#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 3.60 0.99 0.11 0.02 -1.26 -5.04 135.00 133.43 1nqt s PRO 7 Ca 0.00 0.78 -0.11 0.00 0.02 0.00 0.00 61.00 61.69 1nqt s PRO 7 Cb 0.00 -2.08 0.19 0.00 0.02 0.00 0.00 34.50 32.63 1nqt s PRO 7 CO 0.00 -0.57 1.10 -0.80 -0.33 0.00 0.00 177.00 176.41 1nqt s ASN 8 N -4.06 2.33 0.11 2.53 0.01 -1.26 -4.89 114.94 109.72 1nqt s ASN 8 Ca 0.56 1.93 -0.23 0.00 -0.71 0.00 0.00 52.86 54.41 1nqt s ASN 8 Cb -0.11 -2.47 -0.09 0.00 0.41 0.00 0.00 41.25 38.99 1nqt s ASN 8 CO 0.52 -3.43 1.70 2.19 -1.51 0.00 0.00 177.10 176.58 1nqt h PHE 9 N -2.09 -0.18 0.00 2.20 -5.15 -1.99 -3.03 116.94 106.69 1nqt h PHE 9 Ca -0.50 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.28 1nqt h PHE 9 Cb 1.29 0.09 0.00 0.00 0.22 0.00 0.00 35.95 37.55 1nqt h PHE 9 CO 0.42 -0.12 0.00 0.34 -2.00 0.00 0.00 178.31 176.96 1nqt n PHE 10 N -5.20 0.00 -0.66 6.09 7.35 -1.26 -0.96 117.46 122.82 1nqt n PHE 10 Ca -0.05 0.00 0.51 0.00 -0.76 0.00 0.00 57.45 57.14 1nqt n PHE 10 Cb 0.12 -0.18 0.80 0.00 0.35 0.00 0.00 39.48 40.57 1nqt n PHE 10 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1nqt h LYS 11 N 0.00 0.00 0.05 -4.13 1.79 -1.94 0.65 116.57 112.99 1nqt h LYS 11 Ca 0.00 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.20 1nqt h LYS 11 Cb 0.00 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.67 1nqt h LYS 11 CO 0.00 0.00 -1.10 0.52 -1.08 0.00 0.00 179.45 177.79 1nqt h MET 12 N 0.00 0.66 -0.06 3.15 2.86 -0.92 -0.23 114.93 120.39 1nqt h MET 12 Ca 0.89 -0.77 -0.22 0.00 -2.06 0.00 0.00 59.70 57.54 1nqt h MET 12 Cb 3.65 0.23 0.01 0.00 0.06 0.00 0.00 31.60 35.56 1nqt h MET 12 CO -0.01 1.34 -0.81 0.28 1.06 0.00 0.00 176.91 178.77 1nqt h VAL 13 N 0.31 1.32 0.37 -2.22 2.07 0.15 0.24 116.25 118.48 1nqt h VAL 13 Ca -0.15 -2.07 -0.00 0.00 0.82 0.00 0.00 66.70 65.29 1nqt h VAL 13 Cb 1.76 2.28 -0.02 0.00 -1.52 0.00 0.00 31.29 33.79 1nqt h VAL 13 CO 0.21 0.64 -0.39 -0.08 0.02 0.00 0.00 177.57 177.97 1nqt h GLU 14 N 0.31 -0.76 -0.52 1.57 4.81 -1.02 0.14 114.58 119.12 1nqt h GLU 14 Ca -0.08 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.29 1nqt h GLU 14 Cb 1.47 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 30.92 1nqt h GLU 14 CO 0.16 -0.51 -0.38 0.78 -0.73 0.00 0.00 179.01 178.34 1nqt h GLY 15 N -0.79 -0.31 0.39 1.92 0.00 -0.95 0.55 103.07 103.89 1nqt h GLY 15 Ca -0.03 0.48 0.15 0.00 0.00 0.00 0.00 47.33 47.94 1nqt h GLY 15 CO -0.08 -0.19 0.61 0.74 0.00 0.00 0.00 176.54 177.62 1nqt h PHE 16 N -0.23 0.99 0.77 5.60 0.05 -0.43 -1.03 116.94 122.66 1nqt h PHE 16 Ca 0.19 0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.97 1nqt h PHE 16 Cb 0.56 -0.31 0.01 0.00 2.00 0.00 0.00 35.95 38.21 1nqt h PHE 16 CO -0.64 0.33 -0.37 0.35 -0.18 0.00 0.00 178.31 177.81 1nqt h PHE 17 N 0.81 -0.95 -1.02 -0.55 3.57 0.20 -2.00 116.94 117.00 1nqt h PHE 17 Ca 0.50 -0.02 0.25 0.00 3.53 0.00 0.00 57.97 62.23 1nqt h PHE 17 Cb 0.71 0.32 -0.10 0.00 2.79 0.00 0.00 35.95 39.67 1nqt h PHE 17 CO -0.00 -0.58 0.65 -0.44 -2.23 0.00 0.00 178.31 175.70 1nqt h ASP 18 N -1.21 0.51 0.00 0.41 3.32 -0.39 0.69 116.42 119.76 1nqt h ASP 18 Ca -0.11 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1nqt h ASP 18 Cb 0.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1nqt h ASP 18 CO 0.17 0.12 0.00 -1.14 -1.72 0.00 0.00 179.24 176.68 1nqt n ARG 19 N -4.66 0.00 -0.19 3.56 0.00 -0.43 -2.02 116.66 112.92 1nqt n ARG 19 Ca 0.25 0.43 -0.02 0.00 -0.00 0.00 0.00 57.85 58.50 1nqt n ARG 19 Cb 0.80 -1.35 0.04 0.00 0.00 0.00 0.00 32.46 31.95 1nqt n ARG 19 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1nqt h GLY 20 N 0.00 0.26 -0.77 5.14 0.00 -0.82 -1.01 103.07 105.87 1nqt h GLY 20 Ca 0.00 0.27 0.08 0.00 0.00 0.00 0.00 47.33 47.69 1nqt h GLY 20 CO 0.00 -0.23 -0.41 0.00 0.00 0.00 0.00 176.54 175.90 1nqt n ALA 21 N -3.06 -0.38 0.12 3.60 0.00 0.24 -0.08 120.51 120.94 1nqt n ALA 21 Ca 0.06 0.68 -0.13 0.00 0.00 0.00 0.00 53.44 54.05 1nqt n ALA 21 Cb 0.33 -0.17 -0.08 0.00 0.00 0.00 0.00 19.45 19.53 1nqt n ALA 21 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nqt h SER 22 N 0.00 -0.19 0.00 0.00 0.02 -0.58 -1.37 113.55 111.42 1nqt h SER 22 Ca 0.16 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1nqt h SER 22 Cb 0.35 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1nqt h SER 22 CO -0.73 -0.09 0.00 -0.38 -1.14 0.00 0.00 176.83 174.48 1nqt n ILE 23 N -5.17 0.00 0.00 3.27 5.41 0.88 -1.43 119.36 122.32 1nqt n ILE 23 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.66 1nqt n ILE 23 Cb 0.13 -0.64 0.00 0.00 -0.71 0.00 0.00 39.64 38.42 1nqt n ILE 23 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1nqt n VAL 24 N -0.73 0.00 -0.14 1.39 0.31 -0.62 -4.76 118.33 113.77 1nqt n VAL 24 Ca 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.22 1nqt n VAL 24 Cb 0.01 -0.68 -0.09 0.00 -0.91 0.00 0.00 33.84 32.16 1nqt n VAL 24 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1nqt h GLU 25 N 0.00 -0.33 0.01 5.55 4.81 -0.12 0.62 114.58 125.12 1nqt h GLU 25 Ca 0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1nqt h GLU 25 Cb 0.75 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.21 1nqt h GLU 25 CO 0.00 -0.22 -0.01 -0.44 -0.73 0.00 0.00 179.01 177.61 1nqt h ASP 26 N -0.35 -0.02 -0.82 1.04 3.32 -1.88 -2.37 116.42 115.34 1nqt h ASP 26 Ca 0.07 0.00 0.23 0.00 0.02 0.00 0.00 57.03 57.36 1nqt h ASP 26 Cb 0.54 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.06 1nqt h ASP 26 CO -0.57 -0.01 0.59 0.11 -1.72 0.00 0.00 179.24 177.64 1nqt h LYS 27 N -0.02 0.03 -0.94 3.56 1.79 -1.84 0.98 116.57 120.12 1nqt h LYS 27 Ca -0.00 -0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.55 1nqt h LYS 27 Cb 0.02 -0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 30.59 1nqt h LYS 27 CO 0.00 0.02 0.59 1.25 -1.08 0.00 0.00 179.45 180.23 1nqt h LEU 28 N 0.03 0.91 0.00 2.94 5.85 0.78 -3.29 115.31 122.53 1nqt h LEU 28 Ca 0.39 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.14 1nqt h LEU 28 Cb 1.52 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.39 1nqt h LEU 28 CO -0.02 0.54 0.00 0.52 -0.34 0.00 0.00 178.44 179.14 1nqt n VAL 29 N -4.60 0.00 0.00 1.05 0.31 0.32 -4.15 118.33 111.26 1nqt n VAL 29 Ca 0.15 0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1nqt n VAL 29 Cb 0.25 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 1nqt n VAL 29 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1nqt n GLU 30 N 0.00 0.00 0.00 5.55 1.02 -1.14 -0.11 120.64 125.96 1nqt n GLU 30 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1nqt n GLU 30 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1nqt n GLU 30 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1nqt n ASP 31 N 0.00 0.00 -0.02 1.62 5.68 -1.26 -0.66 116.55 121.92 1nqt n ASP 31 Ca 0.00 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.34 1nqt n ASP 31 Cb 0.00 -0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 39.87 1nqt n ASP 31 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1nqt n LEU 32 N -0.64 0.00 -2.39 -2.12 4.77 -0.70 -4.88 117.00 111.04 1nqt n LEU 32 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1nqt n LEU 32 Cb 0.01 0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1nqt n LEU 32 CO 0.00 0.05 0.51 -2.11 -1.33 0.00 0.00 177.39 174.51 1nqt n ARG 33 N -2.06 0.66 -0.07 3.23 1.85 0.85 -4.97 116.66 116.15 1nqt n ARG 33 Ca -0.05 -0.90 0.12 0.00 -1.00 0.00 0.00 57.85 56.01 1nqt n ARG 33 Cb 0.45 0.10 0.21 0.00 -1.05 0.00 0.00 32.46 32.17 1nqt n ARG 33 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1nqt n THR 34 N -0.68 0.19 0.39 8.89 -1.04 -0.80 -4.23 114.28 117.01 1nqt n THR 34 Ca -0.13 -0.55 0.05 0.00 -2.04 0.00 0.00 64.05 61.38 1nqt n THR 34 Cb 0.71 1.11 0.19 0.00 -1.82 0.00 0.00 70.33 70.53 1nqt n THR 34 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1nqt n ARG 35 N 1.19 2.47 -0.10 -2.82 1.74 -1.26 -3.32 116.66 114.55 1nqt n ARG 35 Ca 0.17 -1.49 0.00 0.00 -0.77 0.00 0.00 57.85 55.76 1nqt n ARG 35 Cb 0.55 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1nqt n ARG 35 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1nqt n GLU 36 N 0.45 0.00 -1.63 5.56 -0.00 -1.26 -5.14 120.64 118.63 1nqt n GLU 36 Ca 0.13 -0.11 -0.64 0.00 -0.00 0.00 0.00 57.16 56.55 1nqt n GLU 36 Cb 0.54 -0.09 -0.09 0.00 -0.00 0.00 0.00 31.44 31.80 1nqt n GLU 36 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1nqt n SER 37 N 0.00 0.68 -4.04 -1.84 2.88 -1.21 -4.97 113.62 105.13 1nqt n SER 37 Ca 0.00 1.17 -0.32 0.00 -1.33 0.00 0.00 58.87 58.39 1nqt n SER 37 Cb 0.51 -0.89 -0.15 0.00 -0.75 0.00 0.00 64.21 62.93 1nqt n SER 37 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1nqt s GLU 38 N 1.71 1.65 0.00 -1.46 2.02 -1.26 -4.79 118.70 116.57 1nqt s GLU 38 Ca 0.98 -1.80 0.00 0.00 0.02 0.00 0.00 54.97 54.17 1nqt s GLU 38 Cb -1.39 -3.21 0.00 0.00 0.10 0.00 0.00 34.13 29.63 1nqt s GLU 38 CO 0.71 -0.90 0.00 0.39 0.02 0.00 0.00 175.26 175.47 1nqt n GLU 39 N 4.32 0.00 -2.77 1.61 1.02 -1.26 -3.21 120.64 120.34 1nqt n GLU 39 Ca 0.01 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1nqt n GLU 39 Cb 0.42 -2.60 0.02 0.00 -0.02 0.00 0.00 31.44 29.26 1nqt n GLU 39 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1nqt n GLN 40 N -1.94 -3.43 -0.48 3.49 0.00 -1.26 -4.84 117.38 108.93 1nqt n GLN 40 Ca 0.00 0.68 0.08 0.00 -0.00 0.00 0.00 57.00 57.76 1nqt n GLN 40 Cb 0.00 -5.05 0.26 0.00 0.00 0.00 0.00 30.24 25.45 1nqt n GLN 40 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1nqt n LYS 41 N -3.11 2.97 0.11 3.69 5.02 -1.20 -4.00 118.16 121.65 1nqt n LYS 41 Ca -0.09 -2.87 0.05 0.00 -2.02 0.00 0.00 58.31 53.37 1nqt n LYS 41 Cb 0.59 -1.87 0.01 0.00 -0.02 0.00 0.00 35.03 33.75 1nqt n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nqt h ARG 42 N 1.87 0.00 0.00 1.97 3.08 -1.89 -2.16 114.38 117.25 1nqt h ARG 42 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1nqt h ARG 42 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.54 1nqt h ARG 42 CO 0.25 0.25 0.00 -0.97 -1.07 0.00 0.00 179.97 178.42 1nqt h ASN 43 N 0.00 0.00 0.22 7.04 -1.24 -1.96 0.38 115.58 120.02 1nqt h ASN 43 Ca -0.05 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.96 1nqt h ASN 43 Cb 1.30 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.35 1nqt h ASN 43 CO 0.04 0.00 -0.24 -1.14 -1.29 0.00 0.00 177.43 174.79 1nqt n ARG 44 N -2.35 0.88 -3.08 6.67 0.63 -0.81 -3.93 116.66 114.67 1nqt n ARG 44 Ca 0.01 -0.52 -0.43 0.00 -0.92 0.00 0.00 57.85 56.00 1nqt n ARG 44 Cb 0.19 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 31.62 1nqt n ARG 44 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1nqt n VAL 45 N -0.61 5.10 -0.08 5.15 3.14 0.13 -3.29 118.33 127.87 1nqt n VAL 45 Ca 0.13 -5.82 0.00 0.00 -2.96 0.00 0.00 64.34 55.69 1nqt n VAL 45 Cb 0.35 -2.17 0.00 0.00 -1.06 0.00 0.00 33.84 30.96 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 1.54 1.46 -0.03 1.45 -4.01 -1.25 -4.68 116.66 111.13 1nqt n ARG 46 Ca 0.26 -0.01 0.01 0.00 -1.04 0.00 0.00 57.85 57.07 1nqt n ARG 46 Cb 0.34 -0.17 0.34 0.00 -3.04 0.00 0.00 32.46 29.93 1nqt n ARG 46 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 1nqt h GLY 47 N 0.00 0.63 -0.15 2.89 0.00 -1.86 -1.23 103.07 103.35 1nqt h GLY 47 Ca 0.00 -0.30 0.16 0.00 0.00 0.00 0.00 47.33 47.19 1nqt h GLY 47 CO 0.00 0.29 0.13 -2.22 0.00 0.00 0.00 176.54 174.73 1nqt h ILE 48 N 0.59 0.47 0.00 2.60 1.08 -1.87 1.67 117.51 122.04 1nqt h ILE 48 Ca 0.14 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.54 1nqt h ILE 48 Cb 0.13 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.11 1nqt h ILE 48 CO -0.01 0.04 0.00 -0.07 -0.69 0.00 0.00 178.15 177.41 1nqt h LEU 49 N 0.21 0.00 0.07 1.44 4.07 -1.58 0.12 115.31 119.65 1nqt h LEU 49 Ca 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.37 1nqt h LEU 49 Cb 0.71 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.45 1nqt h LEU 49 CO -0.55 0.00 -0.04 -0.09 -1.08 0.00 0.00 178.44 176.69 1nqt h ARG 50 N 0.00 -0.09 -0.76 1.13 2.43 0.25 -2.91 114.38 114.42 1nqt h ARG 50 Ca 0.00 0.01 0.29 0.00 -0.81 0.00 0.00 59.98 59.47 1nqt h ARG 50 Cb 0.45 0.02 -0.14 0.00 -0.42 0.00 0.00 29.97 29.88 1nqt h ARG 50 CO 0.00 -0.06 0.31 -0.89 -1.51 0.00 0.00 179.97 177.81 1nqt n ILE 51 N -2.43 -0.32 0.26 1.20 5.41 0.16 0.18 119.36 123.82 1nqt n ILE 51 Ca -0.01 1.59 0.15 0.00 1.00 0.00 0.00 62.75 65.48 1nqt n ILE 51 Cb 0.04 -2.50 0.54 0.00 -0.71 0.00 0.00 39.64 37.01 1nqt n ILE 51 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1nqt h ILE 52 N 0.00 0.04 0.14 1.39 2.04 -0.78 -3.33 117.51 117.01 1nqt h ILE 52 Ca 0.60 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1nqt h ILE 52 Cb 1.51 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1nqt h ILE 52 CO -0.62 0.02 -0.07 0.50 0.00 0.00 0.00 178.15 177.98 1nqt h LYS 53 N 0.00 -0.18 -7.00 2.37 3.64 0.21 -3.46 116.57 112.15 1nqt h LYS 53 Ca -0.00 0.01 -0.46 0.00 -1.27 0.00 0.00 60.65 58.93 1nqt h LYS 53 Cb 0.65 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 1nqt h LYS 53 CO 0.00 0.22 0.29 -1.25 -2.27 0.00 0.00 179.45 176.44 1nqt s PRO 54 N -4.30 4.13 0.33 1.90 0.04 -1.25 -5.00 135.00 130.85 1nqt s PRO 54 Ca -0.15 0.98 -0.28 0.00 0.04 0.00 0.00 61.00 61.59 1nqt s PRO 54 Cb 0.02 -2.23 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 1nqt s PRO 54 CO 0.59 -0.03 1.25 0.00 0.04 0.00 0.00 177.00 178.85 1nqt h ASN 56 N 3.38 0.12 -4.88 0.00 2.35 -0.47 -3.47 115.58 112.60 1nqt h ASN 56 Ca -0.48 -0.18 -0.22 0.00 -0.55 0.00 0.00 56.30 54.87 1nqt h ASN 56 Cb 1.22 -0.04 -0.20 0.00 0.05 0.00 0.00 38.32 39.35 1nqt h ASN 56 CO 0.65 1.16 -0.71 -1.00 -1.65 0.00 0.00 177.43 175.88 1nqt s HIS 57 N -2.64 0.49 -0.27 1.19 3.76 -0.97 -5.06 115.29 111.79 1nqt s HIS 57 Ca -0.05 -0.57 -0.02 0.00 -0.15 0.00 0.00 55.06 54.27 1nqt s HIS 57 Cb 0.08 -0.31 0.16 0.00 1.11 0.00 0.00 32.58 33.62 1nqt s HIS 57 CO 0.83 -0.15 0.49 0.08 -0.85 0.00 0.00 174.74 175.14 1nqt s VAL 58 N -1.69 -0.80 -0.22 -0.90 1.01 -1.26 -1.28 120.40 115.26 1nqt s VAL 58 Ca -0.11 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 1nqt s VAL 58 Cb -0.08 -0.90 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1nqt s VAL 58 CO -0.01 -0.06 0.16 -0.22 0.00 0.00 0.00 175.10 174.98 1nqt s LEU 59 N 2.70 4.15 -0.12 3.92 2.96 0.03 -4.96 118.68 127.36 1nqt s LEU 59 Ca 0.16 0.18 0.02 0.00 -0.22 0.00 0.00 54.13 54.27 1nqt s LEU 59 Cb -0.15 -2.12 -0.00 0.00 0.50 0.00 0.00 46.19 44.41 1nqt s LEU 59 CO -0.18 0.10 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.31 1nqt s SER 60 N 0.80 3.40 0.04 3.68 0.01 -1.26 -1.00 113.70 119.37 1nqt s SER 60 Ca 0.08 -0.50 -0.01 0.00 1.31 0.00 0.00 55.95 56.84 1nqt s SER 60 Cb -0.13 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.58 1nqt s SER 60 CO 0.02 0.14 -0.03 -1.48 0.41 0.00 0.00 173.24 172.30 1nqt s LEU 61 N 0.49 2.39 -0.20 2.44 0.05 0.58 -5.01 118.68 119.42 1nqt s LEU 61 Ca -0.13 -0.81 -0.01 0.00 0.05 0.00 0.00 54.13 53.23 1nqt s LEU 61 Cb -0.17 0.15 0.06 0.00 -2.05 0.00 0.00 46.19 44.18 1nqt s LEU 61 CO 0.05 -0.48 -0.02 -0.94 -0.55 0.00 0.00 176.35 174.41 1nqt s SER 62 N -2.35 3.26 0.29 1.48 1.04 -1.26 -0.35 113.70 115.81 1nqt s SER 62 Ca -0.02 -0.92 0.09 0.00 0.48 0.00 0.00 55.95 55.58 1nqt s SER 62 Cb 0.01 -0.90 -0.06 0.00 0.10 0.00 0.00 66.02 65.17 1nqt s SER 62 CO -0.06 -0.25 -0.12 0.72 0.98 0.00 0.00 173.24 174.51 1nqt s PHE 63 N 1.62 2.16 0.33 5.02 -0.12 0.13 -4.91 117.98 122.22 1nqt s PHE 63 Ca -0.03 -0.51 0.08 0.00 -0.05 0.00 0.00 56.93 56.42 1nqt s PHE 63 Cb -0.17 -1.12 -0.03 0.00 -0.63 0.00 0.00 43.02 41.06 1nqt s PHE 63 CO -0.07 0.52 0.21 -1.25 -0.05 0.00 0.00 175.22 174.58 1nqt s PRO 64 N -3.62 2.56 -0.12 1.99 0.04 -1.26 0.10 135.00 134.69 1nqt s PRO 64 Ca 0.30 -1.41 -0.21 0.00 0.04 0.00 0.00 61.00 59.72 1nqt s PRO 64 Cb 0.00 -2.33 0.05 0.00 0.04 0.00 0.00 34.50 32.26 1nqt s PRO 64 CO 0.14 0.12 0.53 0.96 0.04 0.00 0.00 177.00 178.78 1nqt s ILE 65 N -2.36 0.01 -0.26 0.56 -5.25 -0.71 -4.90 121.20 108.31 1nqt s ILE 65 Ca 0.39 -0.10 -0.18 0.00 -0.99 0.00 0.00 60.65 59.77 1nqt s ILE 65 Cb -0.04 -0.79 -0.03 0.00 2.95 0.00 0.00 42.46 44.55 1nqt s ILE 65 CO 0.25 -0.06 0.51 -0.60 -1.79 0.00 0.00 174.94 173.25 1nqt s ARG 66 N -0.45 4.08 1.01 0.37 3.52 -1.26 -2.34 118.95 123.87 1nqt s ARG 66 Ca -0.06 0.33 -0.13 0.00 -0.13 0.00 0.00 55.73 55.74 1nqt s ARG 66 Cb -0.03 -3.64 0.19 0.00 -1.56 0.00 0.00 34.95 29.91 1nqt s ARG 66 CO 0.04 -0.33 1.10 1.03 -0.81 0.00 0.00 175.30 176.33 1nqt s ARG 67 N 2.25 0.35 0.10 5.12 0.52 -0.48 -4.88 118.95 121.93 1nqt s ARG 67 Ca 0.21 0.40 -0.28 0.00 -0.52 0.00 0.00 55.73 55.54 1nqt s ARG 67 