 N -0.96 0.35 0.00 1.72 3.08 -1.13 0.87 114.38 118.31 1nqt h ARG 466 Ca -0.07 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1nqt h ARG 466 Cb 0.59 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1nqt h ARG 466 CO 0.11 0.23 0.00 2.41 -1.07 0.00 0.00 179.97 181.65 1nqt n THR 467 N -5.04 1.22 -0.11 2.04 -1.04 -0.88 -0.93 114.28 109.54 1nqt n THR 467 Ca 0.09 0.31 -0.22 0.00 -2.04 0.00 0.00 64.05 62.19 1nqt n THR 467 Cb 0.31 -1.12 -0.11 0.00 -1.82 0.00 0.00 70.33 67.59 1nqt n THR 467 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nqt n ALA 468 N -1.48 0.84 0.27 2.41 0.00 0.21 -3.55 120.51 119.21 1nqt n ALA 468 Ca 0.03 -0.60 0.17 0.00 0.00 0.00 0.00 53.44 53.05 1nqt n ALA 468 Cb 0.12 -0.40 0.93 0.00 0.00 0.00 0.00 19.45 20.09 1nqt n ALA 468 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1nqt h MET 469 N -1.00 0.00 0.52 0.00 2.07 -0.94 -1.70 114.93 113.89 1nqt h MET 469 Ca -0.39 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.21 1nqt h MET 469 Cb 1.31 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 31.05 1nqt h MET 469 CO -0.24 0.00 -0.25 -0.22 1.07 0.00 0.00 176.91 177.27 1nqt h LYS 470 N 0.00 -0.68 -2.00 1.72 3.64 -1.18 -3.17 116.57 114.91 1nqt h LYS 470 Ca 0.04 0.05 -0.50 0.00 -1.27 0.00 0.00 60.65 58.96 1nqt h LYS 470 Cb 0.25 0.15 -0.18 0.00 -0.41 0.00 0.00 32.23 32.05 1nqt h LYS 470 CO -0.00 -0.45 0.40 0.66 -2.27 0.00 0.00 179.45 177.79 1nqt n TYR 471 N -5.22 1.61 -0.86 1.91 4.01 -0.88 -4.88 117.16 112.84 1nqt n TYR 471 Ca -0.09 -1.94 0.00 0.00 -0.16 0.00 0.00 57.90 55.71 1nqt n TYR 471 Cb 0.28 -1.38 0.00 0.00 -0.31 0.00 0.00 39.34 37.93 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 0.86 0.00 -4.87 7.72 4.13 -0.71 -4.83 115.26 117.55 1nqt n ASN 472 Ca 0.49 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 56.45 1nqt n ASN 472 Cb 0.55 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.76 1nqt n ASN 472 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1nqt s LEU 473 N -0.95 3.76 0.00 3.41 1.43 -0.75 -5.00 118.68 120.59 1nqt s LEU 473 Ca 0.00 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.28 1nqt s LEU 473 Cb 0.00 -4.08 0.00 0.00 0.03 0.00 0.00 46.19 42.14 1nqt s LEU 473 CO 0.00 -0.46 0.00 0.61 0.23 0.00 0.00 176.35 176.73 1nqt n GLY 474 N -1.47 -0.43 0.39 -3.19 0.00 -1.26 -4.50 105.19 94.73 1nqt n GLY 474 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.10 1nqt n GLY 474 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1nqt n LEU 475 N -1.95 2.71 -3.23 0.99 7.94 -1.26 -4.73 117.00 117.47 1nqt n LEU 475 Ca 0.00 -2.34 -0.37 0.00 -1.11 0.00 0.00 56.01 52.19 1nqt n LEU 475 Cb 0.00 -0.24 -0.03 0.00 0.53 0.00 0.00 43.42 43.68 1nqt n LEU 475 CO 0.00 0.64 2.78 -0.67 -1.11 0.00 0.00 177.39 179.03 1nqt n ASP 476 N -0.28 8.11 -0.33 1.96 2.03 -1.26 -4.30 116.55 122.48 1nqt n ASP 476 Ca 0.10 -2.83 0.19 0.00 0.52 0.00 0.00 54.79 52.77 1nqt n ASP 476 Cb 0.48 -1.45 0.43 0.00 -0.72 0.00 0.00 41.12 39.86 1nqt n ASP 476 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1nqt h LEU 477 N 6.11 0.59 0.04 -2.67 4.07 -1.85 -1.85 115.31 119.75 1nqt h LEU 477 Ca 0.73 0.10 0.01 0.00 0.08 0.00 0.00 57.88 58.80 1nqt h LEU 477 Cb 0.40 