Cb -0.16 -1.74 -0.10 0.00 0.52 0.00 0.00 34.95 33.47 1nqt s ARG 67 CO 0.09 -2.76 1.64 -0.44 0.02 0.00 0.00 175.30 173.85 1nqt h ASP 68 N -1.91 -0.76 -1.44 0.23 5.19 -1.95 -2.20 116.42 113.57 1nqt h ASP 68 Ca -0.53 0.08 0.43 0.00 -0.62 0.00 0.00 57.03 56.39 1nqt h ASP 68 Cb 1.33 0.28 -0.09 0.00 0.18 0.00 0.00 39.33 41.03 1nqt h ASP 68 CO 0.57 -0.38 0.99 -2.24 -3.12 0.00 0.00 179.24 175.06 1nqt h ASP 69 N -0.53 0.14 0.00 6.45 3.04 -2.04 -3.44 116.42 120.03 1nqt h ASP 69 Ca 0.01 0.06 0.00 0.00 -3.24 0.00 0.00 57.03 53.86 1nqt h ASP 69 Cb 0.53 0.04 0.00 0.00 -1.04 0.00 0.00 39.33 38.86 1nqt h ASP 69 CO -0.11 -0.05 0.00 0.61 -2.04 0.00 0.00 179.24 177.65 1nqt n GLY 70 N -1.69 1.29 3.79 7.15 0.00 -0.83 -5.12 105.19 109.77 1nqt n GLY 70 Ca 0.35 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.36 7.30 -0.02 1.61 1.04 -1.26 -4.77 113.70 116.24 1nqt s SER 71 Ca 0.00 1.68 -0.19 0.00 0.48 0.00 0.00 55.95 57.92 1nqt s SER 71 Cb 0.00 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.55 1nqt s SER 71 CO 0.00 0.05 0.53 0.26 0.98 0.00 0.00 173.24 175.06 1nqt s TRP 72 N -1.44 3.66 -0.00 5.02 0.51 -1.26 -1.38 118.94 124.04 1nqt s TRP 72 Ca 0.44 1.10 0.01 0.00 -2.12 0.00 0.00 56.10 55.53 1nqt s TRP 72 Cb -0.20 -2.53 -0.00 0.00 -0.81 0.00 0.00 33.47 29.93 1nqt s TRP 72 CO 0.24 0.38 -0.03 -2.00 -0.51 0.00 0.00 176.95 175.03 1nqt s GLU 73 N -0.24 0.29 -0.38 4.98 2.12 -0.99 -4.99 118.70 119.50 1nqt s GLU 73 Ca 0.28 -0.12 -0.13 0.00 0.36 0.00 0.00 54.97 55.37 1nqt s GLU 73 Cb -0.17 -0.29 0.01 0.00 0.26 0.00 0.00 34.13 33.94 1nqt s GLU 73 CO 0.15 0.07 0.25 0.08 -0.54 0.00 0.00 175.26 175.26 1nqt s VAL 74 N -0.03 4.99 0.11 3.70 1.01 -1.26 -1.73 120.40 127.19 1nqt s VAL 74 Ca 0.01 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 1nqt s VAL 74 Cb -0.02 -3.72 -0.07 0.00 0.00 0.00 0.00 36.38 32.57 1nqt s VAL 74 CO -0.00 -0.20 0.51 -0.63 0.00 0.00 0.00 175.10 174.77 1nqt s ILE 75 N 1.64 4.90 0.01 2.22 1.09 0.28 -4.84 121.20 126.50 1nqt s ILE 75 Ca 0.04 0.81 0.08 0.00 -1.10 0.00 0.00 60.65 60.48 1nqt s ILE 75 Cb -0.19 -3.74 -0.03 0.00 -1.06 0.00 0.00 42.46 37.45 1nqt s ILE 75 CO 0.09 0.33 -0.24 -1.83 -0.10 0.00 0.00 174.94 173.19 1nqt s GLU 76 N -1.73 2.03 0.35 2.79 -1.05 -1.26 0.17 118.70 120.00 1nqt s GLU 76 Ca 0.34 -0.98 -0.17 0.00 -0.15 0.00 0.00 54.97 54.01 1nqt s GLU 76 Cb -0.16 -2.07 0.04 0.00 -0.44 0.00 0.00 34.13 31.51 1nqt s GLU 76 CO 0.18 0.55 0.76 0.20 0.95 0.00 0.00 175.26 177.90 1nqt s GLY 77 N -0.94 0.24 0.04 -3.83 0.00 0.53 -0.93 107.32 102.43 1nqt s GLY 77 Ca 0.11 -0.63 -0.26 0.00 0.00 0.00 0.00 44.72 43.94 1nqt s GLY 77 CO 0.01 -0.25 0.61 -2.52 0.00 0.00 0.00 173.10 170.95 1nqt s TYR 78 N -2.82 -0.56 -0.01 1.90 -0.85 0.66 -0.31 117.35 115.35 1nqt s TYR 78 Ca 0.14 0.72 0.03 0.00 -0.52 0.00 0.00 57.07 57.44 1nqt s TYR 78 Cb -0.05 0.44 -0.01 0.00 0.38 0.00 0.00 41.96 42.72 1nqt s TYR 78 CO 0.10 -0.69 -0.09 0.50 -1.52 0.00 0.00 175.55 173.84 1nqt s ARG 79 N -2.29 0.81 -0.06 -3.49 3.52 -0.17 -0.14 118.95 117.13 1nqt s ARG 79 Ca -0.06 -0.34 0.03 0.00 -0.13 0.00 0.00 55.73 55.24 1nqt s ARG 79 Cb -0.01 -0.78 0.01 0.00 -1.56 0.00 0.00 34.95 32.61 1nqt s ARG 79 CO -0.00 0.19 -0.15 0.00 -0.81 0.00 0.00 175.30 174.53 1nqt s ALA 80 N -0.15 1.42 -0.30 6.12 0.00 0.19 -0.79 121.76 128.25 1nqt s ALA 80 Ca 0.03 -0.55 -0.08 0.00 0.00 0.00 0.00 51.96 51.35 1nqt s ALA 80 Cb -0.05 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1nqt s ALA 80 CO -0.00 0.18 0.11 -0.65 0.00 0.00 0.00 175.76 175.40 1nqt s GLN 81 N 0.42 3.20 0.00 0.00 -0.21 -0.41 0.07 119.66 122.74 1nqt s GLN 81 Ca -0.11 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.47 1nqt s GLN 81 Cb -0.14 -3.46 0.00 0.00 1.00 0.00 0.00 33.01 30.41 1nqt s GLN 81 CO 0.04 -0.43 0.37 1.58 -2.12 0.00 0.00 175.29 174.73 1nqt n HIS 82 N 4.92 0.00 -4.94 0.91 -0.00 0.78 -2.30 115.22 114.59 1nqt n HIS 82 Ca -0.14 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.28 1nqt n HIS 82 Cb 0.48 -0.08 -0.15 0.00 -0.00 0.00 0.00 29.99 30.25 1nqt n HIS 82 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nqt s SER 83 N -1.76 3.08 0.00 0.26 0.15 -1.22 -0.34 113.70 113.87 1nqt s SER 83 Ca 0.00 -0.57 0.20 0.00 0.70 0.00 0.00 55.95 56.28 1nqt s SER 83 Cb 0.00 -0.29 0.06 0.00 -1.71 0.00 0.00 66.02 64.09 1nqt s SER 83 CO 0.00 0.26 1.05 1.41 1.20 0.00 0.00 173.24 177.16 1nqt n HIS 84 N 1.88 0.00 -0.17 3.44 -0.00 -1.26 -3.94 115.22 115.17 1nqt n HIS 84 Ca -0.17 0.00 0.16 0.00 -0.00 0.00 0.00 57.72 57.72 1nqt n HIS 84 Cb 0.52 0.00 0.30 0.00 -0.00 0.00 0.00 29.99 30.81 1nqt n HIS 84 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1nqt n GLN 85 N 0.44 -0.03 -3.99 -0.41 10.64 -1.26 -2.64 117.38 120.12 1nqt n GLN 85 Ca 0.10 0.74 -0.33 0.00 -1.83 0.00 0.00 57.00 55.67 1nqt n GLN 85 Cb 0.45 -1.32 -0.14 0.00 -0.86 0.00 0.00 30.24 28.38 1nqt n GLN 85 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.06 175.73 1nqt s ARG 86 N -4.85 2.21 0.01 2.61 6.06 -1.26 -4.99 118.95 118.74 1nqt s ARG 86 Ca -0.05 -1.40 -0.01 0.00 -2.50 0.00 0.00 55.73 51.77 1nqt s ARG 86 Cb 0.18 -3.06 -0.00 0.00 0.06 0.00 0.00 34.95 32.13 1nqt s ARG 86 CO 0.41 -0.65 0.24 2.41 -2.50 0.00 0.00 175.30 175.21 1nqt n THR 87 N 4.48 -0.02 -2.63 4.11 -1.04 -1.08 -2.13 114.28 115.97 1nqt n THR 87 Ca -0.11 0.36 -0.42 0.00 -2.04 0.00 0.00 64.05 61.84 1nqt n THR 87 Cb 0.42 -0.47 -0.03 0.00 -1.82 0.00 0.00 70.33 68.43 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 -3.32 3.26 0.31 -2.82 0.02 -1.26 -4.50 135.00 126.69 1nqt s PRO 88 Ca -0.00 -0.58 -0.29 0.00 0.02 0.00 0.00 61.00 60.15 1nqt s PRO 88 Cb 0.00 -4.43 -0.13 0.00 0.02 0.00 0.00 34.50 29.97 1nqt s PRO 88 CO 0.02 -2.08 1.30 0.00 -0.33 0.00 0.00 177.00 175.91 1nqt s LYS 90 N -1.50 1.62 0.00 0.00 2.47 0.18 0.89 119.74 123.40 1nqt s LYS 90 Ca 0.59 -1.76 0.00 0.00 -1.56 0.00 0.00 55.97 53.23 1nqt s LYS 90 Cb -0.60 -1.56 0.00 0.00 -1.46 0.00 0.00 37.83 34.22 1nqt s LYS 90 CO 0.59 0.24 0.00 0.41 0.16 0.00 0.00 175.35 176.75 1nqt n GLY 91 N -0.60 4.22 3.95 5.54 0.00 -1.23 0.30 105.19 117.36 1nqt n GLY 91 Ca -0.06 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 1nqt n GLY 91 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nqt s GLY 92 N 0.00 1.82 -0.11 -0.02 0.00 -1.25 -2.32 107.32 105.43 1nqt s GLY 92 Ca 0.00 -1.38 0.03 0.00 0.00 0.00 0.00 44.72 43.37 1nqt s GLY 92 CO 0.00 -0.57 -0.21 -0.42 0.00 0.00 0.00 173.10 171.91 1nqt s ILE 93 N -3.89 1.86 -0.16 0.90 1.01 0.25 -0.69 121.20 120.49 1nqt s ILE 93 Ca 0.76 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1nqt s ILE 93 Cb -0.02 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.82 1nqt s ILE 93 CO 0.53 0.51 -0.20 -0.60 0.00 0.00 0.00 174.94 175.19 1nqt s ARG 94 N 0.64 2.88 -0.55 2.79 3.52 0.26 -3.78 118.95 124.70 1nqt s ARG 94 Ca -0.13 -0.79 -0.18 0.00 -0.13 0.00 0.00 55.73 54.50 1nqt s ARG 94 Cb -0.16 -2.45 0.10 0.00 -1.56 0.00 0.00 34.95 30.87 1nqt s ARG 94 CO 0.03 -0.16 0.61 0.71 -0.81 0.00 0.00 175.30 175.68 1nqt s TYR 95 N 1.19 3.09 0.03 5.12 4.12 -1.26 -0.48 117.35 129.16 1nqt s TYR 95 Ca 0.02 -0.95 -0.28 0.00 0.02 0.00 0.00 57.07 55.88 1nqt s TYR 95 Cb -0.14 -3.77 0.07 0.00 -1.52 0.00 0.00 41.96 36.60 1nqt s TYR 95 CO -0.10 -1.13 0.66 0.45 0.02 0.00 0.00 175.55 175.46 1nqt s SER 96 N 3.32 -0.61 0.24 2.29 0.15 -0.11 -4.63 113.70 114.35 1nqt s SER 96 Ca 0.09 0.43 0.05 0.00 0.70 0.00 0.00 55.95 57.22 1nqt s SER 96 Cb -0.24 0.55 0.25 0.00 -1.71 0.00 0.00 66.02 64.87 1nqt s SER 96 CO 0.07 -0.74 1.56 0.71 1.20 0.00 0.00 173.24 176.04 1nqt h THR 97 N 2.59 1.40 0.00 6.45 1.35 -1.79 -2.04 112.91 120.88 1nqt h THR 97 Ca -0.29 -2.04 0.00 0.00 -0.55 0.00 0.00 66.41 63.53 1nqt h THR 97 Cb 1.21 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.68 1nqt h THR 97 CO 0.38 0.60 0.00 -0.90 -0.25 0.00 0.00 175.52 175.35 1nqt n ASP 98 N -3.85 0.00 -4.73 5.36 5.68 -1.26 -4.80 116.55 112.95 1nqt n ASP 98 Ca -0.02 -0.53 -0.42 0.00 -0.50 0.00 0.00 54.79 53.32 1nqt n ASP 98 Cb 0.63 -0.09 -0.03 0.00 -1.14 0.00 0.00 41.12 40.49 1nqt n ASP 98 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1nqt s VAL 99 N -2.17 3.29 0.04 2.12 -7.23 -1.22 -5.02 120.40 110.21 1nqt s VAL 99 Ca 0.32 1.01 0.05 0.00 -1.81 0.00 0.00 61.98 61.55 1nqt s VAL 99 Cb 0.16 -3.65 -0.02 0.00 0.56 0.00 0.00 36.38 33.43 1nqt s VAL 99 CO 0.30 0.13 -0.16 -0.94 -0.31 0.00 0.00 175.10 174.12 1nqt s SER 100 N 0.59 1.85 0.25 4.85 1.04 -1.26 -4.81 113.70 116.20 1nqt s SER 100 Ca 0.59 -0.46 -0.05 0.00 0.48 0.00 0.00 55.95 56.51 1nqt s SER 100 Cb -0.36 -0.13 0.49 0.00 0.10 0.00 0.00 66.02 66.12 1nqt s SER 100 CO 0.35 0.07 1.64 0.58 0.98 0.00 0.00 173.24 176.86 1nqt h VAL 101 N 4.48 0.33 -0.76 5.02 2.07 -1.98 0.43 116.25 125.84 1nqt h VAL 101 Ca -0.39 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.18 1nqt h VAL 101 Cb 1.17 0.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.07 1nqt h VAL 101 CO 0.44 0.02 0.41 0.44 0.02 0.00 0.00 177.57 178.91 1nqt h ASP 102 N 0.13 0.57 0.45 0.57 5.19 -1.98 -0.33 116.42 121.02 1nqt h ASP 102 Ca 0.44 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.88 1nqt h ASP 102 Cb 0.80 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.27 1nqt h ASP 102 CO -0.66 0.32 -0.22 -0.08 -3.12 0.00 0.00 179.24 175.48 1nqt h GLU 103 N 0.69 -0.58 0.57 3.56 4.81 -0.58 0.03 114.58 123.09 1nqt h GLU 103 Ca 0.37 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.62 1nqt h GLU 103 Cb 0.37 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1nqt h GLU 103 CO -0.26 -0.34 -0.43 -0.39 -0.73 0.00 0.00 179.01 176.86 1nqt h VAL 104 N -0.70 0.13 -1.78 0.32 -1.51 -1.22 0.13 116.25 111.63 1nqt h VAL 104 Ca -0.06 0.00 0.54 0.00 -1.23 0.00 0.00 66.70 65.95 1nqt h VAL 104 Cb 0.51 0.13 -0.10 0.00 -2.13 0.00 0.00 31.29 29.71 1nqt h VAL 104 CO 0.10 0.00 1.25 0.29 -1.23 0.00 0.00 177.57 177.98 1nqt n LYS 105 N -5.54 -0.01 -0.06 5.19 5.02 -0.15 0.50 118.16 123.10 1nqt n LYS 105 Ca -0.12 1.14 -0.10 0.00 -2.02 0.00 0.00 58.31 57.21 1nqt n LYS 105 Cb 0.43 -2.50 -0.09 0.00 -0.02 0.00 0.00 35.03 32.86 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 1.20 0.00 -0.94 7.82 0.00 0.25 -3.07 119.26 124.51 1nqt h ALA 106 Ca 0.92 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 55.49 1nqt h ALA 106 Cb 3.47 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 21.22 1nqt h ALA 106 CO -0.17 0.00 0.62 -0.07 0.00 0.00 0.00 179.25 179.64 1nqt h LEU 107 N -1.00 1.06 -0.03 0.00 3.38 0.27 -1.52 115.31 117.46 1nqt h LEU 107 Ca -0.00 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1nqt h LEU 107 Cb 0.72 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1nqt h LEU 107 CO -0.00 0.75 -0.22 0.00 0.09 0.00 0.00 178.44 179.06 1nqt h ALA 108 N 1.36 -0.65 -0.57 1.53 0.00 -0.10 0.52 119.26 121.36 1nqt h ALA 108 Ca 0.36 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.34 1nqt h ALA 108 Cb -0.10 0.73 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 1nqt h ALA 108 CO -0.09 -0.72 -0.17 0.45 0.00 0.00 0.00 179.25 178.72 1nqt n SER 109 N -3.73 -0.26 0.06 0.00 2.88 -0.85 0.80 113.62 112.51 1nqt n SER 109 Ca -0.03 0.98 0.01 0.00 -1.33 0.00 0.00 58.87 58.51 1nqt n SER 109 Cb 0.16 -0.27 0.35 0.00 -0.75 0.00 0.00 64.21 63.70 1nqt n SER 109 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1nqt h LEU 110 N 0.00 0.36 0.46 2.46 5.85 0.06 -3.15 115.31 121.35 1nqt h LEU 110 Ca 0.24 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1nqt h LEU 110 Cb 0.39 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1nqt h LEU 110 CO -0.58 0.46 -0.23 0.24 -0.34 0.00 0.00 178.44 177.99 1nqt h MET 111 N 0.37 -0.61 -1.27 1.25 2.86 0.13 0.14 114.93 117.80 1nqt h MET 111 Ca 0.08 0.04 0.44 0.00 -2.06 0.00 0.00 59.70 58.20 1nqt h MET 111 Cb 0.33 0.14 -0.14 0.00 0.06 0.00 0.00 31.60 31.98 1nqt h MET 111 CO 0.01 -0.41 0.80 0.00 1.06 0.00 0.00 176.91 178.38 1nqt h THR 112 N -0.63 0.09 0.04 2.22 1.03 -1.47 0.87 112.91 115.05 1nqt h THR 112 Ca -0.06 -0.02 -0.08 0.00 -0.01 0.00 0.00 66.41 66.23 1nqt h THR 112 Cb 0.49 0.01 0.00 0.00 -1.07 0.00 0.00 68.15 67.58 1nqt h THR 112 CO 0.10 0.01 -0.41 1.88 -0.01 0.00 0.00 175.52 177.10 1nqt h TYR 113 N 0.07 0.15 -0.64 0.00 0.05 -1.50 -3.12 116.97 111.98 1nqt h TYR 113 Ca 0.84 -0.11 0.10 0.00 0.05 0.00 0.00 58.73 59.61 1nqt h TYR 113 Cb 2.55 -0.01 -0.11 0.00 1.01 0.00 0.00 36.73 40.16 1nqt h TYR 113 CO -0.01 1.16 -0.41 -0.22 -1.05 0.00 0.00 178.16 177.63 1nqt h LYS 114 N -0.82 -0.17 0.00 4.88 3.64 0.34 0.12 116.57 124.56 1nqt h LYS 114 Ca -0.09 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1nqt h LYS 114 Cb 1.22 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1nqt h LYS 114 CO 0.01 -0.12 0.00 0.00 -2.27 0.00 0.00 179.45 177.08 1nqt n ALA 116 N -2.52 -0.09 -0.18 0.00 0.00 -0.18 0.81 120.51 118.35 1nqt n ALA 116 Ca 0.00 0.46 -0.08 0.00 0.00 0.00 0.00 53.44 53.81 1nqt n ALA 116 Cb 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 1nqt n ALA 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1nqt h VAL 117 N 0.00 0.11 -0.62 0.00 2.07 0.20 -1.47 116.25 116.54 1nqt h VAL 117 Ca 0.15 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 67.34 1nqt h VAL 117 Cb 0.27 0.11 -0.19 0.00 -1.52 0.00 0.00 31.29 29.96 1nqt h VAL 117 CO -0.46 0.00 0.42 1.33 0.02 0.00 0.00 177.57 178.88 1nqt n VAL 118 N -5.41 2.45 -4.24 2.57 0.24 0.24 -4.76 118.33 109.42 1nqt n VAL 118 Ca 0.01 -1.29 -0.34 0.00 -2.04 0.00 0.00 64.34 60.67 1nqt n VAL 118 Cb 0.35 -0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 31.92 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 -0.44 -1.82 -4.44 -1.34 8.00 -0.56 -4.93 116.55 111.03 1nqt n ASP 119 Ca 0.37 -1.09 -0.37 0.00 0.71 0.00 0.00 54.79 54.41 1nqt n ASP 119 Cb 1.14 -2.46 -0.12 0.00 -0.02 0.00 0.00 41.12 39.66 1nqt n ASP 119 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1nqt s VAL 120 N -3.58 4.42 -1.17 2.53 1.01 -1.17 -5.01 120.40 117.43 1nqt s VAL 120 Ca 0.50 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.97 1nqt s VAL 120 Cb -0.28 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1nqt s VAL 120 CO 0.95 0.19 2.00 -0.81 0.00 0.00 0.00 175.10 177.43 1nqt n PRO 121 N 4.95 2.30 -3.77 2.72 -0.04 -1.26 -4.15 135.00 135.74 1nqt n PRO 121 Ca -0.15 -2.47 -0.13 0.00 -0.04 0.00 0.00 63.50 60.71 1nqt n PRO 121 Cb 0.50 -3.28 -0.12 0.00 -0.04 0.00 0.00 33.50 30.57 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 5.15 -0.31 0.56 0.54 2.99 -1.26 -4.58 117.98 121.07 1nqt s PHE 122 Ca 0.55 0.74 -0.15 0.00 0.00 0.00 0.00 56.93 58.06 1nqt s PHE 122 Cb 0.10 0.10 -0.06 0.00 0.00 0.00 0.00 43.02 43.16 1nqt s PHE 122 CO 0.04 -0.16 1.02 0.20 -0.00 0.00 0.00 175.22 176.32 1nqt s GLY 123 N 0.32 2.02 0.11 4.36 0.00 -0.91 -4.69 107.32 108.54 1nqt s GLY 123 Ca -0.01 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.63 1nqt s GLY 123 CO -0.01 0.52 1.01 -0.32 0.00 0.00 0.00 173.10 174.30 1nqt s GLY 124 N -3.12 2.92 0.06 0.20 0.00 -1.25 0.51 107.32 106.63 1nqt s GLY 124 Ca 0.60 0.64 -0.15 0.00 0.00 0.00 0.00 44.72 45.82 1nqt s GLY 124 CO 0.37 1.57 0.33 0.00 0.00 0.00 0.00 173.10 175.37 1nqt s ALA 125 N 0.13 -0.75 -0.01 3.20 0.00 0.15 0.27 121.76 124.75 1nqt s ALA 125 Ca 0.49 0.02 -0.24 0.00 0.00 0.00 0.00 51.96 52.24 1nqt s ALA 125 Cb -0.25 0.38 0.05 0.00 0.00 0.00 0.00 23.12 23.30 1nqt s ALA 125 CO 0.31 -0.46 0.52 0.21 0.00 0.00 0.00 175.76 176.34 1nqt s LYS 126 N -2.77 0.94 0.08 0.00 2.47 0.11 -3.55 119.74 117.02 1nqt s LYS 126 Ca -0.03 -0.04 0.04 0.00 -1.56 0.00 0.00 55.97 54.37 1nqt s LYS 126 Cb -0.00 0.43 -0.03 0.00 -1.46 0.00 0.00 37.83 36.77 1nqt s LYS 126 CO -0.05 -0.30 -0.11 0.00 0.16 0.00 0.00 175.35 175.05 1nqt s ALA 127 N -1.68 1.03 0.02 3.13 0.00 0.14 0.56 121.76 124.96 1nqt s ALA 127 Ca -0.10 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 1nqt s ALA 127 Cb -0.02 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.09 1nqt s ALA 127 CO 0.04 0.01 -0.01 0.20 0.00 0.00 0.00 175.76 176.01 1nqt s GLY 128 N -2.15 0.25 -0.17 0.00 0.00 0.80 -0.58 107.32 105.48 1nqt s GLY 128 Ca 0.01 -0.63 -0.02 0.00 0.00 0.00 0.00 44.72 44.08 1nqt s GLY 128 CO 0.01 -0.72 0.02 0.14 0.00 0.00 0.00 173.10 172.55 1nqt s VAL 129 N -1.89 0.55 -0.90 1.40 1.01 0.37 -0.24 120.40 120.70 1nqt s VAL 129 Ca -0.12 -0.43 -0.24 0.00 0.00 0.00 0.00 61.98 61.19 1nqt s VAL 129 Cb -0.07 -0.95 -0.19 0.00 0.00 0.00 0.00 36.38 35.17 1nqt s VAL 129 CO -0.02 -0.08 2.18 0.29 0.00 0.00 0.00 175.10 177.47 1nqt n LYS 130 N 5.05 0.27 -3.55 2.72 5.02 -0.10 -2.21 118.16 125.36 1nqt n LYS 130 Ca -0.09 -1.19 -0.17 0.00 -2.02 0.00 0.00 58.31 54.85 1nqt n LYS 130 Cb 0.48 -3.55 -0.06 0.00 -0.02 0.00 0.00 35.03 31.87 1nqt n LYS 130 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1nqt s ILE 131 N 14.70 0.00 -0.20 -0.18 1.01 -0.77 -4.64 121.20 131.12 1nqt s ILE 131 Ca 0.84 -0.00 -0.05 0.00 0.00 0.00 0.00 60.65 61.44 1nqt s ILE 131 Cb -0.12 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 1nqt s ILE 131 CO 0.15 -0.00 0.00 0.21 0.00 0.00 0.00 174.94 175.30 1nqt s ASN 132 N -0.73 4.89 0.30 3.58 3.84 -1.26 -0.93 114.94 124.63 1nqt s ASN 132 Ca -0.08 -0.17 0.04 0.00 0.21 0.00 0.00 52.86 52.86 1nqt s ASN 132 Cb -0.01 -1.83 0.49 0.00 -0.55 0.00 0.00 41.25 39.35 1nqt s ASN 132 CO 0.07 0.08 1.77 -0.65 -2.79 0.00 0.00 177.10 175.58 1nqt h PRO 133 N 7.37 0.42 -0.13 0.43 0.11 -1.93 -3.01 132.00 135.26 1nqt h PRO 133 Ca -0.35 -0.14 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1nqt h PRO 133 Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1nqt h PRO 133 CO 0.62 0.62 0.43 0.87 -0.21 0.00 0.00 178.00 180.33 1nqt h LYS 134 N 0.38 0.00 -0.01 1.05 1.79 -1.98 0.30 116.57 118.10 1nqt h LYS 134 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1nqt h LYS 134 Cb 0.60 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1nqt h LYS 134 CO 0.04 0.00 -0.45 0.09 -1.08 0.00 0.00 179.45 178.05 1nqt n ASN 135 N -3.08 1.73 -4.34 0.86 3.02 -1.14 -4.93 115.26 107.38 1nqt n ASN 135 Ca 0.01 -1.33 -0.31 0.00 -0.03 0.00 0.00 54.58 52.92 1nqt n ASN 135 Cb 0.52 0.42 -0.15 0.00 -0.61 0.00 0.00 39.78 39.95 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 -2.51 2.38 0.68 3.10 2.02 0.11 -5.10 117.35 118.01 1nqt s TYR 136 Ca 0.19 -0.40 -0.15 0.00 -0.37 0.00 0.00 57.07 56.34 1nqt s TYR 136 Cb 0.18 -1.50 0.01 0.00 -0.40 0.00 0.00 41.96 40.25 1nqt s TYR 136 CO 0.57 0.01 1.13 -0.08 -1.57 0.00 0.00 175.55 175.62 1nqt s THR 137 N -0.66 3.05 0.08 -0.71 -1.32 -1.26 -4.69 115.64 110.14 1nqt s THR 137 Ca 0.10 0.49 -0.20 0.00 -1.21 0.00 0.00 61.69 60.87 1nqt s THR 137 Cb -0.10 -3.01 -0.06 0.00 -1.51 0.00 0.00 72.50 67.81 1nqt s THR 137 CO -0.00 -0.30 1.34 0.44 -2.21 0.00 0.00 174.62 173.89 1nqt h ASP 138 N -0.07 -1.20 0.00 8.08 5.19 -1.99 0.66 116.42 127.08 1nqt h ASP 138 Ca -0.47 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.10 1nqt h ASP 138 Cb 1.26 0.50 0.00 0.00 0.18 0.00 0.00 39.33 41.27 1nqt h ASP 138 CO 0.53 -0.23 0.24 -3.20 -3.12 0.00 0.00 179.24 173.46 1nqt n ASN 139 N -4.38 0.25 -0.06 6.45 2.85 -1.26 0.10 115.26 119.22 1nqt n ASN 139 Ca -0.02 0.49 -0.11 0.00 -0.11 0.00 0.00 54.58 54.83 1nqt n ASN 139 Cb 0.20 -0.47 -0.15 0.00 1.24 0.00 0.00 39.78 40.61 1nqt n ASN 139 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1nqt n GLU 140 N -1.83 0.67 -0.03 1.20 1.02 0.20 -3.29 120.64 118.57 1nqt n GLU 140 Ca -0.01 0.17 -0.11 0.00 -0.02 0.00 0.00 57.16 57.19 1nqt n GLU 140 Cb 0.26 -1.66 -0.05 0.00 -0.02 0.00 0.00 31.44 29.96 1nqt n GLU 140 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1nqt h LEU 141 N 0.01 0.19 0.01 -4.62 3.38 0.39 -1.87 115.31 112.80 1nqt h LEU 141 Ca -0.42 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1nqt h LEU 141 Cb 2.09 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.79 1nqt h LEU 141 CO 0.05 0.28 -0.04 -0.08 0.09 0.00 0.00 178.44 178.74 1nqt h GLU 142 N 0.08 -0.05 -0.61 1.13 4.81 -1.46 0.02 114.58 118.50 1nqt h GLU 142 Ca 0.05 0.00 0.23 0.00 -0.13 0.00 0.00 59.36 59.51 1nqt h GLU 142 Cb 0.15 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.43 1nqt h GLU 142 CO -0.00 -0.03 0.24 1.63 -0.73 0.00 0.00 179.01 180.11 1nqt n LYS 143 N -2.66 -0.04 0.07 1.92 5.02 -1.15 0.40 118.16 121.72 1nqt n LYS 143 Ca -0.01 0.86 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 1nqt n LYS 143 Cb 0.03 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.47 1nqt n LYS 143 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1nqt h ILE 144 N 0.00 0.88 0.00 -0.18 2.04 -0.26 -2.96 117.51 117.03 1nqt h ILE 144 Ca 0.47 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.33 1nqt h ILE 144 Cb 1.19 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1nqt h ILE 144 CO -0.50 0.20 -0.01 0.71 0.00 0.00 0.00 178.15 178.56 1nqt h THR 145 N -0.79 0.23 0.02 -0.27 1.35 0.17 0.66 112.91 114.27 1nqt h THR 145 Ca -0.02 -0.09 -0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1nqt h THR 145 Cb 0.52 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1nqt h THR 145 CO 0.04 0.01 -0.01 0.03 -0.25 0.00 0.00 175.52 175.35 1nqt h ARG 146 N 0.00 -0.02 -0.65 4.72 3.08 -1.41 -1.84 114.38 118.25 1nqt h ARG 146 Ca -0.00 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.24 1nqt h ARG 146 Cb 0.07 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1nqt h ARG 146 CO 0.00 0.04 0.53 -0.09 -1.07 0.00 0.00 179.97 179.39 1nqt h ARG 147 N -1.01 0.00 0.56 0.04 9.65 -1.33 0.60 114.38 122.89 1nqt h ARG 147 Ca -0.00 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1nqt h ARG 147 Cb 0.07 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.66 1nqt h ARG 147 CO 0.00 0.00 -0.27 0.35 2.80 0.00 0.00 179.97 182.86 1nqt h PHE 148 N 0.00 -0.69 0.00 2.20 3.57 -0.89 -2.58 116.94 118.54 1nqt h PHE 148 Ca 0.31 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1nqt h PHE 148 Cb 1.38 0.23 0.00 0.00 2.79 0.00 0.00 35.95 40.35 1nqt h PHE 148 CO 0.00 -0.43 0.00 2.41 -2.23 0.00 0.00 178.31 178.06 1nqt n THR 149 N -5.15 0.00 -0.31 4.41 -1.04 0.17 -0.59 114.28 111.77 1nqt n THR 149 Ca -0.09 1.36 -0.08 0.00 -2.04 0.00 0.00 64.05 63.20 1nqt n THR 149 Cb 0.30 -1.82 -0.07 0.00 -1.82 0.00 0.00 70.33 66.91 1nqt n THR 149 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1nqt n MET 150 N -2.88 -0.33 -0.19 -2.82 2.81 0.10 0.32 117.12 114.13 1nqt n MET 150 Ca 0.00 1.16 -0.03 0.00 -1.81 0.00 0.00 57.70 57.01 1nqt n MET 150 Cb 0.00 -1.70 0.16 0.00 -0.71 0.00 0.00 33.22 30.96 1nqt n MET 150 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1nqt h GLU 151 N 0.00 0.97 0.28 0.03 4.39 -0.59 -1.43 114.58 118.23 1nqt h GLU 151 Ca 0.12 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1nqt h GLU 151 Cb 0.30 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1nqt h GLU 151 CO -0.70 0.81 -0.33 -0.07 -1.16 0.00 0.00 179.01 177.56 1nqt h LEU 152 N 0.95 -0.91 -0.00 1.33 4.07 0.23 -2.94 115.31 118.04 1nqt h LEU 152 Ca 0.22 0.09 0.00 0.00 0.08 0.00 0.00 57.88 58.26 1nqt h LEU 152 Cb 0.22 0.32 -0.00 0.00 1.08 0.00 0.00 40.66 42.27 1nqt h LEU 152 CO -0.02 -0.46 -0.01 0.00 -1.08 0.00 0.00 178.44 176.88 1nqt h ALA 153 N -0.12 -0.35 0.00 1.53 0.00 -0.10 -0.38 119.26 119.83 1nqt h ALA 153 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1nqt h ALA 153 Cb 0.62 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1nqt h ALA 153 CO -0.09 -0.35 0.31 1.63 0.00 0.00 0.00 179.25 180.75 1nqt n LYS 154 N -2.69 0.00 0.00 0.00 5.02 -0.61 0.23 118.16 120.11 1nqt n LYS 154 Ca -0.00 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1nqt n LYS 154 Cb 0.00 -1.81 0.00 0.00 -0.02 0.00 0.00 35.03 33.20 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 -1.13 0.83 -2.06 1.97 4.76 -0.77 -5.03 118.16 116.73 1nqt n LYS 155 Ca 0.00 -0.87 0.00 0.00 -2.87 0.00 0.00 58.31 54.57 1nqt n LYS 155 Cb 0.31 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.59 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 -0.21 0.80 0.00 0.72 0.00 0.13 -4.98 105.19 101.66 1nqt n GLY 156 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.78 0.00 -3.69 1.61 3.72 -0.22 -4.88 117.46 112.21 1nqt n PHE 157 Ca 0.00 -0.25 -0.11 0.00 -0.05 0.00 0.00 57.45 57.04 1nqt n PHE 157 Cb 0.44 -0.02 -0.10 0.00 -0.94 0.00 0.00 39.48 38.86 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 -0.50 -0.01 0.00 4.37 2.07 -1.26 -4.75 121.20 121.12 1nqt s ILE 158 Ca 0.00 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.29 1nqt s ILE 158 Cb 0.00 -0.68 0.00 0.00 0.13 0.00 0.00 42.46 41.91 1nqt s ILE 158 CO 0.00 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.66 1nqt n GLY 159 N 3.87 1.97 0.34 1.50 0.00 -0.33 -4.45 105.19 108.10 1nqt n GLY 159 Ca -0.20 0.07 0.20 0.00 0.00 0.00 0.00 46.02 46.08 1nqt n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt h PRO 160 N 0.00 0.00 -0.27 1.61 0.13 -1.80 0.26 132.00 131.93 1nqt h PRO 160 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.91 1nqt h PRO 160 Cb 0.00 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 30.92 1nqt h PRO 160 CO 0.00 0.00 -0.70 0.41 -0.23 0.00 0.00 178.00 177.48 1nqt n GLY 161 N -1.15 4.90 1.10 1.56 0.00 -1.26 -4.81 105.19 105.53 1nqt n GLY 161 Ca -0.02 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1nqt n GLY 161 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nqt n ILE 162 N -0.78 0.00 -3.47 -0.61 5.41 -0.07 -4.65 119.36 115.19 1nqt n ILE 162 Ca 0.25 0.00 0.01 0.00 1.00 0.00 0.00 62.75 64.01 1nqt n ILE 162 Cb 0.84 -0.20 -0.04 0.00 -0.71 0.00 0.00 39.64 39.53 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 -3.40 -0.78 -0.60 4.38 -1.08 -0.30 -2.04 116.67 112.86 1nqt s ASP 163 Ca 0.00 1.03 0.01 0.00 -0.52 0.00 0.00 52.55 53.07 1nqt s ASP 163 Cb 0.00 1.87 0.15 0.00 -1.46 0.00 0.00 42.92 43.48 1nqt s ASP 163 CO 0.00 -0.15 0.38 -0.69 0.52 0.00 0.00 175.17 175.23 1nqt s VAL 164 N 2.62 3.21 0.95 1.11 1.01 0.26 -1.18 120.40 128.37 1nqt s VAL 164 Ca -0.03 -3.24 -0.16 0.00 0.00 0.00 0.00 61.98 58.55 1nqt s VAL 164 Cb -0.08 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.20 1nqt s VAL 164 CO -0.18 -0.86 -0.27 -2.65 0.00 0.00 0.00 175.10 171.13 1nqt n PRO 165 N 3.17 -1.18 -3.70 2.72 -0.02 -1.21 -4.04 135.00 130.74 1nqt n PRO 165 Ca 0.08 -0.34 -0.04 0.00 -2.02 0.00 0.00 63.50 61.17 1nqt n PRO 165 Cb 0.35 -1.33 -0.01 0.00 -0.02 0.00 0.00 33.50 32.49 1nqt n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nqt s ALA 166 N -2.08 -1.69 1.19 3.55 0.00 -0.98 -2.28 121.76 119.47 1nqt s ALA 166 Ca 0.34 0.30 -0.18 0.00 0.00 0.00 0.00 51.96 52.43 1nqt s ALA 166 Cb -0.02 0.60 0.28 0.00 0.00 0.00 0.00 23.12 23.98 1nqt s ALA 166 CO 0.43 -0.97 1.07 -2.14 0.00 0.00 0.00 175.76 174.15 1nqt s PRO 167 N -3.25 -1.09 0.00 0.00 0.02 -1.26 0.85 135.00 130.27 1nqt s PRO 167 Ca 0.11 0.17 0.00 0.00 0.02 0.00 0.00 61.00 61.30 1nqt s PRO 167 Cb -0.01 -1.59 0.00 0.00 0.02 0.00 0.00 34.50 32.92 1nqt s PRO 167 CO -0.00 -3.67 0.00 -3.47 -0.33 0.00 0.00 177.00 169.53 1nqt n ASP 168 N -4.78 0.03 0.02 2.53 2.03 -1.24 -4.18 116.55 110.96 1nqt n ASP 168 Ca 0.10 -0.03 -0.05 0.00 0.52 0.00 0.00 54.79 55.34 1nqt n ASP 168 Cb 0.59 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.88 1nqt n ASP 168 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1nqt h MET 169 N 0.00 0.00 0.00 -0.67 2.86 -1.98 -3.32 114.93 111.82 1nqt h MET 169 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1nqt h MET 169 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1nqt h MET 169 CO 0.00 0.47 0.00 -1.13 1.06 0.00 0.00 176.91 177.31 1nqt n SER 170 N -3.03 0.74 -4.30 1.22 3.41 -1.26 -4.90 113.62 105.50 1nqt n SER 170 Ca -0.11 0.58 -0.16 0.00 -0.26 0.00 0.00 58.87 58.91 1nqt n SER 170 Cb 0.94 -0.77 -0.10 0.00 -0.26 0.00 0.00 64.21 64.02 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 -3.11 1.13 0.14 6.66 -4.23 -1.25 -4.61 115.64 110.38 1nqt s THR 171 Ca 0.10 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.59 1nqt s THR 171 Cb 0.13 -2.14 -0.01 0.00 1.34 0.00 0.00 72.50 71.82 1nqt s THR 171 CO 0.57 -0.50 0.11 0.61 -0.54 0.00 0.00 174.62 174.87 1nqt n GLY 172 N -0.33 3.60 0.26 3.99 0.00 -1.26 -3.70 105.19 107.75 1nqt n GLY 172 Ca -0.07 -1.80 0.08 0.00 0.00 0.00 0.00 46.02 44.22 1nqt n GLY 172 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nqt h GLU 173 N 0.00 0.01 -0.31 1.61 4.11 -1.94 -2.06 114.58 116.01 1nqt h GLU 173 Ca -0.10 -0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.24 1nqt h GLU 173 Cb 0.49 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1nqt h GLU 173 CO 0.15 0.02 -0.16 0.00 0.07 0.00 0.00 179.01 179.10 1nqt h ARG 174 N 0.01 0.66 -0.55 1.06 3.08 -1.97 0.45 114.38 117.13 1nqt h ARG 174 Ca 0.00 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.73 1nqt h ARG 174 Cb 0.03 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1nqt h ARG 174 CO 0.00 0.88 0.22 0.93 -1.07 0.00 0.00 179.97 180.93 1nqt h GLU 175 N 0.42 0.82 -0.50 0.04 3.07 -1.80 -2.18 114.58 114.45 1nqt h GLU 175 Ca 0.07 -0.15 0.02 0.00 -0.50 0.00 0.00 59.36 58.80 1nqt h GLU 175 Cb 0.69 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 28.43 1nqt h GLU 175 CO 0.05 0.71 0.30 0.52 -1.40 0.00 0.00 179.01 179.19 1nqt h MET 176 N 0.75 0.58 -0.96 2.33 2.86 -1.06 0.68 114.93 120.10 1nqt h MET 176 Ca 0.18 -0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.87 1nqt h MET 176 Cb 0.20 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 31.66 1nqt h MET 176 CO -0.01 0.38 0.60 1.03 1.06 0.00 0.00 176.91 179.97 1nqt h SER 177 N 0.59 0.94 -0.19 1.22 0.87 0.25 -1.04 113.55 116.19 1nqt h SER 177 Ca 0.20 0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.63 1nqt h SER 177 Cb 0.02 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1nqt h SER 177 CO -0.09 0.57 -0.47 -0.50 -0.53 0.00 0.00 176.83 175.80 1nqt h TRP 178 N 1.05 0.92 -0.64 2.24 6.55 -0.71 0.57 115.95 125.94 1nqt h TRP 178 Ca 0.43 -0.30 0.01 0.00 0.95 0.00 0.00 58.89 59.99 1nqt h TRP 178 Cb 0.27 -0.18 -0.03 0.00 -0.86 0.00 0.00 29.16 28.35 1nqt h TRP 178 CO -0.01 1.08 0.42 0.82 -1.05 0.00 0.00 178.44 179.69 1nqt h ILE 179 N 0.60 1.14 0.50 1.49 1.08 -0.35 0.18 117.51 122.14 1nqt h ILE 179 Ca 0.03 -0.29 -0.02 0.00 -0.39 0.00 0.00 64.86 64.19 1nqt h ILE 179 Cb 1.04 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 1nqt h ILE 179 CO 0.10 0.15 -0.24 0.00 -0.69 0.00 0.00 178.15 177.48 1nqt h ALA 180 N 1.25 -1.16 -0.52 1.87 0.00 -1.11 -2.35 119.26 117.24 1nqt h ALA 180 Ca 0.24 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1nqt h ALA 180 Cb -0.06 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1nqt h ALA 180 CO -0.07 -1.11 0.09 0.22 0.00 0.00 0.00 179.25 178.38 1nqt h ASP 181 N -0.68 -0.02 -0.07 0.00 1.82 -0.63 0.13 116.42 116.97 1nqt h ASP 181 Ca -0.07 0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.70 1nqt h ASP 181 Cb 0.51 0.14 -0.04 0.00 0.68 0.00 0.00 39.33 40.62 1nqt h ASP 181 CO 0.11 0.01 -0.17 0.74 -1.61 0.00 0.00 179.24 178.33 1nqt h THR 182 N 0.23 0.58 -0.25 2.25 2.02 -0.72 -1.31 112.91 115.71 1nqt h THR 182 Ca 0.26 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.50 1nqt h THR 182 Cb 0.36 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 67.29 1nqt h THR 182 CO -0.35 0.00 -0.16 0.22 0.37 0.00 0.00 175.52 175.60 1nqt h TYR 183 N -0.24 -0.41 0.00 3.16 3.20 -0.29 -2.11 116.97 120.29 1nqt h TYR 183 Ca 0.08 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1nqt h TYR 183 Cb 0.35 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 1nqt h TYR 183 CO -0.25 -0.23 -0.06 0.00 -1.64 0.00 0.00 178.16 175.97 1nqt h ALA 184 N 1.01 1.67 -0.49 1.82 0.00 -0.61 0.24 119.26 122.90 1nqt h ALA 184 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1nqt h ALA 184 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1nqt h ALA 184 CO -0.34 0.08 0.00 0.43 0.00 0.00 0.00 179.25 179.42 1nqt n SER 185 N -4.14 3.36 0.00 0.00 7.64 -0.52 -3.48 113.62 116.48 1nqt n SER 185 Ca -0.03 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.88 1nqt n SER 185 Cb 0.15 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1nqt n SER 185 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1nqt n THR 186 N 1.38 0.00 -0.27 0.44 -2.24 -0.89 -4.85 114.28 107.85 1nqt n THR 186 Ca 0.20 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 62.06 1nqt n THR 186 Cb 0.57 0.00 0.22 0.00 -2.10 0.00 0.00 70.33 69.01 1nqt n THR 186 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1nqt h ILE 187 N 0.00 0.63 -0.57 2.28 1.08 -1.81 -0.75 117.51 118.36 1nqt h ILE 187 Ca 0.00 -0.16 -0.33 0.00 -0.39 0.00 0.00 64.86 63.98 1nqt h ILE 187 Cb 0.00 0.12 -0.17 0.00 -3.07 0.00 0.00 36.82 33.70 1nqt h ILE 187 CO 0.00 0.08 0.42 0.61 -0.69 0.00 0.00 178.15 178.57 1nqt n GLY 188 N -1.33 3.77 0.16 5.37 0.00 0.78 -4.44 105.19 109.50 1nqt n GLY 188 Ca 0.16 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 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 0.91 0.44 -0.02 1.61 6.17 -1.16 -3.12 115.15 119.99 1nqt h HIS 189 Ca 0.36 -0.00 -0.18 0.00 0.71 0.00 0.00 60.37 61.26 1nqt h HIS 189 Cb 1.68 -0.15 -0.01 0.00 2.52 0.00 0.00 27.41 31.45 1nqt h HIS 189 CO 0.92 0.32 -0.78 1.88 0.71 0.00 0.00 177.93 180.98 1nqt h TYR 190 N 0.44 0.24 -2.24 5.26 -1.99 -1.84 -3.46 116.97 113.39 1nqt h TYR 190 Ca 0.12 -0.12 -0.57 0.00 2.00 0.00 0.00 58.73 60.16 1nqt h