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 1nqt h LEU 477 CO 1.50 0.15 -0.08 -0.09 -1.08 0.00 0.00 178.44 178.84 1nqt h ARG 478 N 0.54 -0.15 0.00 1.13 2.43 -1.82 0.11 114.38 116.62 1nqt h ARG 478 Ca 0.59 0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.64 1nqt h ARG 478 Cb 1.24 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.81 1nqt h ARG 478 CO -0.35 -0.10 -0.66 1.79 -1.51 0.00 0.00 179.97 179.14 1nqt h THR 479 N -0.16 1.47 -0.76 0.20 1.35 -1.81 0.21 112.91 113.41 1nqt h THR 479 Ca 0.02 -2.25 0.04 0.00 -0.55 0.00 0.00 66.41 63.67 1nqt h THR 479 Cb 0.17 2.21 -0.05 0.00 -1.73 0.00 0.00 68.15 68.75 1nqt h THR 479 CO -0.05 0.64 0.47 0.00 -0.25 0.00 0.00 175.52 176.33 1nqt h ALA 480 N 1.34 1.02 0.76 6.62 0.00 -0.94 0.49 119.26 128.55 1nqt h ALA 480 Ca -0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1nqt h ALA 480 Cb 1.16 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1nqt h ALA 480 CO 0.09 0.24 -0.37 0.00 0.00 0.00 0.00 179.25 179.21 1nqt h ALA 481 N 1.34 -1.05 -0.97 0.00 0.00 -0.17 -1.40 119.26 117.01 1nqt h ALA 481 Ca 0.32 -0.22 0.23 0.00 0.00 0.00 0.00 54.91 55.23 1nqt h ALA 481 Cb 0.08 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 1nqt h ALA 481 CO -0.14 -0.98 0.63 1.88 0.00 0.00 0.00 179.25 180.65 1nqt h TYR 482 N -1.24 0.61 0.37 0.00 0.05 -0.68 0.35 116.97 116.43 1nqt h TYR 482 Ca -0.10 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.68 1nqt h TYR 482 Cb 0.78 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 38.34 1nqt h TYR 482 CO 0.01 0.12 -0.23 0.28 -1.05 0.00 0.00 178.16 177.28 1nqt h VAL 483 N 0.42 0.00 -1.64 -2.88 2.07 0.14 -1.30 116.25 113.05 1nqt h VAL 483 Ca 0.52 0.00 0.48 0.00 0.82 0.00 0.00 66.70 68.52 1nqt h VAL 483 Cb 1.30 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 1nqt h VAL 483 CO -0.23 0.00 1.18 -1.13 0.02 0.00 0.00 177.57 177.41 1nqt h ASN 484 N -0.57 0.01 0.02 0.57 -0.00 0.16 0.21 115.58 115.99 1nqt h ASN 484 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.25 1nqt h ASN 484 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.78 1nqt h ASN 484 CO 0.05 -0.00 -0.01 0.00 -0.00 0.00 0.00 177.43 177.46 1nqt h ALA 485 N 1.19 -0.11 -0.78 1.57 0.00 -1.05 -3.06 119.26 117.01 1nqt h ALA 485 Ca 0.79 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.90 1nqt h ALA 485 Cb 3.14 0.01 -0.15 0.00 0.00 0.00 0.00 17.79 20.79 1nqt h ALA 485 CO -0.02 -0.11 -0.01 -0.89 0.00 0.00 0.00 179.25 178.22 1nqt n ILE 486 N -2.52 -0.33 0.00 0.00 2.08 0.28 0.13 119.36 119.00 1nqt n ILE 486 Ca -0.00 1.73 0.00 0.00 0.56 0.00 0.00 62.75 65.03 1nqt n ILE 486 Cb 0.01 -2.51 0.00 0.00 -0.75 0.00 0.00 39.64 36.39 1nqt n ILE 486 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1nqt n GLU 487 N -5.12 0.00 -0.20 0.38 2.13 0.49 -1.26 120.64 117.06 1nqt n GLU 487 Ca 0.18 0.75 -0.03 0.00 0.66 0.00 0.00 57.16 58.72 1nqt n GLU 487 Cb 0.58 -1.48 0.04 0.00 0.27 0.00 0.00 31.44 30.85 1nqt n GLU 487 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1nqt h LYS 488 N 0.00 -0.09 0.00 5.31 1.57 0.12 0.19 116.57 123.68 1nqt h LYS 488 Ca 0.00 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1nqt h LYS 488 Cb 0.00 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1nqt h