TYR 190 Cb 0.01 -0.03 0.03 0.00 2.00 0.00 0.00 36.73 38.73 1nqt h TYR 190 CO -0.04 0.88 1.11 -3.47 -0.00 0.00 0.00 178.16 176.64 1nqt n ASP 191 N -3.72 3.75 0.00 3.88 4.64 -1.18 -4.86 116.55 119.06 1nqt n ASP 191 Ca -0.03 0.96 0.10 0.00 -1.38 0.00 0.00 54.79 54.45 1nqt n ASP 191 Cb 0.74 -1.46 0.47 0.00 -1.04 0.00 0.00 41.12 39.84 1nqt n ASP 191 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1nqt n ILE 192 N 5.02 0.50 -0.52 5.18 3.06 -1.26 -2.39 119.36 128.95 1nqt n ILE 192 Ca 0.20 0.12 0.05 0.00 -2.50 0.00 0.00 62.75 60.63 1nqt n ILE 192 Cb 0.34 -0.78 0.09 0.00 0.54 0.00 0.00 39.64 39.84 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 -1.41 2.37 -0.43 9.51 3.02 -1.26 -4.81 115.26 122.25 1nqt n ASN 193 Ca 0.07 -2.51 0.37 0.00 -0.03 0.00 0.00 54.58 52.47 1nqt n ASN 193 Cb 0.21 -0.23 0.64 0.00 -0.61 0.00 0.00 39.78 39.79 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 0.31 2.63 0.00 5.41 0.00 -1.75 1.13 119.26 126.99 1nqt h ALA 194 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1nqt h ALA 194 Cb 0.79 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1nqt h ALA 194 CO 0.02 -1.32 0.00 0.72 0.00 0.00 0.00 179.25 178.67 1nqt n HIS 195 N -4.85 0.00 1.16 0.00 8.25 -1.26 -1.28 115.22 117.24 1nqt n HIS 195 Ca 0.39 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.99 1nqt n HIS 195 Cb 1.44 -0.17 0.60 0.00 1.12 0.00 0.00 29.99 32.99 1nqt n HIS 195 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nqt n ALA 196 N -1.17 2.58 0.18 -1.41 0.00 0.39 -3.91 120.51 117.18 1nqt n ALA 196 Ca 0.10 -0.17 0.16 0.00 0.00 0.00 0.00 53.44 53.54 1nqt n ALA 196 Cb 0.11 -1.41 0.78 0.00 0.00 0.00 0.00 19.45 18.93 1nqt n ALA 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nqt s VAL 198 N -4.77 -0.01 0.71 0.00 0.11 -1.25 -3.29 120.40 111.90 1nqt s VAL 198 Ca -0.05 0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 59.02 1nqt s VAL 198 Cb 0.16 -0.74 0.12 0.00 -1.53 0.00 0.00 36.38 34.39 1nqt s VAL 198 CO 0.60 0.01 0.98 0.42 -3.33 0.00 0.00 175.10 173.78 1nqt s THR 199 N 0.93 2.20 -0.47 5.04 -4.23 -0.96 -4.62 115.64 113.53 1nqt s THR 199 Ca -0.05 -0.56 -0.02 0.00 -1.18 0.00 0.00 61.69 59.88 1nqt s THR 199 Cb -0.06 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.14 1nqt s THR 199 CO -0.08 0.00 0.40 0.61 -0.54 0.00 0.00 174.62 175.01 1nqt n GLY 200 N -2.82 0.35 4.01 3.99 0.00 -1.26 -4.32 105.19 105.14 1nqt n GLY 200 Ca 0.14 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.63 1nqt n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nqt s LYS 201 N -5.20 2.34 0.23 1.61 1.02 -1.26 -4.21 119.74 114.27 1nqt s LYS 201 Ca 0.15 -1.67 -0.22 0.00 0.02 0.00 0.00 55.97 54.25 1nqt s LYS 201 Cb -0.07 -2.57 -0.08 0.00 -0.52 0.00 0.00 37.83 34.59 1nqt s LYS 201 CO 0.26 -0.77 0.78 -2.14 -0.92 0.00 0.00 175.35 172.55 1nqt s PRO 202 N -4.58 4.38 0.30 -1.68 0.02 -1.26 -4.17 135.00 128.02 1nqt s PRO 202 Ca 0.57 1.02 0.06 0.00 0.02 0.00 0.00 61.00 62.67 1nqt s PRO 202 Cb -0.05 -2.95 0.83 0.00 0.02 0.00 0.00 34.50 32.34 1nqt s PRO 202 CO 0.36 0.41 1.65 0.82 -0.33 0.00 0.00 177.00 179.91 1nqt h ILE 203 N 2.85 0.29 -0.06 2.83 1.08 -1.91 0.72 117.51 123.31 1nqt h ILE 203 Ca -0.47 -0.08 0.02 0.00 -0.39 0.00 0.00 64.86 63.94 1nqt h ILE 203 Cb 1.20 0.04 -0.00 0.00 -3.07 0.00 0.00 36.82 34.99 1nqt h ILE 203 CO 0.65 0.04 0.10 -1.28 -0.69 0.00 0.00 178.15 176.97 1nqt h SER 204 N 0.22 0.00 -0.28 1.72 0.87 -1.92 -1.30 113.55 112.87 1nqt h SER 204 Ca 0.61 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.17 1nqt h SER 204 Cb 1.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 1nqt h SER 204 CO -0.66 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 175.64 1nqt n GLN 205 N -3.53 2.07 0.00 2.24 1.13 0.24 -4.95 117.38 114.58 1nqt n GLN 205 Ca -0.01 -1.89 0.00 0.00 -1.94 0.00 0.00 57.00 53.16 1nqt n GLN 205 Cb 0.19 -1.34 0.00 0.00 0.11 0.00 0.00 30.24 29.20 1nqt n GLN 205 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nqt n GLY 206 N 0.89 1.72 3.68 1.08 0.00 -0.49 -4.85 105.19 107.22 1nqt n GLY 206 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 1.63 -0.07 -0.02 0.00 -0.58 -4.79 107.32 101.49 1nqt s GLY 207 Ca 0.00 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 43.77 1nqt s GLY 207 CO 0.00 -0.13 -0.10 -1.50 0.00 0.00 0.00 173.10 171.37 1nqt s ILE 208 N -3.21 3.45 0.34 0.90 2.07 -1.26 -4.65 121.20 118.83 1nqt s ILE 208 Ca 0.71 -0.57 -0.28 0.00 -1.41 0.00 0.00 60.65 59.10 1nqt s ILE 208 Cb -0.09 -2.39 -0.09 0.00 0.13 0.00 0.00 42.46 40.01 1nqt s ILE 208 CO 0.55 0.59 1.20 -1.00 -1.91 0.00 0.00 174.94 174.38 1nqt s HIS 209 N -0.72 3.21 0.00 3.50 3.76 -1.26 -3.34 115.29 120.45 1nqt s HIS 209 Ca 0.11 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.56 1nqt s HIS 209 Cb -0.11 -3.47 0.00 0.00 1.11 0.00 0.00 32.58 30.11 1nqt s HIS 209 CO 0.01 -1.30 0.00 0.41 -0.85 0.00 0.00 174.74 173.01 1nqt n GLY 210 N 0.86 0.88 0.15 -2.22 0.00 -1.26 -4.34 105.19 99.26 1nqt n GLY 210 Ca 0.01 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.26 -0.32 1.61 2.43 -1.96 -3.09 114.38 112.79 1nqt h ARG 211 Ca 0.00 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.26 1nqt h ARG 211 Cb 0.00 0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.54 1nqt h ARG 211 CO 0.00 0.14 -0.19 0.82 -1.51 0.00 0.00 179.97 179.23 1nqt h ILE 212 N -0.86 0.47 0.00 1.20 2.04 -1.95 0.15 117.51 118.55 1nqt h ILE 212 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1nqt h ILE 212 Cb 0.51 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1nqt h ILE 212 CO 0.04 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.65 1nqt n SER 213 N -5.35 0.10 0.00 1.72 3.41 -1.26 -4.30 113.62 107.94 1nqt n SER 213 Ca 0.01 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1nqt n SER 213 Cb 0.27 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1nqt n SER 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nqt n ALA 214 N -1.54 -0.05 -0.18 7.33 0.00 0.04 -0.24 120.51 125.87 1nqt n ALA 214 Ca 0.04 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.72 1nqt n ALA 214 Cb 0.22 0.26 0.63 0.00 0.00 0.00 0.00 19.45 20.56 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 0.63 0.38 0.00 2.02 -1.75 0.22 112.91 114.41 1nqt h THR 215 Ca 0.00 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1nqt h THR 215 Cb 0.00 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1nqt h THR 215 CO 0.00 0.03 -0.18 1.23 0.37 0.00 0.00 175.52 176.97 1nqt h GLY 216 N 0.16 -0.53 -0.69 2.16 0.00 -1.65 -2.70 103.07 99.82 1nqt h GLY 216 Ca 0.42 0.20 0.36 0.00 0.00 0.00 0.00 47.33 48.31 1nqt h GLY 216 CO -0.08 -0.19 0.75 3.21 0.00 0.00 0.00 176.54 180.23 1nqt h ARG 217 N -0.67 0.21 0.50 4.80 3.08 0.49 0.51 114.38 123.30 1nqt h ARG 217 Ca -0.05 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1nqt h ARG 217 Cb 0.39 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1nqt h ARG 217 CO 0.09 0.14 -0.34 0.78 -1.07 0.00 0.00 179.97 179.57 1nqt h GLY 218 N 0.22 -0.87 1.21 0.04 0.00 -0.52 -2.13 103.07 101.02 1nqt h GLY 218 Ca 0.73 0.38 0.10 0.00 0.00 0.00 0.00 47.33 48.54 1nqt h GLY 218 CO -0.40 -0.32 0.29 -2.08 0.00 0.00 0.00 176.54 174.03 1nqt h VAL 219 N -0.81 0.66 0.00 4.60 2.07 0.34 -0.20 116.25 122.91 1nqt h VAL 219 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1nqt h VAL 219 Cb 0.67 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1nqt h VAL 219 CO 0.04 0.00 0.00 0.33 0.02 0.00 0.00 177.57 177.96 1nqt n PHE 220 N -4.17 0.00 -0.30 1.57 -0.00 -0.84 -2.39 117.46 111.33 1nqt n PHE 220 Ca 0.06 0.00 0.08 0.00 -0.00 0.00 0.00 57.45 57.59 1nqt n PHE 220 Cb 0.47 -0.17 0.17 0.00 -0.00 0.00 0.00 39.48 39.95 1nqt n PHE 220 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1nqt n HIS 221 N -1.02 0.40 -0.15 -5.13 8.25 -0.98 0.79 115.22 117.38 1nqt n HIS 221 Ca 0.00 1.02 -0.13 0.00 -0.26 0.00 0.00 57.72 58.36 1nqt n HIS 221 Cb 0.00 -1.05 -0.09 0.00 1.12 0.00 0.00 29.99 29.98 1nqt n HIS 221 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1nqt h GLY 222 N 0.00 -0.88 0.03 -1.41 0.00 -1.07 0.46 103.07 100.19 1nqt h GLY 222 Ca 0.45 0.68 -0.00 0.00 0.00 0.00 0.00 47.33 48.46 1nqt h GLY 222 CO -0.84 -0.13 -0.04 -2.22 0.00 0.00 0.00 176.54 173.31 1nqt h ILE 223 N -0.36 0.00 0.00 2.60 2.04 0.76 -3.21 117.51 119.34 1nqt h ILE 223 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 1nqt h ILE 223 Cb 0.59 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1nqt h ILE 223 CO -0.61 0.00 0.00 1.21 0.00 0.00 0.00 178.15 178.75 1nqt n GLU 224 N -2.58 0.00 -0.25 2.37 2.13 -0.06 -0.70 120.64 121.54 1nqt n GLU 224 Ca -0.01 0.60 0.16 0.00 0.66 0.00 0.00 57.16 58.57 1nqt n GLU 224 Cb 0.03 -0.90 0.31 0.00 0.27 0.00 0.00 31.44 31.15 1nqt n GLU 224 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1nqt n ASN 225 N -2.59 0.04 0.11 4.31 3.02 0.15 -0.60 115.26 119.70 1nqt n ASN 225 Ca 0.00 1.28 -0.23 0.00 -0.03 0.00 0.00 54.58 55.59 1nqt n ASN 225 Cb 0.00 -0.52 -0.15 0.00 -0.61 0.00 0.00 39.78 38.49 1nqt n ASN 225 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1nqt h PHE 226 N 0.00 0.82 0.00 3.10 -1.00 -0.92 -3.29 116.94 115.65 1nqt h PHE 226 Ca 0.53 -0.60 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1nqt h PHE 226 Cb 1.23 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.76 1nqt h PHE 226 CO -0.24 1.61 0.00 0.82 -1.61 0.00 0.00 178.31 178.88 1nqt h ILE 227 N 0.12 0.00 -0.69 -0.55 2.04 0.33 -1.62 117.51 117.14 1nqt h ILE 227 Ca -0.30 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1nqt h ILE 227 Cb 2.13 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 39.10 1nqt h ILE 227 CO 0.22 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.96 1nqt n ASN 228 N -2.42 4.50 -4.21 1.72 5.03 -0.53 -4.66 115.26 114.68 1nqt n ASN 228 Ca 0.00 -2.28 -0.38 0.00 0.87 0.00 0.00 54.58 52.79 1nqt n ASN 228 Cb 0.17 -0.55 -0.11 0.00 -1.02 0.00 0.00 39.78 38.27 1nqt n ASN 228 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1nqt s GLU 229 N -1.53 2.40 0.06 3.52 2.56 -0.61 -5.00 118.70 120.10 1nqt s GLU 229 Ca 0.51 -1.53 -0.12 0.00 0.00 0.00 0.00 54.97 53.83 1nqt s GLU 229 Cb 0.30 -3.62 -0.03 0.00 2.00 0.00 0.00 34.13 32.78 1nqt s GLU 229 CO 0.28 -0.93 1.11 0.00 -0.56 0.00 0.00 175.26 175.16 1nqt n ALA 230 N 4.78 -0.24 -0.13 6.30 0.00 -1.26 -1.31 120.51 128.65 1nqt n ALA 230 Ca -0.08 0.32 -0.03 0.00 0.00 0.00 0.00 53.44 53.64 1nqt n ALA 230 Cb 0.43 0.22 -0.03 0.00 0.00 0.00 0.00 19.45 20.06 1nqt n ALA 230 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nqt n SER 231 N -3.82 -0.33 0.07 0.00 7.64 -1.26 0.15 113.62 116.06 1nqt n SER 231 Ca 0.01 0.76 0.12 0.00 1.01 0.00 0.00 58.87 60.76 1nqt n SER 231 Cb 0.10 -0.17 0.46 0.00 -1.01 0.00 0.00 64.21 63.59 1nqt n SER 231 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1nqt n TYR 232 N -3.82 0.50 1.13 1.43 4.02 -1.03 -2.51 117.16 116.88 1nqt n TYR 232 Ca 0.01 0.17 0.12 0.00 -0.01 0.00 0.00 57.90 58.19 1nqt n TYR 232 Cb 0.08 -0.77 0.18 0.00 -0.02 0.00 0.00 39.34 38.82 1nqt n TYR 232 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1nqt n MET 233 N -1.93 1.61 -0.07 -0.72 2.81 0.40 -3.93 117.12 115.29 1nqt n MET 233 Ca 0.05 -1.23 -0.05 0.00 -1.81 0.00 0.00 57.70 54.66 1nqt n MET 233 Cb 0.31 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.33 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 0.37 1.74 0.03 7.83 2.88 0.11 0.21 113.62 126.80 1nqt n SER 234 Ca 0.13 0.55 0.01 0.00 -1.33 0.00 0.00 58.87 58.23 1nqt n SER 234 Cb 0.47 -0.83 0.05 0.00 -0.75 0.00 0.00 64.21 63.16 1nqt n SER 234 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nqt n ILE 235 N -4.47 0.85 0.06 2.46 3.06 -1.07 0.28 119.36 120.53 1nqt n ILE 235 Ca -0.08 0.54 0.04 0.00 -2.50 0.00 0.00 62.75 60.75 1nqt n ILE 235 Cb 0.30 -1.54 -0.06 0.00 0.54 0.00 0.00 39.64 38.88 1nqt n ILE 235 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1nqt n LEU 236 N -1.37 0.06 -2.26 9.51 4.77 -1.25 -5.00 117.00 121.47 1nqt n LEU 236 Ca -0.00 -0.08 -0.01 0.00 -0.03 0.00 0.00 56.01 55.89 1nqt n LEU 236 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1nqt n LEU 236 CO 0.01 0.02 0.14 0.61 -1.33 0.00 0.00 177.39 176.83 1nqt n GLY 237 N 1.89 -0.83 0.00 -0.72 0.00 0.81 -5.06 105.19 101.28 1nqt n GLY 237 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.15 0.95 -3.78 1.61 2.00 0.57 -4.92 117.12 112.39 1nqt n MET 238 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 57.70 57.63 1nqt n MET 238 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.66 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 -0.45 -0.90 2.03 5.66 -1.26 -4.80 114.28 114.55 1nqt n THR 239 Ca 0.00 -0.10 -0.30 0.00 -3.05 0.00 0.00 64.05 60.60 1nqt n THR 239 Cb 0.00 -0.38 0.16 0.00 -1.55 0.00 0.00 70.33 68.55 1nqt n THR 239 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 1nqt s PRO 240 N -5.41 1.02 -0.26 1.09 0.02 -1.25 -5.04 135.00 125.16 1nqt s PRO 240 Ca 0.09 1.20 0.14 0.00 0.02 0.00 0.00 61.00 62.44 1nqt s PRO 240 Cb -0.05 -1.75 0.48 0.00 0.02 0.00 0.00 34.50 33.20 1nqt s PRO 240 CO 0.17 -2.52 1.16 0.41 -0.33 0.00 0.00 177.00 175.89 1nqt n GLY 241 N -0.29 4.40 0.98 0.52 0.00 -1.26 -4.17 105.19 105.38 1nqt n GLY 241 Ca 0.09 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1nqt n GLY 241 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqt n PHE 242 N -0.65 -0.94 -0.01 1.61 7.35 -1.26 -4.92 117.46 118.64 1nqt n PHE 242 Ca 0.27 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 57.04 1nqt n PHE 242 Cb 0.90 0.25 -0.13 0.00 0.35 0.00 0.00 39.48 40.85 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 -0.81 -0.74 5.57 7.13 0.00 -1.26 -5.02 105.19 110.05 1nqt n GLY 243 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.09 0.00 -3.67 1.61 4.64 -1.26 -4.60 116.55 111.17 1nqt n ASP 244 Ca -0.04 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.25 1nqt n ASP 244 Cb 0.45 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.48 1nqt n ASP 244 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1nqt s LYS 245 N 0.00 0.95 -0.30 -0.67 1.02 -1.26 -3.93 119.74 115.55 1nqt s LYS 245 Ca 0.00 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 55.47 1nqt s LYS 245 Cb 0.00 0.42 0.19 0.00 -0.52 0.00 0.00 37.83 37.92 1nqt s LYS 245 CO 0.00 -0.34 0.59 0.99 -0.92 0.00 0.00 175.35 175.67 1nqt s THR 246 N -2.98 -0.99 0.25 2.17 2.01 -1.26 -2.93 115.64 111.91 1nqt s THR 246 Ca -0.02 -0.00 0.10 0.00 0.31 0.00 0.00 61.69 62.08 1nqt s THR 246 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.47 1nqt s THR 246 CO -0.06 -0.00 -0.18 0.72 -0.69 0.00 0.00 174.62 174.41 1nqt s PHE 247 N 2.85 2.06 -0.04 4.92 -0.71 -0.21 0.12 117.98 126.98 1nqt s PHE 247 Ca 0.19 -0.42 0.02 0.00 -1.04 0.00 0.00 56.93 55.68 1nqt s PHE 247 Cb -0.14 -0.91 0.01 0.00 -1.21 0.00 0.00 43.02 40.76 1nqt s PHE 247 CO -0.22 0.58 -0.10 0.08 -1.34 0.00 0.00 175.22 174.22 1nqt s VAL 248 N -2.68 0.91 0.11 -2.49 1.01 -0.35 -1.56 120.40 115.36 1nqt s VAL 248 Ca 0.27 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.91 1nqt s VAL 248 Cb -0.03 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 1nqt s VAL 248 CO 0.12 0.29 0.02 0.54 0.00 0.00 0.00 175.10 176.07 1nqt s VAL 249 N 0.44 4.07 -0.41 2.92 0.11 -1.17 -0.05 120.40 126.30 1nqt s VAL 249 Ca -0.08 -1.06 0.02 0.00 -2.93 0.00 0.00 61.98 57.93 1nqt s VAL 249 Cb -0.12 -2.98 0.12 0.00 -1.53 0.00 0.00 36.38 31.87 1nqt s VAL 249 CO 0.02 0.05 0.19 -1.58 -3.33 0.00 0.00 175.10 170.44 1nqt s GLN 250 N -2.54 1.33 0.00 1.54 -0.44 -0.60 -2.75 119.66 116.20 1nqt s GLN 250 Ca 0.27 -1.92 0.00 0.00 -2.50 0.00 0.00 55.36 51.21 1nqt s GLN 250 Cb -0.11 -2.59 0.00 0.00 -1.64 0.00 0.00 33.01 28.67 1nqt s GLN 250 CO 0.19 -1.08 0.00 0.41 0.50 0.00 0.00 175.29 175.31 1nqt n GLY 251 N 3.83 2.95 2.34 2.59 0.00 -1.26 -0.89 105.19 114.74 1nqt n GLY 251 Ca 0.05 -0.71 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 1nqt n GLY 251 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nqt n PHE 252 N 0.00 3.21 -0.13 1.61 -0.00 -1.26 -3.95 117.46 116.94 1nqt n PHE 252 Ca 0.00 -2.99 0.00 0.00 -0.00 0.00 0.00 57.45 54.46 1nqt n PHE 252 Cb 0.00 -1.40 0.00 0.00 -0.00 0.00 0.00 39.48 38.08 1nqt n PHE 252 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 253 N -0.90 1.06 0.00 7.13 0.00 -1.26 -4.63 105.19 106.59 1nqt n GLY 253 Ca 0.62 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.36 1.61 5.15 -1.26 -2.44 115.26 117.96 1nqt n ASN 254 Ca 0.00 0.47 0.03 0.00 -0.60 0.00 0.00 54.58 54.47 1nqt n ASN 254 Cb 0.00 0.00 0.09 0.00 -0.53 0.00 0.00 39.78 39.34 1nqt n ASN 254 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 1nqt n VAL 255 N -0.48 -0.46 -0.16 3.44 3.14 -1.26 -1.13 118.33 121.41 1nqt n VAL 255 Ca 0.00 2.27 -0.03 0.00 -2.96 0.00 0.00 64.34 63.62 1nqt n VAL 255 Cb 0.00 -3.07 0.06 0.00 -1.06 0.00 0.00 33.84 29.77 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 0.65 0.00 7.55 0.00 -1.68 0.15 103.07 109.73 1nqt h GLY 256 Ca 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1nqt h GLY 256 CO -0.99 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 175.45 1nqt n LEU 257 N -5.02 0.00 -0.28 3.11 7.94 -0.28 -0.95 117.00 121.52 1nqt n LEU 257 Ca 0.05 0.94 0.08 0.00 -1.11 0.00 0.00 56.01 55.97 1nqt n LEU 257 Cb 0.20 -0.44 0.20 0.00 0.53 0.00 0.00 43.42 43.92 1nqt n LEU 257 CO 0.24 -0.44 0.84 0.45 -1.11 0.00 0.00 177.39 177.38 1nqt h HIS 258 N 0.00 0.03 -0.94 1.96 3.86 -1.38 1.21 115.15 119.89 1nqt h HIS 258 Ca 0.00 0.06 0.20 0.00 -1.16 0.00 0.00 60.37 59.46 1nqt h HIS 258 Cb 0.00 0.12 -0.11 0.00 1.06 0.00 0.00 27.41 28.47 1nqt h HIS 258 CO 0.01 -0.26 0.51 0.77 0.86 0.00 0.00 177.93 179.82 1nqt h SER 259 N 0.12 0.59 0.37 2.45 0.02 -0.46 0.34 113.55 116.98 1nqt h SER 259 Ca 0.47 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.52 1nqt h SER 259 Cb 0.87 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1nqt h SER 259 CO -0.70 0.16 -0.18 -0.03 -1.14 0.00 0.00 176.83 174.95 1nqt h MET 260 N 0.61 -0.48 -0.63 3.45 1.85 0.31 -2.23 114.93 117.81 1nqt h MET 260 Ca 0.56 0.03 0.08 0.00 -0.61 0.00 0.00 59.70 59.76 1nqt h MET 260 Cb 0.94 0.11 -0.10 0.00 0.43 0.00 0.00 31.60 32.97 1nqt h MET 260 CO -0.43 -0.17 -0.50 0.00 -0.40 0.00 0.00 176.91 175.41 1nqt h ARG 261 N -0.84 -0.22 0.00 0.39 3.08 0.27 0.31 114.38 117.38 1nqt h ARG 261 Ca -0.05 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1nqt h ARG 261 Cb 0.53 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 1nqt h ARG 261 CO 0.08 -0.14 -0.12 1.88 -1.07 0.00 0.00 179.97 180.60 1nqt h TYR 262 N -0.23 0.00 0.10 3.04 0.05 -0.61 -1.84 116.97 117.49 1nqt h TYR 262 Ca 0.15 0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.65 1nqt h TYR 262 Cb 0.55 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 1nqt h TYR 262 CO -0.78 0.12 -1.40 -0.07 -1.05 0.00 0.00 178.16 174.98 1nqt h LEU 263 N 0.00 0.33 -0.22 3.88 3.38 -0.74 -3.34 115.31 118.60 1nqt h LEU 263 Ca -0.00 -0.42 -0.13 0.00 0.09 0.00 0.00 57.88 57.42 1nqt h LEU 263 Cb 0.83 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1nqt h LEU 263 CO 0.02 1.34 -0.39 -0.74 0.09 0.00 0.00 178.44 178.76 1nqt h HIS 264 N 0.06 0.81 0.00 1.13 2.76 -0.27 -3.11 115.15 116.53 1nqt h HIS 264 Ca -0.19 -0.29 0.00 0.00 -2.20 0.00 0.00 60.37 57.70 1nqt h HIS 264 Cb 1.97 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.78 1nqt h HIS 264 CO 0.05 1.04 0.00 -2.13 -1.30 0.00 0.00 177.93 175.60 1nqt n ARG 265 N -4.23 0.02 -2.65 5.26 0.63 -0.70 -1.99 116.66 112.99 1nqt n ARG 265 Ca -0.05 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.79 1nqt n ARG 265 Cb 0.53 -1.38 0.03 0.00 0.45 0.00 0.00 32.46 32.09 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 -0.88 1.60 0.00 -0.14 0.99 -1.17 -5.06 117.46 112.79 1nqt n PHE 266 Ca 0.00 -2.48 0.00 0.00 -0.00 0.00 0.00 57.45 54.97 1nqt n PHE 266 Cb 0.00 -0.28 0.00 0.00 -1.00 0.00 0.00 39.48 38.20 1nqt n PHE 266 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 267 N -0.40 1.12 0.00 1.37 0.00 -0.84 -5.03 105.19 101.41 1nqt n GLY 267 Ca 0.15 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 1.79 -0.12 -2.80 4.61 0.00 -1.25 -4.71 120.51 118.03 1nqt n ALA 268 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1nqt n ALA 268 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1nqt n ALA 268 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nqt s LYS 269 N 0.00 3.63 -0.13 0.00 1.02 -1.15 -4.13 119.74 118.97 1nqt s LYS 269 Ca 0.00 -0.33 -0.24 0.00 0.02 0.00 0.00 55.97 55.42 1nqt s LYS 269 Cb 0.00 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.19 1nqt s LYS 269 CO 0.00 0.47 0.74 0.00 -0.92 0.00 0.00 175.35 175.64 1nqt n ILE 271 N 4.32 0.70 -4.00 0.00 3.06 -0.60 -0.90 119.36 121.94 1nqt n ILE 271 Ca 0.01 -0.56 -0.08 0.00 -2.50 0.00 0.00 62.75 59.62 1nqt n ILE 271 Cb 0.50 -0.36 -0.09 0.00 0.54 0.00 0.00 39.64 40.24 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 -2.62 0.22 -0.26 1.51 0.00 -1.26 -2.15 121.76 117.20 1nqt s ALA 272 Ca -0.07 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.83 1nqt s ALA 272 Cb 0.06 0.45 0.12 0.00 0.00 0.00 0.00 23.12 23.75 1nqt s ALA 272 CO 0.64 -0.45 0.55 0.08 0.00 0.00 0.00 175.76 176.58 1nqt s VAL 273 N -3.91 -0.86 0.00 0.00 1.01 -0.45 -3.04 120.40 113.14 1nqt s VAL 273 Ca 0.08 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1nqt s VAL 273 Cb 0.06 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.57 1nqt s VAL 273 CO -0.09 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.64 1nqt n GLY 274 N 5.42 0.94 0.00 4.51 0.00 -1.11 -0.72 105.19 114.23 1nqt n GLY 274 Ca -0.10 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1nqt n GLY 274 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nqt n GLU 275 N 0.00 0.00 0.00 1.61 -0.58 -1.15 -4.53 120.64 115.99 1nqt n GLU 275 Ca 0.00 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.76 1nqt n GLU 275 Cb 0.00 0.00 0.11 0.00 -0.57 0.00 0.00 31.44 30.98 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 0.00 0.00 0.00 1.62 3.41 -1.26 -3.63 113.62 113.76 1nqt n SER 276 Ca 0.00 -1.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1nqt n SER 276 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1nqt n SER 276 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1nqt n ASP 277 N -0.57 0.00 0.00 4.04 8.00 -1.26 -5.13 116.55 121.63 1nqt n ASP 277 Ca 0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1nqt n ASP 277 Cb 0.01 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 1nqt n ASP 277 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nqt n GLY 278 N 2.39 4.55 3.81 0.44 0.00 -1.24 -4.99 105.19 110.14 1nqt n GLY 278 Ca 0.00 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 1nqt n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt s SER 279 N 1.00 0.01 -0.22 1.61 0.01 -1.25 -2.92 113.70 111.94 1nqt s SER 279 Ca 0.00 -1.15 -0.11 0.00 1.31 0.00 0.00 55.95 56.00 1nqt s SER 279 Cb 0.00 0.84 0.08 0.00 0.21 0.00 0.00 66.02 67.15 1nqt s SER 279 CO 0.00 -1.68 0.52 -0.63 0.41 0.00 0.00 173.24 171.86 1nqt s ILE 280 N -2.25 -0.18 0.17 1.44 1.01 0.10 -3.89 121.20 117.60 1nqt s ILE 280 Ca 0.16 0.07 0.08 0.00 0.00 0.00 0.00 60.65 60.96 1nqt s ILE 280 Cb -0.05 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 1nqt s ILE 280 CO 0.11 0.03 -0.17 0.86 0.00 0.00 0.00 174.94 175.77 1nqt s TRP 281 N 1.77 1.76 0.00 3.97 -0.11 -1.09 -1.35 118.94 123.89 1nqt s TRP 281 Ca -0.08 -0.49 0.00 0.00 1.22 0.00 0.00 56.10 56.75 1nqt s TRP 281 Cb -0.08 -0.87 0.00 0.00 -1.50 0.00 0.00 33.47 31.01 1nqt s TRP 281 CO -0.16 0.32 0.00 -1.71 -4.62 0.00 0.00 176.95 170.78 1nqt n ASN 282 N 0.22 0.00 -0.65 5.86 2.85 -0.91 -1.70 115.26 120.93 1nqt n ASN 282 Ca -0.13 0.00 0.51 0.00 -0.11 0.00 0.00 54.58 54.85 1nqt n ASN 282 Cb 0.57 0.00 0.81 0.00 1.24 0.00 0.00 39.78 42.40 1nqt n ASN 282 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1nqt h PRO 283 N 0.00 0.00 -0.60 1.20 0.11 -1.94 0.95 132.00 131.72 1nqt h PRO 283 Ca 0.00 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1nqt h PRO 283 Cb 0.00 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1nqt h PRO 283 CO 0.00 0.00 0.22 -0.44 -0.21 0.00 0.00 178.00 177.57 1nqt h ASP 284 N 0.00 0.85 0.00 -2.05 3.45 -1.94 -3.48 116.42 113.26 1nqt h ASP 284 Ca 0.90 -0.19 0.00 0.00 0.43 0.00 0.00 57.03 58.17 1nqt h ASP 284 Cb 3.55 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 42.10 1nqt h ASP 284 CO -0.05 0.81 0.00 0.61 -1.57 0.00 0.00 179.24 179.04 1nqt n GLY 285 N -0.77 3.38 3.81 2.75 0.00 0.33 -4.99 105.19 109.69 1nqt n GLY 285 Ca 0.04 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 1nqt n GLY 285 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nqt s ILE 286 N 0.00 4.37 -0.22 -0.61 1.01 -0.08 -4.96 121.20 120.71 1nqt s ILE 286 Ca 0.00 1.53 -0.07 0.00 0.00 0.00 0.00 60.65 62.10 1nqt s ILE 286 Cb 0.00 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 1nqt s ILE 286 CO 0.00 -0.13 0.07 -0.62 0.00 0.00 0.00 174.94 174.26 1nqt s ASP 287 N -1.98 5.37 0.00 3.58 2.15 -1.26 -4.46 116.67 120.07 1nqt s ASP 287 Ca 0.56 -0.08 0.00 0.00 0.43 0.00 0.00 52.55 53.46 1nqt s ASP 287 Cb -0.13 -1.95 0.00 0.00 -0.30 0.00 0.00 42.92 40.55 1nqt s ASP 287 CO 0.17 0.05 0.60 -2.65 -0.17 0.00 0.00 175.17 173.18 1nqt n PRO 288 N 4.35 0.00 -0.21 4.34 -0.02 -1.26 -1.19 135.00 141.01 1nqt n PRO 288 Ca -0.16 0.50 -0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1nqt n PRO 288 Cb 0.52 -1.10 -0.04 0.00 -0.02 0.00 0.00 33.50 32.85 1nqt n PRO 288 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1nqt n LYS 289 N -1.28 -0.21 0.13 -0.52 4.81 -1.26 0.27 118.16 120.10 1nqt n LYS 289 Ca 0.00 0.75 -0.13 0.00 -0.87 0.00 0.00 58.31 58.05 1nqt n LYS 289 Cb 0.00 -1.10 -0.08 0.00 0.02 0.00 0.00 35.03 33.87 1nqt n LYS 289 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1nqt h GLU 290 N 0.00 -0.63 -0.73 1.64 5.08 -1.89 0.23 114.58 118.27 1nqt h GLU 290 Ca 0.09 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.56 1nqt h GLU 290 Cb 0.21 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 1nqt h GLU 290 CO -0.47 -0.42 0.48 1.25 -1.00 0.00 0.00 179.01 178.85 1nqt h LEU 291 N -0.66 0.66 0.48 1.33 5.85 0.76 0.13 115.31 123.85 1nqt h LEU 291 Ca -0.02 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1nqt h LEU 291 Cb 0.63 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1nqt h LEU 291 CO -0.18 0.42 -0.28 -0.08 -0.34 0.00 0.00 178.44 177.99 1nqt h GLU 292 N 0.75 -0.68 -0.21 1.25 4.81 0.71 -0.19 114.58 121.03 1nqt h GLU 292 Ca 0.31 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.65 1nqt h GLU 292 Cb 0.27 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1nqt h GLU 292 CO -0.11 -0.45 0.28 -0.44 -0.73 0.00 0.00 179.01 177.57 1nqt h ASP 293 N -0.70 0.00 0.33 1.04 3.32 -0.19 -0.05 116.42 120.17 1nqt h ASP 293 Ca -0.06 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1nqt h ASP 293 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1nqt h ASP 293 CO 0.07 0.00 -0.16 0.15 -1.72 0.00 0.00 179.24 177.59 1nqt h PHE 294 N 0.00 -0.41 -1.21 4.55 3.57 -0.31 -2.16 116.94 120.97 1nqt h PHE 294 Ca 0.10 -0.01 0.41 0.00 3.53 0.00 0.00 57.97 62.00 1nqt h PHE 294 Cb 0.66 0.14 -0.14 0.00 2.79 0.00 0.00 35.95 39.40 1nqt h PHE 294 CO 0.00 -0.19 0.75 -0.22 -2.23 0.00 0.00 178.31 176.42 1nqt h LYS 295 N -1.08 0.12 0.00 1.11 1.63 0.77 -2.08 116.57 117.04 1nqt h LYS 295 Ca -0.05 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1nqt h LYS 295 Cb 0.40 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 1nqt h LYS 295 CO 0.07 0.08 -0.01 1.25 -3.45 0.00 0.00 179.45 177.39 1nqt h LEU 296 N 0.12 0.01 -0.61 5.20 7.12 -1.24 -3.36 115.31 122.55 1nqt h LEU 296 Ca 0.80 -0.97 0.12 0.00 0.13 0.00 0.00 57.88 57.97 1nqt h LEU 296 Cb 2.34 -0.00 -0.10 0.00 -0.53 0.00 0.00 40.66 42.37 1nqt h LEU 296 CO -0.49 0.98 0.03 -0.61 -0.13 0.00 0.00 178.44 178.21 1nqt h GLN 297 N -0.96 0.14 0.00 1.25 4.15 -0.69 -3.44 115.11 115.57 1nqt h GLN 297 Ca -0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1nqt h GLN 297 Cb 0.98 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.64 1nqt h GLN 297 CO 0.00 0.09 0.00 -2.39 -1.93 0.00 0.00 178.83 174.60 1nqt n HIS 298 N -5.25 0.00 -0.11 3.99 1.44 -1.10 -5.12 115.22 109.07 1nqt n HIS 298 Ca 0.09 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.63 1nqt n HIS 298 Cb 0.35 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.40 1nqt n HIS 298 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1nqt n GLY 299 N 5.00 -0.50 3.09 -1.39 0.00 -1.26 -4.95 105.19 105.17 1nqt n GLY 299 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 1nqt n GLY 299 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nqt s SER 300 N -6.54 0.14 0.00 1.61 0.15 -1.26 -4.92 113.70 102.88 1nqt s SER 300 Ca -0.33 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 55.90 1nqt s SER 300 Cb 0.08 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1nqt s SER 300 CO 0.45 -0.43 0.18 2.30 1.20 0.00 0.00 173.24 176.94 1nqt n ILE 301 N 1.13 0.00 -1.40 6.45 -5.35 -1.26 -4.73 119.36 114.20 1nqt n ILE 301 Ca -0.21 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 61.94 1nqt n ILE 301 Cb 0.57 -0.75 0.09 0.00 -1.74 0.00 0.00 39.64 37.81 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 -1.21 3.24 -1.43 7.28 2.01 -1.26 -3.61 118.68 123.70 1nqt s LEU 302 Ca 0.00 2.19 -0.07 0.00 0.01 0.00 0.00 54.13 56.26 1nqt s LEU 302 Cb 0.00 -4.57 0.04 0.00 0.01 0.00 0.00 46.19 41.67 1nqt s LEU 302 CO 0.00 -2.19 0.80 0.61 1.01 0.00 0.00 176.35 176.57 1nqt n GLY 303 N -0.02 -0.38 3.72 -3.19 0.00 -1.26 -4.96 105.19 99.10 1nqt n GLY 303 Ca 0.12 0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.53 3.48 0.31 1.61 5.36 -1.24 -5.06 117.98 118.91 1nqt s PHE 304 Ca 0.31 0.75 -0.28 0.00 -0.96 0.00 0.00 56.93 56.76 1nqt s PHE 304 Cb -0.16 -2.47 -0.09 0.00 -0.34 0.00 0.00 43.02 39.96 1nqt s PHE 304 CO 0.83 0.17 1.04 -2.14 -1.46 0.00 0.00 175.22 173.67 1nqt s PRO 305 N 0.65 4.55 0.00 10.12 0.02 -1.26 -3.62 135.00 145.46 1nqt s PRO 305 Ca 0.22 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1nqt s PRO 305 Cb -0.14 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1nqt s PRO 305 CO 0.08 0.18 0.00 1.63 -0.33 0.00 0.00 177.00 178.56 1nqt n LYS 306 N 0.87 0.00 -3.62 5.54 5.02 -1.26 -5.05 118.16 119.65 1nqt n LYS 306 Ca 0.01 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1nqt n LYS 306 Cb 0.47 -2.38 -0.06 0.00 -0.02 0.00 0.00 35.03 33.04 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 -2.08 -2.57 -0.25 7.82 0.00 -1.24 -4.87 121.76 118.57 1nqt s ALA 307 Ca 0.00 2.05 -0.12 0.00 0.00 0.00 0.00 51.96 53.89 1nqt s ALA 307 Cb 0.00 -1.92 -0.05 0.00 0.00 0.00 0.00 23.12 21.16 1nqt s ALA 307 CO 0.00 -0.37 0.21 0.21 0.00 0.00 0.00 175.76 175.82 1nqt s LYS 308 N 1.21 4.05 0.47 0.00 2.47 -0.69 -4.63 119.74 122.62 1nqt s LYS 308 Ca -0.08 -0.20 -0.16 0.00 -1.56 0.00 0.00 55.97 53.98 1nqt s LYS 308 Cb -0.03 -3.58 -0.13 0.00 -1.46 0.00 0.00 37.83 32.64 1nqt s LYS 308 CO -0.12 -0.03 -0.14 -2.30 0.16 0.00 0.00 175.35 172.92 1nqt n PRO 309 N 4.57 0.00 -4.18 4.03 -0.02 -1.26 -2.68 135.00 135.46 1nqt n PRO 309 Ca -0.13 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.16 1nqt n PRO 309 Cb 0.52 -0.88 -0.12 0.00 -0.02 0.00 0.00 33.50 33.00 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 -1.76 1.23 -0.27 6.00 5.04 -1.25 -4.70 117.35 121.63 1nqt s TYR 310 Ca 0.49 -0.47 -0.08 0.00 -2.44 0.00 0.00 57.07 54.58 1nqt s TYR 310 Cb -0.42 -0.69 -0.01 0.00 0.35 0.00 0.00 41.96 41.19 1nqt s TYR 310 CO 0.59 0.06 0.09 -2.00 -1.34 0.00 0.00 175.55 172.95 1nqt s GLU 311 N -1.81 3.42 0.00 4.97 2.56 -1.26 -3.97 118.70 122.61 1nqt s GLU 311 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 54.97 54.32 1nqt s GLU 311 Cb -0.10 -3.38 0.00 0.00 2.00 0.00 0.00 34.13 32.65 1nqt s GLU 311 CO 0.02 -0.31 0.00 0.41 -0.56 0.00 0.00 175.26 174.82 1nqt n GLY 312 N 4.92 0.53 3.08 -1.50 0.00 -1.26 -4.97 105.19 105.99 1nqt n GLY 312 Ca -0.15 -1.33 -0.25 0.00 0.00 0.00 0.00 46.02 44.28 1nqt n GLY 312 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nqt s SER 313 N -4.00 1.98 0.00 1.61 0.01 -1.26 -4.50 113.70 107.54 1nqt s SER 313 Ca 0.00 -0.33 0.01 0.00 1.31 0.00 0.00 55.95 56.94 1nqt s SER 313 Cb 0.00 -0.71 0.04 0.00 0.21 0.00 0.00 66.02 65.56 1nqt s SER 313 CO 0.00 0.10 0.92 2.30 0.41 0.00 0.00 173.24 176.97 1nqt n ILE 314 N 3.43 1.52 -0.36 1.44 -0.00 -1.26 -3.59 119.36 120.54 1nqt n ILE 314 Ca -0.20 0.38 0.27 0.00 -0.00 0.00 0.00 62.75 63.20 1nqt n ILE 314 Cb 0.53 -1.37 0.55 0.00 -0.00 0.00 0.00 39.64 39.35 1nqt n ILE 314 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1nqt h LEU 315 N 0.00 0.38 0.01 7.28 3.38 -1.95 -1.28 115.31 123.14 1nqt h LEU 315 Ca 0.00 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1nqt h LEU 315 Cb 0.01 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1nqt h LEU 315 CO 0.00 -0.02 -0.00 -0.33 0.09 0.00 0.00 178.44 178.18 1nqt h GLU 316 N 0.29 -0.01 0.00 1.13 4.39 -1.85 -3.42 114.58 115.11 1nqt h GLU 316 Ca 0.68 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.38 1nqt h GLU 316 Cb 1.