LYS 488 CO 0.00 -0.06 -0.06 0.28 -0.57 0.00 0.00 179.45 179.04 1nqt h VAL 489 N -0.09 0.85 0.36 0.50 2.07 -1.19 -2.78 116.25 115.98 1nqt h VAL 489 Ca 0.27 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1nqt h VAL 489 Cb 0.51 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1nqt h VAL 489 CO -0.65 0.06 -0.17 0.15 0.02 0.00 0.00 177.57 176.97 1nqt h PHE 490 N 0.00 -0.45 -1.00 1.57 3.57 0.71 -2.72 116.94 118.62 1nqt h PHE 490 Ca -0.00 -0.01 0.30 0.00 3.53 0.00 0.00 57.97 61.79 1nqt h PHE 490 Cb 0.12 0.15 -0.18 0.00 2.79 0.00 0.00 35.95 38.82 1nqt h PHE 490 CO 0.00 -0.28 0.13 -0.22 -2.23 0.00 0.00 178.31 175.71 1nqt h LYS 491 N -1.00 0.01 0.24 1.11 3.64 -1.03 0.83 116.57 120.36 1nqt h LYS 491 Ca -0.05 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1nqt h LYS 491 Cb 0.37 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1nqt h LYS 491 CO 0.08 0.00 -0.12 0.28 -2.27 0.00 0.00 179.45 177.43 1nqt h VAL 492 N 0.01 0.78 -0.82 2.00 2.07 -1.53 -0.24 116.25 118.51 1nqt h VAL 492 Ca 0.65 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 68.09 1nqt h VAL 492 Cb 1.45 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 1nqt h VAL 492 CO -0.90 0.02 0.55 1.88 0.02 0.00 0.00 177.57 179.14 1nqt h TYR 493 N -0.37 1.03 0.52 1.57 0.05 0.04 -3.16 116.97 116.65 1nqt h TYR 493 Ca -0.03 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 1nqt h TYR 493 Cb 0.28 -0.35 0.01 0.00 1.01 0.00 0.00 36.73 37.68 1nqt h TYR 493 CO -0.05 0.65 -0.25 -0.97 -1.05 0.00 0.00 178.16 176.49 1nqt h ASN 494 N 1.11 -0.59 0.00 3.88 -0.00 0.77 -1.98 115.58 118.77 1nqt h ASN 494 Ca 0.30 -0.02 -0.14 0.00 -0.00 0.00 0.00 56.30 56.44 1nqt h ASN 494 Cb -0.12 0.15 -0.00 0.00 -0.00 0.00 0.00 38.32 38.35 1nqt h ASN 494 CO -0.07 -0.19 1.15 -0.62 -0.00 0.00 0.00 177.43 177.71 1nqt n GLU 495 N -5.25 0.92 0.00 6.67 1.02 -0.13 -3.25 120.64 120.62 1nqt n GLU 495 Ca -0.09 -0.71 0.00 0.00 -0.02 0.00 0.00 57.16 56.33 1nqt n GLU 495 Cb 0.30 -1.99 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 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 3.80 0.00 0.00 0.62 0.00 -1.25 -4.98 120.51 118.70 1nqt n ALA 496 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1nqt n ALA 496 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1nqt n ALA 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nqt n GLY 497 N -0.33 -0.09 0.21 0.00 0.00 -0.75 -4.16 105.19 100.08 1nqt n GLY 497 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 1.61 0.24 -1.26 -4.65 118.33 114.27 1nqt n VAL 498 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1nqt n VAL 498 Cb 0.00 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 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 -1.61 0.00 -2.48 3.34 -1.04 -1.26 -4.54 114.28 106.69 1nqt n THR 499 Ca 0.00 -0.06 -0.09 0.00 -2.04 0.00 0.00 64.05 61.86 1nqt n THR 499 Cb 0.00 0.95 0.04 0.00 -1.82 0.00 0.00 70.33 69.50 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 -0.14 1.72 1.99 -1.42 3.01 -1.26 -5.30 117.46 116.05 1nqt n PHE 500 Ca 0.00 -2.08 0.16 0.00 1.01 0.00 0.00 57.45 56.54 1nqt n PHE 500 Cb 0.00 -0.27 0.94 0.00 -0.01 0.00 0.00 39.48 40.14 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40