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.51 1nqt h GLU 316 CO -0.36 0.34 0.00 0.00 -1.16 0.00 0.00 179.01 177.83 1nqt n ALA 317 N -2.72 -0.06 -2.22 3.43 0.00 -0.48 -3.29 120.51 115.16 1nqt n ALA 317 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 1nqt n ALA 317 Cb 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.59 1nqt n ALA 317 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nqt s ASP 318 N 0.00 6.83 -0.03 0.00 2.15 -1.26 -4.51 116.67 119.85 1nqt s ASP 318 Ca 0.00 2.05 -0.30 0.00 0.43 0.00 0.00 52.55 54.72 1nqt s ASP 318 Cb 0.00 -2.55 0.11 0.00 -0.30 0.00 0.00 42.92 40.18 1nqt s ASP 318 CO 0.00 -0.77 1.11 0.00 -0.17 0.00 0.00 175.17 175.34 1nqt h ASP 320 N 2.00 -0.37 -3.42 0.00 5.19 0.64 -3.06 116.42 117.39 1nqt h ASP 320 Ca -0.21 0.01 -0.66 0.00 -0.62 0.00 0.00 57.03 55.56 1nqt h ASP 320 Cb 1.21 0.10 -0.27 0.00 0.18 0.00 0.00 39.33 40.55 1nqt h ASP 320 CO 0.27 -0.19 -0.71 0.27 -3.12 0.00 0.00 179.24 175.76 1nqt s ILE 321 N -3.39 3.51 -0.30 0.35 -4.36 -1.07 0.30 121.20 116.24 1nqt s ILE 321 Ca -0.06 -0.45 -0.13 0.00 -0.26 0.00 0.00 60.65 59.75 1nqt s ILE 321 Cb 0.01 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 41.08 1nqt s ILE 321 CO 0.19 0.42 0.25 -0.22 0.24 0.00 0.00 174.94 175.82 1nqt s LEU 322 N 1.40 4.19 -0.62 0.37 0.20 0.52 -1.21 118.68 123.53 1nqt s LEU 322 Ca 0.05 -0.08 -0.07 0.00 0.69 0.00 0.00 54.13 54.72 1nqt s LEU 322 Cb -0.14 -2.20 0.16 0.00 -0.43 0.00 0.00 46.19 43.58 1nqt s LEU 322 CO -0.02 -0.15 0.47 -0.63 -0.29 0.00 0.00 176.35 175.74 1nqt s ILE 323 N 1.83 4.20 -0.68 6.68 1.01 0.93 -1.03 121.20 134.14 1nqt s ILE 323 Ca 0.09 -2.54 -0.26 0.00 0.00 0.00 0.00 60.65 57.94 1nqt s ILE 323 Cb -0.16 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 1nqt s ILE 323 CO 0.11 -0.88 1.82 -2.84 0.00 0.00 0.00 174.94 173.15 1nqt s PRO 324 N 0.38 2.68 -0.78 2.79 0.02 -1.20 -1.56 135.00 137.33 1nqt s PRO 324 Ca 0.14 0.34 0.03 0.00 0.02 0.00 0.00 61.00 61.52 1nqt s PRO 324 Cb -0.20 -4.52 0.29 0.00 0.02 0.00 0.00 34.50 30.10 1nqt s PRO 324 CO -0.04 -2.80 1.10 0.00 -0.33 0.00 0.00 177.00 174.93 1nqt n ALA 325 N 12.63 4.73 -2.12 -1.55 0.00 -0.07 -1.33 120.51 132.80 1nqt n ALA 325 Ca 0.23 -4.75 0.00 0.00 0.00 0.00 0.00 53.44 48.92 1nqt n ALA 325 Cb 0.51 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 0.58 0.00 -1.21 0.00 0.00 -1.24 -4.06 120.51 114.58 1nqt n ALA 326 Ca 0.31 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.43 1nqt n ALA 326 Cb 0.37 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.92 1nqt n ALA 326 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1nqt s SER 327 N 2.00 4.23 1.02 0.00 0.15 -1.26 -4.62 113.70 115.22 1nqt s SER 327 Ca 0.00 2.04 -0.11 0.00 0.70 0.00 0.00 55.95 58.58 1nqt s SER 327 Cb 0.00 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 61.93 1nqt s SER 327 CO 0.00 -2.23 0.40 -0.62 1.20 0.00 0.00 173.24 171.99 1nqt n GLU 328 N -3.28 -2.15 -1.60 5.44 1.02 -1.26 -4.25 120.64 114.55 1nqt n GLU 328 Ca 0.11 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.58 1nqt n GLU 328 Cb 0.52 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 1nqt n GLU 328 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1nqt n LYS 329 N -2.58 -0.43 -0.97 3.49 4.01 -1.04 -4.77 118.16 115.86 1nqt n LYS 329 Ca 0.06 -0.21 -0.06 0.00 -0.51 0.00 0.00 58.31 57.58 1nqt n LYS 329 Cb 0.27 0.38 0.28 0.00 -0.51 0.00 0.00 35.03 35.45 1nqt n LYS 329 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 1nqt n GLN 330 N -0.40 3.28 -3.20 1.97 -0.06 0.13 -4.65 117.38 114.45 1nqt n GLN 330 Ca 0.00 -3.07 0.01 0.00 -2.00 0.00 0.00 57.00 51.93 1nqt n GLN 330 Cb 0.00 -2.14 -0.01 0.00 -4.06 0.00 0.00 30.24 24.03 1nqt n GLN 330 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1nqt s LEU 331 N -3.05 -1.46 0.00 1.69 1.43 -0.63 -4.94 118.68 111.72 1nqt s LEU 331 Ca 0.53 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 53.15 1nqt s LEU 331 Cb 0.43 1.88 0.04 0.00 0.03 0.00 0.00 46.19 48.57 1nqt s LEU 331 CO 0.11 -0.22 0.31 0.35 0.23 0.00 0.00 176.35 177.13 1nqt n THR 332 N 4.75 0.00 -0.08 5.49 -2.24 -1.26 -0.98 114.28 119.96 1nqt n THR 332 Ca 0.09 -1.48 0.14 0.00 -2.27 0.00 0.00 64.05 60.54 1nqt n THR 332 Cb 0.55 -0.22 0.54 0.00 -2.10 0.00 0.00 70.33 69.10 1nqt n THR 332 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1nqt h LYS 333 N 0.00 0.31 0.00 -0.78 3.64 -1.94 0.58 116.57 118.37 1nqt h LYS 333 Ca -0.23 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1nqt h LYS 333 Cb 0.87 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1nqt h LYS 333 CO 0.36 0.20 0.00 0.43 -2.27 0.00 0.00 179.45 178.18 1nqt n SER 334 N -4.46 0.00 0.16 4.20 7.64 -1.26 -3.87 113.62 116.03 1nqt n SER 334 Ca 0.10 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.09 1nqt n SER 334 Cb 0.45 0.00 0.57 0.00 -1.01 0.00 0.00 64.21 64.22 1nqt n SER 334 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1nqt n ASN 335 N 0.00 0.57 -0.36 6.43 2.04 -1.23 -3.91 115.26 118.80 1nqt n ASN 335 Ca 0.00 0.75 -0.01 0.00 -0.44 0.00 0.00 54.58 54.88 1nqt n ASN 335 Cb 0.00 -0.83 0.04 0.00 -2.53 0.00 0.00 39.78 36.47 1nqt n ASN 335 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nqt n ALA 336 N -1.77 -0.10 -0.25 -2.53 0.00 0.19 -1.56 120.51 114.49 1nqt n ALA 336 Ca -0.01 0.94 -0.06 0.00 0.00 0.00 0.00 53.44 54.31 1nqt n ALA 336 Cb 0.06 -0.43 0.05 0.00 0.00 0.00 0.00 19.45 19.13 1nqt n ALA 336 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1nqt h PRO 337 N 0.00 0.98 0.00 0.00 0.11 -1.79 -3.16 132.00 128.14 1nqt h PRO 337 Ca 0.33 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1nqt h PRO 337 Cb 0.57 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1nqt h PRO 337 CO -0.93 0.77 0.00 0.54 -0.21 0.00 0.00 178.00 178.16 1nqt n ARG 338 N -4.46 0.29 -2.84 1.05 3.00 -0.60 -4.78 116.66 108.31 1nqt n ARG 338 Ca 0.05 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.48 1nqt n ARG 338 Cb 0.12 -1.33 -0.04 0.00 0.00 0.00 0.00 32.46 31.21 1nqt n ARG 338 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1nqt s VAL 339 N -2.00 4.80 -0.02 1.55 -7.23 -1.19 -4.74 120.40 111.56 1nqt s VAL 339 Ca 0.09 1.85 0.02 0.00 -1.81 0.00 0.00 61.98 62.14 1nqt s VAL 339 Cb 0.04 -4.22 -0.25 0.00 0.56 0.00 0.00 36.38 32.51 1nqt s VAL 339 CO 0.07 0.25 0.76 0.11 -0.31 0.00 0.00 175.10 175.98 1nqt h LYS 340 N 6.29 0.15 -6.67 4.82 1.79 -1.79 -3.48 116.57 117.68 1nqt h LYS 340 Ca -0.42 -0.25 -0.58 0.00 -2.18 0.00 0.00 60.65 57.22 1nqt h LYS 340 Cb 1.21 0.09 0.13 0.00 -1.58 0.00 0.00 32.23 32.08 1nqt h LYS 340 CO 0.74 0.92 0.24 0.00 -1.08 0.00 0.00 179.45 180.26 1nqt n ALA 341 N -2.65 0.41 0.03 3.86 0.00 -1.15 -4.75 120.51 116.25 1nqt n ALA 341 Ca -0.17 0.25 -0.22 0.00 0.00 0.00 0.00 53.44 53.30 1nqt n ALA 341 Cb 1.04 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.23 1nqt n ALA 341 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1nqt h LYS 342 N 1.72 0.29 -5.70 0.00 1.79 -0.29 -3.46 116.57 110.92 1nqt h LYS 342 Ca -0.45 -0.49 -0.67 0.00 -2.18 0.00 0.00 60.65 56.86 1nqt h LYS 342 Cb 1.33 0.18 -0.26 0.00 -1.58 0.00 0.00 32.23 31.90 1nqt h LYS 342 CO 0.58 1.23 -0.77 0.42 -1.08 0.00 0.00 179.45 179.83 1nqt s ILE 343 N -2.49 3.01 -0.28 1.86 1.01 -0.83 -1.71 121.20 121.78 1nqt s ILE 343 Ca -0.18 -0.70 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1nqt s ILE 343 Cb 0.04 -2.23 0.03 0.00 0.01 0.00 0.00 42.46 40.32 1nqt s ILE 343 CO 0.80 0.55 -0.00 -0.63 0.00 0.00 0.00 174.94 175.66 1nqt s ILE 344 N -0.05 3.18 -0.58 2.92 1.01 0.12 -0.35 121.20 127.44 1nqt s ILE 344 Ca -0.03 -1.11 -0.16 0.00 0.00 0.00 0.00 60.65 59.35 1nqt s ILE 344 Cb -0.14 -2.71 0.14 0.00 0.01 0.00 0.00 42.46 39.76 1nqt s ILE 344 CO 0.04 0.03 0.53 0.00 0.00 0.00 0.00 174.94 175.55 1nqt s ALA 345 N 1.33 3.71 -0.82 9.38 0.00 -0.19 -0.84 121.76 134.33 1nqt s ALA 345 Ca -0.02 -2.65 -0.25 0.00 0.00 0.00 0.00 51.96 49.04 1nqt s ALA 345 Cb -0.18 -3.30 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1nqt s ALA 345 CO -0.01 -2.05 2.20 -1.21 0.00 0.00 0.00 175.76 174.68 1nqt s GLU 346 N 1.40 2.05 -0.12 0.00 2.02 -0.75 -3.24 118.70 120.06 1nqt s GLU 346 Ca 0.05 0.22 0.05 0.00 0.02 0.00 0.00 54.97 55.31 1nqt s GLU 346 Cb -0.27 -4.87 0.33 0.00 0.10 0.00 0.00 34.13 29.42 1nqt s GLU 346 CO 0.01 -3.90 1.11 0.41 0.02 0.00 0.00 175.26 172.92 1nqt n GLY 347 N 6.75 2.34 1.47 -1.39 0.00 -0.44 -3.85 105.19 110.08 1nqt n GLY 347 Ca 0.43 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt n ALA 348 N 0.16 -0.17 -2.85 4.61 0.00 -1.12 -4.45 120.51 116.69 1nqt n ALA 348 Ca 0.15 -0.70 -0.34 0.00 0.00 0.00 0.00 53.44 52.54 1nqt n ALA 348 Cb 0.73 0.57 -0.10 0.00 0.00 0.00 0.00 19.45 20.65 1nqt n ALA 348 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1nqt s ASN 349 N -1.94 5.45 -1.53 0.00 0.01 -1.26 -4.54 114.94 111.12 1nqt s ASN 349 Ca 0.12 0.04 -0.04 0.00 -0.71 0.00 0.00 52.86 52.27 1nqt s ASN 349 Cb -0.00 -1.93 0.01 0.00 0.41 0.00 0.00 41.25 39.74 1nqt s ASN 349 CO 0.09 0.17 0.43 0.61 -1.51 0.00 0.00 177.10 176.89 1nqt n GLY 350 N 3.54 -0.51 0.27 0.66 0.00 -1.26 -4.65 105.19 103.24 1nqt n GLY 350 Ca -0.17 0.09 0.15 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.96 0.00 -6.50 1.61 0.13 -1.83 -2.77 132.00 121.69 1nqt h PRO 351 Ca -0.49 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.96 1nqt h PRO 351 Cb 1.35 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.29 1nqt h PRO 351 CO 0.55 0.09 -0.76 0.95 -0.23 0.00 0.00 178.00 178.61 1nqt s THR 352 N -3.88 3.17 0.80 1.56 -4.23 -1.26 0.21 115.64 112.01 1nqt s THR 352 Ca -0.01 -1.10 -0.11 0.00 -1.18 0.00 0.00 61.69 59.29 1nqt s THR 352 Cb 0.11 -2.39 0.09 0.00 1.34 0.00 0.00 72.50 71.65 1nqt s THR 352 CO 0.56 0.29 1.16 0.42 -0.54 0.00 0.00 174.62 176.51 1nqt s THR 353 N -1.02 2.06 0.23 3.99 -4.23 -0.15 -4.91 115.64 111.61 1nqt s THR 353 Ca 0.17 -0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.58 1nqt s THR 353 Cb -0.11 -2.99 0.04 0.00 1.34 0.00 0.00 72.50 70.78 1nqt s THR 353 CO 0.08 0.00 1.65 1.55 -0.54 0.00 0.00 174.62 177.36 1nqt h PRO 354 N -1.01 0.70 0.00 3.99 0.13 -1.98 -2.29 132.00 131.54 1nqt h PRO 354 Ca -0.45 -0.28 -0.11 0.00 -0.87 0.00 0.00 66.00 64.29 1nqt h PRO 354 Cb 1.32 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 1nqt h PRO 354 CO 0.61 0.87 -0.52 0.93 -0.23 0.00 0.00 178.00 179.66 1nqt h GLU 355 N 0.61 0.00 -0.02 0.86 4.39 -1.94 -2.44 114.58 116.05 1nqt h GLU 355 Ca 0.09 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.65 1nqt h GLU 355 Cb 0.72 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 1nqt h GLU 355 CO 0.06 0.52 -0.61 0.00 -1.16 0.00 0.00 179.01 177.82 1nqt h ALA 356 N 1.48 0.95 0.81 3.43 0.00 -1.70 -2.96 119.26 121.26 1nqt h ALA 356 Ca -0.01 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 1nqt h ALA 356 Cb 0.97 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1nqt h ALA 356 CO 0.07 0.75 -0.39 -0.44 0.00 0.00 0.00 179.25 179.24 1nqt h ASP 357 N 0.06 -0.92 -0.90 0.00 3.32 -0.96 -1.33 116.42 115.69 1nqt h ASP 357 Ca -0.01 0.02 0.19 0.00 0.02 0.00 0.00 57.03 57.26 1nqt h ASP 357 Cb 1.09 0.24 -0.17 0.00 0.22 0.00 0.00 39.33 40.70 1nqt h ASP 357 CO 0.08 -0.57 -0.18 0.29 -1.72 0.00 0.00 179.24 177.14 1nqt n LYS 358 N -5.50 -0.08 0.21 3.56 4.76 -1.00 0.10 118.16 120.21 1nqt n LYS 358 Ca -0.14 1.39 -0.15 0.00 -2.87 0.00 0.00 58.31 56.55 1nqt n LYS 358 Cb 0.43 -2.11 -0.08 0.00 -1.84 0.00 0.00 35.03 31.43 1nqt n LYS 358 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1nqt h ILE 359 N 0.00 0.64 -0.46 -0.18 5.03 -1.38 -1.60 117.51 119.56 1nqt h ILE 359 Ca 0.45 -0.15 0.13 0.00 -0.12 0.00 0.00 64.86 65.17 1nqt h ILE 359 Cb 0.74 0.72 -0.02 0.00 -3.03 0.00 0.00 36.82 35.23 1nqt h ILE 359 CO -0.91 0.03 0.33 -0.26 -0.68 0.00 0.00 178.15 176.66 1nqt h PHE 360 N -0.59 0.00 -0.07 1.37 0.04 0.85 -1.57 116.94 116.97 1nqt h PHE 360 Ca -0.05 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.67 1nqt h PHE 360 Cb 0.44 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.59 1nqt h PHE 360 CO -0.03 0.00 -0.16 -0.07 -0.60 0.00 0.00 178.31 177.45 1nqt h LEU 361 N 0.00 0.27 0.00 1.54 4.07 -0.64 0.61 115.31 121.17 1nqt h LEU 361 Ca 0.22 -0.57 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1nqt h LEU 361 Cb 0.88 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.54 1nqt h LEU 361 CO -0.00 0.80 0.00 -0.62 -1.08 0.00 0.00 178.44 177.53 1nqt n GLU 362 N -4.59 0.24 -0.00 1.13 -0.58 -0.63 -1.43 120.64 114.78 1nqt n GLU 362 Ca -0.08 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 1nqt n GLU 362 Cb 0.39 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 1nqt n GLU 362 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1nqt n ARG 363 N -1.20 -0.87 -3.04 3.49 1.74 -0.90 -5.03 116.66 110.86 1nqt n ARG 363 Ca 0.07 -0.53 -0.01 0.00 -0.77 0.00 0.00 57.85 56.61 1nqt n ARG 363 Cb 0.08 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 1nqt n ARG 363 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1nqt n ASN 364 N -0.01 -7.66 -4.07 0.55 3.02 -0.52 -5.04 115.26 101.53 1nqt n ASN 364 Ca 0.00 -0.09 -0.29 0.00 -0.03 0.00 0.00 54.58 54.17 1nqt n ASN 364 Cb 0.01 -5.23 -0.17 0.00 -0.61 0.00 0.00 39.78 33.78 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 -3.01 1.60 -0.30 2.41 -1.09 0.21 -4.89 121.20 116.12 1nqt s ILE 365 Ca 0.02 -0.70 -0.21 0.00 -2.23 0.00 0.00 60.65 57.53 1nqt s ILE 365 Cb -0.00 -1.45 -0.01 0.00 -1.58 0.00 0.00 42.46 39.42 1nqt s ILE 365 CO 0.73 0.46 0.68 -0.32 -1.23 0.00 0.00 174.94 175.26 1nqt s MET 366 N 0.99 3.95 -0.37 2.79 1.75 -0.69 -4.45 119.30 123.27 1nqt s MET 366 Ca -0.06 0.42 -0.05 0.00 -1.25 0.00 0.00 55.69 54.75 1nqt s MET 366 Cb -0.15 -3.72 0.07 0.00 2.84 0.00 0.00 34.83 33.88 1nqt s MET 366 CO -0.02 -0.58 0.15 0.14 -0.65 0.00 0.00 175.02 174.05 1nqt s VAL 367 N 2.69 3.55 -0.45 10.11 -7.23 -1.26 0.13 120.40 127.94 1nqt s VAL 367 Ca 0.27 -1.53 -0.29 0.00 -1.81 0.00 0.00 61.98 58.63 1nqt s VAL 367 Cb -0.15 -3.18 0.01 0.00 0.56 0.00 0.00 36.38 33.63 1nqt s VAL 367 CO 0.11 -0.39 1.36 -0.63 -0.31 0.00 0.00 175.10 175.25 1nqt s ILE 368 N 1.29 3.94 0.08 -0.62 1.01 -0.02 -4.36 121.20 122.52 1nqt s ILE 368 Ca 0.01 0.93 -0.34 0.00 0.00 0.00 0.00 60.65 61.26 1nqt s ILE 368 Cb -0.21 -4.32 -0.13 0.00 0.01 0.00 0.00 42.46 37.81 1nqt s ILE 368 CO -0.00 -0.88 1.67 -2.65 0.00 0.00 0.00 174.94 173.08 1nqt n PRO 369 N 8.14 2.13 -0.33 2.79 -0.02 -1.26 -1.80 135.00 144.65 1nqt n PRO 369 Ca 0.15 0.77 0.05 0.00 -2.02 0.00 0.00 63.50 62.45 1nqt n PRO 369 Cb 0.48 -2.56 0.13 0.00 -0.02 0.00 0.00 33.50 31.53 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 6.96 -0.83 0.00 2.55 -0.00 -1.80 1.24 116.42 124.54 1nqt h ASP 370 Ca -0.46 0.28 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 1nqt h ASP 370 Cb 1.26 0.56 0.00 0.00 -0.00 0.00 0.00 39.33 41.16 1nqt h ASP 370 CO 0.91 -0.30 0.75 0.25 -0.00 0.00 0.00 179.24 180.84 1nqt h LEU 371 N 0.00 0.00 0.00 0.15 5.85 -1.90 -1.20 115.31 118.22 1nqt h LEU 371 Ca 0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.17 1nqt h LEU 371 Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1nqt h LEU 371 CO -0.94 0.00 -0.32 0.00 -0.34 0.00 0.00 178.44 176.83 1nqt n TYR 372 N -2.27 0.00 -0.04 1.25 4.19 0.38 -4.52 117.16 116.16 1nqt n TYR 372 Ca -0.00 0.00 -0.15 0.00 3.31 0.00 0.00 57.90 61.06 1nqt n TYR 372 Cb 0.76 0.00 -0.12 0.00 0.49 0.00 0.00 39.34 40.46 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 0.12 -4.17 2.98 5.85 0.49 -3.30 115.31 117.27 1nqt h LEU 373 Ca 0.00 -0.88 -0.48 0.00 0.84 0.00 0.00 57.88 57.36 1nqt h LEU 373 Cb 0.30 -0.04 -0.18 0.00 0.37 0.00 0.00 40.66 41.11 1nqt h LEU 373 CO 0.00 0.99 0.49 -0.46 -0.34 0.00 0.00 178.44 179.12 1nqt n ASN 374 N -4.55 6.65 -0.69 1.25 2.04 -0.53 -3.79 115.26 115.65 1nqt n ASN 374 Ca -0.10 -3.25 0.09 0.00 -0.44 0.00 0.00 54.58 50.87 1nqt n ASN 374 Cb 0.50 -1.14 0.07 0.00 -2.53 0.00 0.00 39.78 36.68 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 0.45 2.51 0.06 -2.53 0.00 -1.24 -4.46 120.51 115.30 1nqt n ALA 375 Ca 0.44 -0.63 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 1nqt n ALA 375 Cb 0.55 -0.60 -0.05 0.00 0.00 0.00 0.00 19.45 19.36 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 3.48 -0.26 -0.26 0.00 0.00 -1.83 -1.34 103.07 102.86 1nqt h GLY 376 Ca 0.00 0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.58 1nqt h GLY 376 CO 0.00 -0.17 -0.33 -1.33 0.00 0.00 0.00 176.54 174.70 1nqt h GLY 377 N -0.31 -1.40 -0.60 4.60 0.00 -1.79 -0.85 103.07 102.71 1nqt h GLY 377 Ca 0.05 0.78 0.14 0.00 0.00 0.00 0.00 47.33 48.31 1nqt h GLY 377 CO -0.17 -0.37 -0.26 -2.08 0.00 0.00 0.00 176.54 173.65 1nqt h VAL 378 N -0.23 0.16 -0.17 4.60 2.07 -1.81 0.60 116.25 121.48 1nqt h VAL 378 Ca 0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.59 1nqt h VAL 378 Cb 0.35 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1nqt h VAL 378 CO -0.37 0.00 -0.30 0.74 0.02 0.00 0.00 177.57 177.67 1nqt h THR 379 N -0.05 0.00 -0.48 2.57 2.02 -0.01 -0.59 112.91 116.38 1nqt h THR 379 Ca 0.34 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.64 1nqt h THR 379 Cb 0.58 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1nqt h THR 379 CO -0.81 0.00 0.33 0.58 0.37 0.00 0.00 175.52 176.00 1nqt h VAL 380 N -0.24 0.81 0.00 3.16 2.07 -0.16 0.35 116.25 122.24 1nqt h VAL 380 Ca 0.03 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1nqt h VAL 380 Cb 0.33 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1nqt h VAL 380 CO -0.29 0.02 -0.04 0.77 0.02 0.00 0.00 177.57 178.04 1nqt h SER 381 N 0.10 0.00 -0.08 0.57 4.64 0.46 -1.14 113.55 118.10 1nqt h SER 381 Ca 0.23 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.38 1nqt h SER 381 Cb 0.77 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1nqt h SER 381 CO -0.02 0.04 -0.55 0.22 -0.87 0.00 0.00 176.83 175.65 1nqt h TYR 382 N 0.00 0.84 0.37 4.77 5.03 0.11 -2.26 116.97 125.83 1nqt h TYR 382 Ca -0.00 -0.30 -0.02 0.00 2.58 0.00 0.00 58.73 60.99 1nqt h TYR 382 Cb 0.59 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.71 1nqt h TYR 382 CO 0.00 1.07 -0.18 0.74 -1.32 0.00 0.00 178.16 178.47 1nqt h PHE 383 N 0.51 -0.46 -0.93 -3.82 0.05 -1.25 -2.22 116.94 108.82 1nqt h PHE 383 Ca 0.01 -0.01 0.26 0.00 3.82 0.00 0.00 57.97 62.05 1nqt h PHE 383 Cb 1.12 0.15 -0.16 0.00 2.00 0.00 0.00 35.95 39.06 1nqt h PHE 383 CO 0.05 -0.13 0.12 1.49 -0.18 0.00 0.00 178.31 179.66 1nqt h GLU 384 N -0.86 0.07 0.45 1.51 4.81 -1.20 0.97 114.58 120.34 1nqt h GLU 384 Ca -0.05 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1nqt h GLU 384 Cb 0.54 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 1nqt h GLU 384 CO 0.08 0.05 -0.43 2.35 -0.73 0.00 0.00 179.01 180.33 1nqt h TRP 385 N 0.08 -1.19 -0.46 0.92 7.01 -1.20 -0.25 115.95 120.85 1nqt h TRP 385 Ca 0.58 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.67 1nqt h TRP 385 Cb 1.20 0.46 -0.10 0.00 -2.10 0.00 0.00 29.16 28.63 1nqt h TRP 385 CO -0.39 -0.58 -0.39 -0.07 -2.79 0.00 0.00 178.44 174.22 1nqt h LEU 386 N -0.87 -1.33 -0.87 0.65 3.38 0.45 0.27 115.31 116.99 1nqt h LEU 386 Ca -0.06 0.22 0.23 0.00 0.09 0.00 0.00 57.88 58.36 1nqt h LEU 386 Cb 0.75 0.60 -0.15 0.00 0.09 0.00 0.00 40.66 41.95 1nqt h LEU 386 CO -0.04 -0.34 0.09 0.50 0.09 0.00 0.00 178.44 178.73 1nqt h LYS 387 N -0.27 0.10 0.47 1.13 3.64 0.15 0.76 116.57 122.54 1nqt h LYS 387 Ca 0.17 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1nqt h LYS 387 Cb 0.57 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1nqt h LYS 387 CO -0.60 0.07 -0.22 -0.91 -2.27 0.00 0.00 179.45 175.51 1nqt h ASN 388 N 0.10 -0.53 -0.60 4.20 4.21 0.12 -1.11 115.58 121.98 1nqt h ASN 388 Ca 0.52 -0.01 0.10 0.00 1.21 0.00 0.00 56.30 58.13 1nqt h ASN 388 Cb 1.02 0.14 -0.11 0.00 -1.12 0.00 0.00 38.32 38.25 1nqt h ASN 388 CO -0.75 -0.34 -0.38 -0.07 -1.29 0.00 0.00 177.43 174.60 1nqt h LEU 389 N -0.67 -1.31 -1.73 1.61 3.38 0.14 -1.47 115.31 115.26 1nqt h LEU 389 Ca -0.06 0.24 0.02 0.00 0.09 0.00 0.00 57.88 58.17 1nqt h LEU 389 Cb 0.50 0.63 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1nqt h LEU 389 CO 0.11 -0.32 0.22 0.78 0.09 0.00 0.00 178.44 179.31 1nqt h ASN 390 N -0.19 0.30 -5.87 -0.43 2.35 -0.08 -3.48 115.58 108.19 1nqt h ASN 390 Ca 0.21 -0.01 -0.39 0.00 -0.55 0.00 0.00 56.30 55.56 1nqt h ASN 390 Cb 0.56 -0.07 0.12 0.00 0.05 0.00 0.00 38.32 38.98 1nqt h ASN 390 CO -0.69 0.21 -0.71 1.41 -1.65 0.00 0.00 177.43 176.00 1nqt n HIS 391 N -4.49 -2.65 -3.63 1.19 8.25 -0.43 -5.01 115.22 108.45 1nqt n HIS 391 Ca 0.02 0.98 -0.12 0.00 -0.26 0.00 0.00 57.72 58.35 1nqt n HIS 391 Cb 0.13 -4.91 -0.07 0.00 1.12 0.00 0.00 29.99 26.26 1nqt n HIS 391 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1nqt s VAL 392 N -3.34 0.00 0.15 1.59 1.01 -1.25 -5.11 120.40 113.45 1nqt s VAL 392 Ca 0.45 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 1nqt s VAL 392 Cb -0.20 -1.00 -0.07 0.00 0.00 0.00 0.00 36.38 35.10 1nqt s VAL 392 CO 0.74 0.00 1.20 -0.94 0.00 0.00 0.00 175.10 176.10 1nqt s SER 393 N 0.40 7.09 0.26 3.32 1.04 -1.26 -4.88 113.70 119.67 1nqt s SER 393 Ca 0.00 2.17 -0.27 0.00 0.48 0.00 0.00 55.95 58.34 1nqt s SER 393 Cb -0.05 -2.60 -0.15 0.00 0.10 0.00 0.00 66.02 63.32 1nqt s SER 393 CO -0.02 -0.39 0.68 -1.22 0.98 0.00 0.00 173.24 173.26 1nqt n TYR 394 N 2.89 0.06 -0.74 5.02 4.02 -1.26 -1.39 117.16 125.77 1nqt n TYR 394 Ca 0.06 0.83 0.00 0.00 -0.01 0.00 0.00 57.90 58.77 1nqt n TYR 394 Cb 0.45 -2.06 0.00 0.00 -0.02 0.00 0.00 39.34 37.71 1nqt n TYR 394 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nqt n GLY 395 N 1.72 0.43 0.20 2.72 0.00 -1.26 -4.30 105.19 104.70 1nqt n GLY 395 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 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 1.28 0.32 -0.00 1.61 1.12 -1.60 -1.81 114.38 115.29 1nqt h ARG 396 Ca 0.00 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 1nqt h ARG 396 Cb 0.04 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 29.92 1nqt h ARG 396 CO 0.00 0.21 -0.40 1.28 -3.11 0.00 0.00 179.97 177.95 1nqt n LEU 397 N -5.03 0.49 -0.00 3.80 4.32 -1.26 -4.46 117.00 114.85 1nqt n LEU 397 Ca 0.06 0.03 0.03 0.00 -0.02 0.00 0.00 56.01 56.11 1nqt n LEU 397 Cb 0.22 -0.26 -0.05 0.00 -1.62 0.00 0.00 43.42 41.71 1nqt n LEU 397 CO 0.23 0.12 -0.41 0.35 -1.22 0.00 0.00 177.39 176.46 1nqt n THR 398 N -1.40 0.00 -0.35 -5.08 -2.24 -0.97 -4.60 114.28 99.64 1nqt n THR 398 Ca 0.07 -0.21 0.09 0.00 -2.27 0.00 0.00 64.05 61.72 1nqt n THR 398 Cb 0.33 0.54 0.27 0.00 -2.10 0.00 0.00 70.33 69.38 1nqt n THR 398 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1nqt h PHE 399 N 0.00 1.09 0.51 4.78 0.05 -1.56 -0.33 116.94 121.48 1nqt h PHE 399 Ca 0.00 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.80 1nqt h PHE 399 Cb 0.27 -0.34 0.00 0.00 2.00 0.00 0.00 35.95 37.88 1nqt h PHE 399 CO 0.00 0.39 -0.24 -0.22 -0.18 0.00 0.00 178.31 178.06 1nqt h LYS 400 N 0.91 -0.66 -0.88 1.51 1.63 -1.85 -2.14 116.57 115.09 1nqt h LYS 400 Ca 0.51 0.04 0.23 0.00 -0.85 0.00 0.00 60.65 60.58 1nqt h LYS 400 Cb 0.60 0.15 -0.13 0.00 -0.60 0.00 0.00 32.23 32.25 1nqt h LYS 400 CO -0.28 -0.39 0.33 -0.92 -3.45 0.00 0.00 179.45 174.74 1nqt h TYR 401 N -1.12 0.53 0.00 1.91 3.20 -1.67 0.26 116.97 120.09 1nqt h TYR 401 Ca -0.07 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 1nqt h TYR 401 Cb 0.58 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 1nqt h TYR 401 CO 0.01 -0.11 -0.01 0.93 -1.64 0.00 0.00 178.16 177.33 1nqt h GLU 402 N 0.32 0.00 0.09 1.82 4.39 -1.10 -0.30 114.58 119.80 1nqt h GLU 402 Ca 0.55 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.25 1nqt h GLU 402 Cb 1.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1nqt h GLU 402 CO -0.57 0.01 -0.04 -0.09 -1.16 0.00 0.00 179.01 177.16 1nqt h ARG 403 N 0.00 -0.11 0.41 2.33 2.43 0.17 -2.59 114.38 117.02 1nqt h ARG 403 Ca -0.00 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1nqt h ARG 403 Cb 0.89 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1nqt h ARG 403 CO 0.00 0.34 -0.46 -0.44 -1.51 0.00 0.00 179.97 177.90 1nqt h ASP 404 N -0.62 -1.27 -0.95 -3.80 3.45 -1.16 -1.98 116.42 110.09 1nqt h ASP 404 Ca -0.01 0.11 0.29 0.00 0.43 0.00 0.00 57.03 57.84 1nqt h ASP 404 Cb 0.51 0.43 -0.15 0.00 -0.56 0.00 0.00 39.33 39.56 1nqt h ASP 404 CO 0.02 -0.60 0.42 0.28 -1.57 0.00 0.00 179.24 177.78 1nqt h SER 405 N -0.89 0.27 -0.30 6.45 0.02 -1.12 0.11 113.55 118.09 1nqt h SER 405 Ca -0.04 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1nqt h SER 405 Cb 0.80 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.53 1nqt h SER 405 CO -0.09 -0.16 0.17 0.78 -1.14 0.00 0.00 176.83 176.39 1nqt h ASN 406 N 0.26 0.37 0.07 3.07 -0.26 -0.95 -0.74 115.58 117.40 1nqt h ASN 406 Ca 0.66 -0.08 -0.08 0.00 -0.56 0.00 0.00 56.30 56.25 1nqt h ASN 406 Cb 1.44 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 38.60 1nqt h ASN 406 CO -0.64 0.34 -0.24 1.88 -1.06 0.00 0.00 177.43 177.71 1nqt h TYR 407 N 0.37 0.32 -0.59 1.19 0.05 -0.44 -1.34 116.97 116.54 1nqt h TYR 407 Ca 0.11 -0.06 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 1nqt h TYR 407 Cb 0.05 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1nqt h TYR 407 CO -0.03 0.51 0.04 0.45 -1.05 0.00 0.00 178.16 178.07 1nqt h HIS 408 N 0.26 1.06 0.44 4.88 3.86 -0.86 0.43 115.15 125.23 1nqt h HIS 408 Ca 0.04 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.08 1nqt h HIS 408 Cb 0.57 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.75 1nqt h HIS 408 CO 0.01 0.93 -0.25 1.25 0.86 0.00 0.00 177.93 180.73 1nqt h LEU 409 N 0.92 -0.62 0.21 2.43 7.12 -0.28 -0.71 115.31 124.37 1nqt h LEU 409 Ca 0.17 0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.22 1nqt h LEU 409 Cb 0.48 0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.78 1nqt h LEU 409 CO 0.02 -0.41 -0.16 -0.07 -0.13 0.00 0.00 178.44 177.69 1nqt h LEU 410 N -0.66 -0.42 -0.75 2.25 3.38 -1.10 -2.20 115.31 115.82 1nqt h LEU 410 Ca -0.05 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.12 1nqt h LEU 410 Cb 0.53 0.14 -0.13 0.00 0.09 0.00 0.00 40.66 41.28 1nqt h LEU 410 CO 0.07 -0.25 -0.01 0.24 0.09 0.00 0.00 178.44 178.58 1nqt h MET 411 N -0.38 0.09 0.49 1.13 2.86 -0.05 0.70 114.93 119.77 1nqt h MET 411 Ca -0.01 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1nqt h MET 411 Cb 0.34 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1nqt h MET 411 CO -0.01 0.06 -0.37 0.77 1.06 0.00 0.00 176.91 178.41 1nqt h SER 412 N 0.09 -0.98 -0.96 1.22 0.02 -0.76 0.14 113.55 112.33 1nqt h SER 412 Ca 0.41 0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.52 1nqt h SER 412 Cb 0.71 0.30 -0.12 0.00 0.14 0.00 0.00 62.40 63.43 1nqt h SER 412 CO -0.67 -0.53 -0.55 0.58 -1.14 0.00 0.00 176.83 174.51 1nqt h VAL 413 N -0.83 0.00 -0.48 2.27 2.07 -0.72 0.11 116.25 118.67 1nqt h VAL 413 Ca -0.06 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.52 1nqt h VAL 413 Cb 0.69 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.37 1nqt h VAL 413 CO 0.02 0.00 -0.51 -0.61 0.02 0.00 0.00 177.57 176.49 1nqt h GLN 414 N -0.03 -0.32 -0.65 1.57 4.15 -0.25 0.60 115.11 120.19 1nqt h GLN 414 Ca 0.19 0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.62 1nqt h GLN 414 Cb 0.46 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.19 1nqt h GLN 414 CO -0.92 -0.21 0.39 1.49 -1.93 0.00 0.00 178.83 177.64 1nqt h GLU 415 N -0.33 0.88 -0.30 1.69 4.81 0.07 0.81 114.58 122.21 1nqt h GLU 415 Ca 0.11 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1nqt h GLU 415 Cb 0.58 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1nqt h GLU 415 CO -0.63 0.64 0.20 0.77 -0.73 0.00 0.00 179.01 179.26 1nqt h SER 416 N 0.88 0.23 1.08 1.04 0.02 0.06 -0.19 113.55 116.67 1nqt h SER 416 Ca 0.23 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.11 1nqt h SER 416 Cb -0.02 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1nqt h SER 416 CO -0.04 0.16 -0.95 -0.07 -1.14 0.00 0.00 176.83 174.78 1nqt h LEU 417 N 0.26 0.00 0.00 5.07 4.07 -0.23 -3.28 115.31 121.20 1nqt h LEU 417 Ca 0.13 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1nqt h LEU 417 Cb 0.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.92 1nqt h LEU 417 CO -0.03 0.24 -0.10 -0.33 -1.08 0.00 0.00 178.44 177.14 1nqt h GLU 418 N 0.00 0.00 0.00 1.13 5.08 0.79 -3.16 114.58 118.42 1nqt h GLU 418 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1nqt h GLU 418 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1nqt h GLU 418 CO 0.02 0.00 0.00 -0.09 -1.00 0.00 0.00 179.01 177.94 1nqt h ARG 419 N 0.00 0.00 -1.88 2.33 2.43 -1.18 -3.07 114.38 113.00 1nqt h ARG 419 Ca 0.00 0.00 -0.70 0.00 -0.81 0.00 0.00 59.98 58.47 1nqt h ARG 419 Cb 0.94 0.00 -0.25 0.00 -0.42 0.00 0.00 29.97 30.24 1nqt h ARG 419 CO 0.00 0.00 0.90 1.17 -1.51 0.00 0.00 179.97 180.53 1nqt n LYS 420 N -3.09 2.65 0.00 0.20 4.81 -1.19 -4.70 118.16 116.84 1nqt n LYS 420 Ca 0.02 -3.22 0.00 0.00 -0.87 0.00 0.00 58.31 54.24 1nqt n LYS 420 Cb 0.40 -2.23 0.00 0.00 0.02 0.00 0.00 35.03 33.22 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 -0.28 0.00 0.00 5.64 -0.00 -1.16 -5.06 117.46 116.60 1nqt n PHE 421 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.98 1nqt n PHE 421 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.83 1nqt n PHE 421 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nqt n GLY 422 N 0.00 0.00 4.00 7.13 0.00 -1.25 -5.15 105.19 109.92 1nqt n GLY 422 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1nqt n GLY 422 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nqt s LYS 423 N 0.00 2.79 -0.42 1.61 3.01 -1.26 -5.07 119.74 120.40 1nqt s LYS 423 Ca 0.00 -1.27 0.10 0.00 -1.01 0.00 0.00 55.97 53.79 1nqt s LYS 423 Cb 0.00 -2.73 0.40 0.00 -1.01 0.00 0.00 37.83 34.49 1nqt s LYS 423 CO 0.00 -0.29 0.94 -2.39 0.51 0.00 0.00 175.35 174.12 1nqt n HIS 424 N -1.85 2.15 0.00 3.18 1.44 -1.26 -4.73 115.22 114.15 1nqt n HIS 424 Ca 0.08 -3.38 0.00 0.00 -2.01 0.00 0.00 57.72 52.41 1nqt n HIS 424 Cb 0.59 -0.33 0.00 0.00 0.12 0.00 0.00 29.99 30.37 1nqt n HIS 424 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1nqt n GLY 425 N -0.13 0.00 0.04 -1.39 0.00 -1.26 -5.07 105.19 97.38 1nqt n GLY 425 Ca 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.26 1nqt n GLY 425 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nqt h GLY 426 N 0.00 0.00 -2.89 -0.02 0.00 -1.96 -3.46 103.07 94.74 1nqt h GLY 426 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.86 1nqt h GLY 426 CO 0.00 0.00 0.37 -1.59 0.00 0.00 0.00 176.54 175.32 1nqt s THR 427 N -1.52 4.04 -0.36 4.70 2.01 -1.26 -5.04 115.64 118.20 1nqt s THR 427 Ca -0.03 1.62 0.11 0.00 0.31 0.00 0.00 61.69 63.70 1nqt s THR 427 Cb 0.00 -3.87 0.45 0.00 0.01 0.00 0.00 72.50 69.09 1nqt s THR 427 CO 0.04 0.07 1.08 -0.38 -0.69 0.00 0.00 174.62 174.74 1nqt n ILE 428 N 0.29 1.88 -0.24 1.82 2.08 -1.26 -4.86 119.36 119.07 1nqt n ILE 428 Ca 0.03 -4.08 0.04 0.00 0.56 0.00 0.00 62.75 59.30 1nqt n ILE 428 Cb 0.50 -0.44 0.15 0.00 -0.75 0.00 0.00 39.64 39.10 1nqt n ILE 428 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1nqt h PRO 429 N 2.65 0.14 -5.02 0.38 0.11 -1.92 -3.28 132.00 125.06 1nqt h PRO 429 Ca 0.15 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 1nqt h PRO 429 Cb 1.12 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1nqt h PRO 429 CO 0.67 0.09 0.81 0.44 -0.21 0.00 0.00 178.00 179.80 1nqt n ILE 430 N -5.28 0.00 0.00 4.15 -5.35 -1.26 -4.32 119.36 107.30 1nqt n ILE 430 Ca 0.12 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 1nqt n ILE 430 Cb 0.43 -0.45 0.00 0.00 -1.74 0.00 0.00 39.64 37.88 1nqt n ILE 430 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 1nqt n VAL 431 N 5.58 0.00 -1.12 7.28 3.14 -1.24 -5.05 118.33 126.93 1nqt n VAL 431 Ca 0.12 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.19 1nqt n VAL 431 Cb 0.48 0.00 0.11 0.00 -1.06 0.00 0.00 33.84 33.37 1nqt n VAL 431 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 1nqt s PRO 432 N 0.00 1.87 0.35 1.45 0.02 -1.26 -4.98 135.00 132.45 1nqt s PRO 432 Ca 0.00 1.22 -0.26 0.00 0.02 0.00 0.00 61.00 61.98 1nqt s PRO 432 Cb 0.00 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.58 1nqt s PRO 432 CO 0.00 -1.93 1.08 0.95 -0.33 0.00 0.00 177.00 176.77 1nqt s THR 433 N -2.85 3.56 0.39 0.99 -4.23 -1.26 -4.72 115.64 107.53 1nqt s THR 433 Ca 0.63 1.35 0.23 0.00 -1.18 0.00 0.00 61.69 62.72 1nqt s THR 433 Cb -0.19 -3.78 0.40 0.00 1.34 0.00 0.00 72.50 70.28 1nqt s THR 433 CO 0.57 0.16 1.62 0.00 -0.54 0.00 0.00 174.62 176.42 1nqt h ALA 434 N 3.03 2.36 -0.23 3.99 0.00 -1.99 0.74 119.26 127.16 1nqt h ALA 434 Ca -0.48 0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 1nqt h ALA 434 Cb 1.22 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1nqt h ALA 434 CO 0.64 -1.04 -0.17 0.93 0.00 0.00 0.00 179.25 179.62 1nqt h GLU 435 N 0.12 0.52 -0.67 0.00 3.07 -1.99 -1.89 114.58 113.73 1nqt h GLU 435 Ca 0.81 -0.25 0.09 0.00 -0.50 0.00 0.00 59.36 59.51 1nqt h GLU 435 Cb 2.25 -0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 30.08 1nqt h GLU 435 CO -0.58 0.82 0.32 0.35 -1.40 0.00 0.00 179.01 178.52 1nqt h PHE 436 N 0.22 0.57 0.34 4.33 -0.00 0.05 0.11 116.94 122.56 1nqt h PHE 436 Ca 0.04 0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 58.03 1nqt h PHE 436 Cb 0.70 -0.15 -0.01 0.00 -0.00 0.00 0.00 35.95 36.49 1nqt h PHE 436 CO 0.07 0.20 -0.25 0.37 -0.00 0.00 0.00 178.31 178.70 1nqt h GLN 437 N 0.55 -0.55 -1.29 1.11 5.75 -0.95 -0.99 115.11 118.74 1nqt h GLN 437 Ca 0.33 0.04 0.38 0.00 -0.15 0.00 0.00 58.65 59.24 1nqt h GLN 437 Cb 0.35 0.12 -0.07 0.00 1.07 0.00 0.00 27.48 28.95 1nqt h GLN 437 CO -0.27 -0.36 0.90 -0.44 -2.65 0.00 0.00 178.83 176.01 1nqt h ASP 438 N -0.57 0.13 0.01 -0.69 3.45 -0.54 0.54 116.42 118.75 1nqt h ASP 438 Ca -0.04 0.04 -0.26 0.00 0.43 0.00 0.00 57.03 57.19 1nqt h ASP 438 Cb 0.47 0.02 0.02 0.00 -0.56 0.00 0.00 39.33 39.28 1nqt h ASP 438 CO 0.01 -0.01 -1.02 -0.09 -1.57 0.00 0.00 179.24 176.57 1nqt h ARG 439 N 0.10 0.68 -0.01 3.56 2.43 -0.44 -2.49 114.38 118.20 1nqt h ARG 439 Ca 0.66 -0.74 -0.20 0.00 -0.81 0.00 0.00 59.98 58.89 1nqt h ARG 439 Cb 2.38 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 32.13 1nqt h ARG 439 CO -0.13 1.32 -0.86 0.82 -1.51 0.00 0.00 179.97 179.60 1nqt h ILE 440 N 0.34 1.44 0.01 1.20 2.04 0.69 -2.90 117.51 120.33 1nqt h ILE 440 Ca -0.13 -2.46 -0.00 0.00 1.00 0.00 0.00 64.86 63.27 1nqt h ILE 440 Cb 1.68 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 40.13 1nqt h ILE 440 CO 0.20 0.72 -0.01 0.77 0.00 0.00 0.00 178.15 179.84 1nqt h SER 441 N 0.18 -0.02 -2.32 1.72 4.64 -0.12 -3.29 113.55 114.34 1nqt h SER 441 Ca -0.05 -0.30 -0.74 0.00 -0.47 0.00 0.00 61.79 60.23 1nqt h SER 441 Cb 1.48 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 63.26 1nqt h SER 441 CO 0.14 0.29 0.50 0.61 -0.87 0.00 0.00 176.83 177.50 1nqt n GLY 442 N -0.27 5.87 3.61 -0.77 0.00 -0.94 -4.99 105.19 107.69 1nqt n GLY 442 Ca -0.08 -2.65 -0.39 0.00 0.00 0.00 0.00 46.02 42.90 1nqt n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nqt s ALA 443 N -3.90 3.56 0.30 4.61 0.00 -1.09 -4.85 121.76 120.40 1nqt s ALA 443 Ca 0.41 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.57 1nqt s ALA 443 Cb 0.20 -2.67 -0.06 0.00 0.00 0.00 0.00 23.12 20.59 1nqt s ALA 443 CO -0.11 -0.61 0.08 -1.54 0.00 0.00 0.00 175.76 173.58 1nqt s SER 444 N 1.60 1.90 0.38 0.00 1.04 -1.26 -5.03 113.70 112.33 1nqt s SER 444 Ca 0.14 -1.40 0.10 0.00 0.48 0.00 0.00 55.95 55.27 1nqt s SER 444 Cb -0.16 0.06 0.87 0.00 0.10 0.00 0.00 66.02 66.90 1nqt s SER 444 CO 0.10 -0.68 1.92 -0.08 0.98 0.00 0.00 173.24 175.48 1nqt h GLU 445 N 2.21 0.60 -0.05 4.02 4.81 -1.95 0.78 114.58 125.00 1nqt h GLU 445 Ca -0.39 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1nqt h GLU 445 Cb 1.25 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 1nqt h GLU 445 CO 0.65 0.40 0.05 1.57 -0.73 0.00 0.00 179.01 180.94 1nqt h LYS 446 N 0.62 0.00 -0.20 1.92 2.10 -1.94 -0.80 116.57 118.27 1nqt h LYS 446 Ca 0.36 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.82 1nqt h LYS 446 Cb 0.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 1nqt h LYS 446 CO -0.13 0.00 -0.63 -0.44 -2.00 0.00 0.00 179.45 176.24 1nqt h ASP 447 N 0.00 0.82 0.60 7.07 5.19 -1.20 -0.96 116.42 127.94 1nqt h ASP 447 Ca 0.02 -0.48 -0.15 0.00 -0.62 0.00 0.00 57.03 55.80 1nqt h ASP 447 Cb 0.11 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.37 1nqt h ASP 447 CO -0.00 1.25 -0.70 0.40 -3.12 0.00 0.00 179.24 177.06 1nqt h ILE 448 N 0.53 1.47 -0.13 0.35 1.08 -1.19 -1.83 117.51 117.79 1nqt h ILE 448 Ca -0.01 -2.33 -0.18 0.00 -0.39 0.00 0.00 64.86 61.95 1nqt h ILE 448 Cb 1.23 2.25 0.01 0.00 -3.07 0.00 0.00 36.82 37.24 1nqt h ILE 448 CO 0.13 0.67 -0.63 0.58 -0.69 0.00 0.00 178.15 178.21 1nqt h VAL 449 N 0.06 1.32 0.36 1.67 2.07 -1.08 -1.56 116.25 119.09 1nqt h VAL 449 Ca -0.01 -1.89 -0.02 0.00 0.82 0.00 0.00 66.70 65.60 1nqt h VAL 449 Cb 1.25 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 1nqt h VAL 449 CO 0.10 0.58 -0.17 0.45 0.02 0.00 0.00 177.57 178.55 1nqt h HIS 450 N 0.32 -0.45 0.00 1.57 3.86 -1.17 -1.28 115.15 117.99 1nqt h HIS 450 Ca -0.04 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1nqt h HIS 450 Cb 1.27 0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.88 1nqt h HIS 450 CO 0.10 -0.21 0.00 0.45 0.86 0.00 0.00 177.93 179.13 1nqt n SER 451 N -5.25 0.00 -0.27 2.45 2.88 -0.69 -0.02 113.62 112.72 1nqt n SER 451 Ca -0.10 0.80 0.23 0.00 -1.33 0.00 0.00 58.87 58.47 1nqt n SER 451 Cb 0.24 -0.30 0.43 0.00 -0.75 0.00 0.00 64.21 63.84 1nqt n SER 451 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nqt n GLY 452 N -0.96 -0.71 0.10 0.46 0.00 -0.59 0.13 105.19 103.62 1nqt n GLY 452 Ca 0.00 0.69 -0.12 0.00 0.00 0.00 0.00 46.02 46.59 1nqt n GLY 452 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1nqt h LEU 453 N 0.00 0.20 -1.59 0.99 7.12 0.41 -1.55 115.31 120.89 1nqt h LEU 453 Ca 0.66 -0.27 -0.05 0.00 0.13 0.00 0.00 57.88 58.35 1nqt h LEU 453 Cb 1.68 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 41.75 1nqt h LEU 453 CO -0.66 0.42 -0.22 0.00 -0.13 0.00 0.00 178.44 177.85 1nqt h ALA 454 N 0.79 1.43 0.05 1.25 0.00 0.48 -1.23 119.26 122.02 1nqt h ALA 454 Ca 0.04 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 54.52 1nqt h ALA 454 Cb 0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1nqt h ALA 454 CO 0.00 0.28 -1.07 -0.92 0.00 0.00 0.00 179.25 177.54 1nqt h TYR 455 N 0.00 0.23 0.33 0.00 5.03 -0.97 -2.67 116.97 118.92 1nqt h TYR 455 Ca -0.00 -0.16 -0.02 0.00 2.58 0.00 0.00 58.73 61.13 1nqt h TYR 455 Cb 0.45 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.72 1nqt h TYR 455 CO 0.00 1.10 -0.16 1.15 -1.32 0.00 0.00 178.16 178.93 1nqt h THR 456 N 0.04 0.69 -0.38 1.81 2.02 -0.30 -1.33 112.91 115.46 1nqt h THR 456 Ca -0.06 -0.45 0.07 0.00 0.77 0.00 0.00 66.41 66.74 1nqt h THR 456 Cb 1.80 0.92 -0.09 0.00 -1.74 0.00 0.00 68.15 69.04 1nqt h THR 456 CO 0.16 0.09 -0.40 0.24 0.37 0.00 0.00 175.52 175.98 1nqt h MET 457 N -0.69 -0.31 -0.21 6.66 2.86 -1.36 -0.55 114.93 121.33 1nqt h MET 457 Ca -0.04 0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1nqt h MET 457 Cb 0.48 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 1nqt h MET 457 CO 0.07 -0.20 0.07 1.49 1.06 0.00 0.00 176.91 179.40 1nqt h GLU 458 N -0.32 0.17 -0.31 1.72 4.81 -1.47 0.29 114.58 119.46 1nqt h GLU 458 Ca 0.14 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.41 1nqt h GLU 458 Cb 0.58 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 1nqt h GLU 458 CO -0.55 0.11 0.04 -0.09 -0.73 0.00 0.00 179.01 177.79 1nqt h ARG 459 N 0.17 0.14 -0.14 1.92 2.43 -0.67 -2.47 114.38 115.77 1nqt h ARG 459 Ca 0.09 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1nqt h ARG 459 Cb 0.06 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1nqt h ARG 459 CO -0.10 0.09 0.06 0.77 -1.51 0.00 0.00 179.97 179.29 1nqt h SER 460 N 0.15 0.18 -0.13 -3.80 0.02 -0.82 -0.97 113.55 108.18 1nqt h SER 460 Ca 0.15 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1nqt h SER 460 Cb 0.18 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1nqt h SER 460 CO -0.21 0.28 -0.10 0.00 -1.14 0.00 0.00 176.83 175.65 1nqt h ALA 461 N 0.91 -0.21 -0.06 3.77 0.00 -0.13 0.38 119.26 123.91 1nqt h ALA 461 Ca 0.05 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1nqt h ALA 461 Cb 0.15 0.95 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1nqt h ALA 461 CO -0.00 -0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.51 1nqt n ARG 462 N -3.29 0.00 -0.24 0.00 5.12 -0.96 0.16 116.66 117.46 1nqt n ARG 462 Ca -0.00 0.95 0.12 0.00 -1.93 0.00 0.00 57.85 56.99 1nqt n ARG 462 Cb 0.05 -1.42 0.23 0.00 -1.16 0.00 0.00 32.46 30.16 1nqt n ARG 462 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1nqt n GLN 463 N -2.91 -0.05 0.11 5.56 6.02 -0.38 0.70 117.38 126.43 1nqt n GLN 463 Ca 0.00 1.02 -0.13 0.00 -0.01 0.00 0.00 57.00 57.88 1nqt n GLN 463 Cb 0.00 -1.65 -0.08 0.00 1.02 0.00 0.00 30.24 29.53 1nqt n GLN 463 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1nqt h ILE 464 N 0.00 0.89 0.22 5.09 2.04 0.58 -1.31 117.51 125.01 1nqt h ILE 464 Ca 0.44 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1nqt h ILE 464 Cb 0.97 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 1nqt h ILE 464 CO -0.63 0.12 -0.39 0.24 0.00 0.00 0.00 178.15 177.49 1nqt h MET 465 N -0.54 -0.63 -0.94 2.37 2.86 0.30 -1.43 114.93 116.93 1nqt h MET 465 Ca -0.03 0.04 0.25 0.00 -2.06 0.00 0.00 59.70 57.90 1nqt h MET 465 Cb 0.41 0.14 -0.17 0.00 0.06 0.00 0.00 31.60 32.04 1nqt h MET 465 CO 0.05 -0.42 0.03 -0.09 1.06 0.00 0.00 176.91 177.54 1nqt h ARG 466 N -0.65 0.04 0.00 1.72 2.43 -1.12 1.12 114.38 117.92 1nqt h ARG 466 Ca -0.02 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 1nqt h ARG 466 Cb 0.61 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 1nqt h ARG 466 CO -0.14 0.03 -0.24 1.79 -1.51 0.00 0.00 179.97 179.89 1nqt h THR 467 N 0.04 0.65 0.20 0.20 1.35 -0.84 -1.59 112.91 112.92 1nqt h THR 467 Ca 0.56 -1.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.32 1nqt h THR 467 Cb 1.12 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1nqt h THR 467 CO -0.86 0.24 -0.10 0.00 -0.25 0.00 0.00 175.52 174.55 1nqt h ALA 468 N 1.76 -0.67 -1.41 6.62 0.00 0.23 -2.84 119.26 122.95 1nqt h ALA 468 Ca -0.00 -0.06 0.41 0.00 0.00 0.00 0.00 54.91 55.26 1nqt h ALA 468 Cb 0.69 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 1nqt h ALA 468 CO 0.03 -0.65 1.04 0.52 0.00 0.00 0.00 179.25 180.19 1nqt h MET 469 N -0.41 0.00 0.00 0.00 2.86 -1.01 -0.11 114.93 116.25 1nqt h MET 469 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1nqt h MET 469 Cb 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 1nqt h MET 469 CO 0.05 0.00 0.00 1.17 1.06 0.00 0.00 176.91 179.19 1nqt n LYS 470 N -4.05 0.00 -0.01 1.72 4.81 -0.61 -3.15 118.16 116.86 1nqt n LYS 470 Ca 0.31 0.27 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 1nqt n LYS 470 Cb 1.49 -1.12 0.00 0.00 0.02 0.00 0.00 35.03 35.42 1nqt n LYS 470 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1nqt n TYR 471 N -1.31 0.00 -3.77 5.64 4.01 -0.39 -4.80 117.16 116.54 1nqt n TYR 471 Ca 0.00 -0.25 -0.13 0.00 -0.16 0.00 0.00 57.90 57.36 1nqt n TYR 471 Cb 0.00 -0.18 0.01 0.00 -0.31 0.00 0.00 39.34 38.85 1nqt n TYR 471 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1nqt n ASN 472 N 0.81 -1.15 -4.79 7.72 5.15 -0.20 -4.89 115.26 117.91 1nqt n ASN 472 Ca 0.00 -0.36 -0.32 0.00 -0.60 0.00 0.00 54.58 53.30 1nqt n ASN 472 Cb 0.24 -0.44 -0.07 0.00 -0.53 0.00 0.00 39.78 38.98 1nqt n ASN 472 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1nqt s LEU 473 N -5.52 3.91 0.00 1.20 1.02 -0.84 -5.00 118.68 113.44 1nqt s LEU 473 Ca 0.13 0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.40 1nqt s LEU 473 Cb -0.07 -2.38 0.00 0.00 0.02 0.00 0.00 46.19 43.76 1nqt s LEU 473 CO 0.27 0.24 0.00 0.61 0.02 0.00 0.00 176.35 177.49 1nqt n GLY 474 N 0.94 1.48 0.88 -3.19 0.00 -1.26 -4.33 105.19 99.69 1nqt n GLY 474 Ca -0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.98 1nqt n GLY 474 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nqt n LEU 475 N -0.01 3.63 -3.02 0.99 4.32 -1.26 -4.67 117.00 116.97 1nqt n LEU 475 Ca 0.00 -2.57 -0.29 0.00 -0.02 0.00 0.00 56.01 53.13 1nqt n LEU 475 Cb 0.00 -0.43 -0.05 0.00 -1.62 0.00 0.00 43.42 41.32 1nqt n LEU 475 CO 0.00 0.71 2.79 -0.67 -1.22 0.00 0.00 177.39 179.00 1nqt n ASP 476 N 0.06 7.09 0.06 -1.43 2.03 -1.26 -4.40 116.55 118.70 1nqt n ASP 476 Ca 0.18 -2.47 0.21 0.00 0.52 0.00 0.00 54.79 53.23 1nqt n ASP 476 Cb 0.72 -1.40 0.74 0.00 -0.72 0.00 0.00 41.12 40.46 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 6.90 0.00 0.00 -2.67 4.07 -1.83 -2.19 115.31 119.59 1nqt h LEU 477 Ca 0.65 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.61 1nqt h LEU 477 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 1nqt h LEU 477 CO 1.40 0.00 0.00 -1.14 -1.08 0.00 0.00 178.44 177.62 1nqt n ARG 478 N -3.90 0.00 -0.32 1.13 0.63 -1.26 -2.45 116.66 110.49 1nqt n ARG 478 Ca 0.08 0.15 0.14 0.00 -0.92 0.00 0.00 57.85 57.31 1nqt n ARG 478 Cb 0.62 -1.03 0.30 0.00 0.45 0.00 0.00 32.46 32.80 1nqt n ARG 478 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1nqt h THR 479 N 0.00 0.10 -0.99 5.15 1.35 -1.92 1.33 112.91 117.94 1nqt h THR 479 Ca 0.00 -0.02 0.16 0.00 -0.55 0.00 0.00 66.41 66.00 1nqt h THR 479 Cb 0.00 0.04 -0.09 0.00 -1.73 0.00 0.00 68.15 66.37 1nqt h THR 479 CO 0.00 0.01 0.62 0.00 -0.25 0.00 0.00 175.52 175.90 1nqt h ALA 480 N 1.92 1.66 0.56 6.62 0.00 -1.48 0.79 119.26 129.33 1nqt h ALA 480 Ca 0.59 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.52 1nqt h ALA 480 Cb 1.23 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.88 1nqt h ALA 480 CO -0.84 0.04 -0.27 0.00 0.00 0.00 0.00 179.25 178.18 1nqt h ALA 481 N 1.59 -0.81 -1.05 0.00 0.00 0.20 0.52 119.26 119.71 1nqt h ALA 481 Ca 0.53 -0.16 0.27 0.00 0.00 0.00 0.00 54.91 55.55 1nqt h ALA 481 Cb 0.72 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.70 1nqt h ALA 481 CO -0.30 -0.76 0.67 1.88 0.00 0.00 0.00 179.25 180.74 1nqt h TYR 482 N -1.09 0.69 0.72 0.00 0.05 -0.79 0.12 116.97 116.67 1nqt h TYR 482 Ca -0.08 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 1nqt h TYR 482 Cb 0.57 -0.20 0.01 0.00 1.01 0.00 0.00 36.73 38.12 1nqt h TYR 482 CO 0.02 0.04 -0.35 0.28 -1.05 0.00 0.00 178.16 177.10 1nqt h VAL 483 N 0.40 0.00 -0.79 -2.88 2.07 0.93 -1.43 116.25 114.55 1nqt h VAL 483 Ca 0.61 -0.09 0.14 0.00 0.82 0.00 0.00 66.70 68.19 1nqt h VAL 483 Cb 1.53 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 31.16 1nqt h VAL 483 CO -0.33 0.00 -0.25 -3.20 0.02 0.00 0.00 177.57 173.81 1nqt n ASN 484 N -4.84 -0.39 0.00 0.57 5.15 0.26 -1.12 115.26 114.88 1nqt n ASN 484 Ca -0.12 1.37 0.00 0.00 -0.60 0.00 0.00 54.58 55.23 1nqt n ASN 484 Cb 0.38 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.26 1nqt n ASN 484 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nqt n ALA 485 N -3.65 -0.23 -0.16 5.20 0.00 -0.25 -1.94 120.51 119.49 1nqt n ALA 485 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 1nqt n ALA 485 Cb 0.36 0.07 0.01 0.00 0.00 0.00 0.00 19.45 19.89 1nqt n ALA 485 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1nqt n ILE 486 N -1.49 -0.23 -0.02 0.00 2.08 -0.35 0.18 119.36 119.53 1nqt n ILE 486 Ca 0.00 0.96 -0.01 0.00 0.56 0.00 0.00 62.75 64.25 1nqt n ILE 486 Cb 0.00 -1.25 -0.01 0.00 -0.75 0.00 0.00 39.64 37.63 1nqt n ILE 486 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1nqt h GLU 487 N 0.00 -0.03 -0.44 0.38 4.81 -0.95 0.57 114.58 118.92 1nqt h GLU 487 Ca 0.13 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.44 1nqt h GLU 487 Cb 0.23 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.52 1nqt h GLU 487 CO -0.40 -0.02 -0.35 0.87 -0.73 0.00 0.00 179.01 178.37 1nqt h LYS 488 N -0.04 -0.25 -0.20 1.92 1.57 0.25 0.25 116.57 120.07 1nqt h LYS 488 Ca 0.01 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1nqt h LYS 488 Cb 0.06 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1nqt h LYS 488 CO -0.07 -0.16 0.17 0.28 -0.57 0.00 0.00 179.45 179.10 1nqt h VAL 489 N -0.26 0.71 0.34 0.50 2.07 -0.67 -2.52 116.25 116.43 1nqt h VAL 489 Ca 0.17 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.68 1nqt h VAL 489 Cb 0.55 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1nqt h VAL 489 CO -0.57 0.00 -0.17 0.15 0.02 0.00 0.00 177.57 177.00 1nqt h PHE 490 N 0.00 -0.43 -0.28 1.57 3.57 0.34 -3.20 116.94 118.52 1nqt h PHE 490 Ca 0.10 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.61 1nqt h PHE 490 Cb 0.44 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1nqt h PHE 490 CO 0.00 -0.27 -0.17 1.17 -2.23 0.00 0.00 178.31 176.82 1nqt n LYS 491 N -4.33 -0.12 -0.36 1.11 4.81 -0.31 0.37 118.16 119.31 1nqt n LYS 491 Ca -0.06 0.88 0.01 0.00 -0.87 0.00 0.00 58.31 58.27 1nqt n LYS 491 Cb 0.18 -1.31 0.07 0.00 0.02 0.00 0.00 35.03 33.99 1nqt n LYS 491 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 1nqt h VAL 492 N 0.00 0.02 0.10 3.15 -1.51 -1.65 0.72 116.25 117.08 1nqt h VAL 492 Ca 0.04 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.51 1nqt h VAL 492 Cb 0.11 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.29 1nqt h VAL 492 CO -0.26 0.00 -0.08 1.88 -1.23 0.00 0.00 177.57 177.88 1nqt h TYR 493 N -0.01 -0.21 -0.98 5.19 0.05 -0.07 -3.08 116.97 117.85 1nqt h TYR 493 Ca 0.37 -0.00 0.16 0.00 0.05 0.00 0.00 58.73 59.31 1nqt h TYR 493 Cb 0.63 0.08 -0.16 0.00 1.01 0.00 0.00 36.73 38.29 1nqt h TYR 493 CO -0.83 -0.11 -0.36 -1.71 -1.05 0.00 0.00 178.16 174.10 1nqt n ASN 494 N -2.71 -0.59 -0.53 3.88 4.05 0.11 -0.74 115.26 118.73 1nqt n ASN 494 Ca -0.02 1.70 0.00 0.00 0.45 0.00 0.00 54.58 56.71 1nqt n ASN 494 Cb 0.08 -0.41 0.00 0.00 1.23 0.00 0.00 39.78 40.68 1nqt n ASN 494 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 1nqt n GLU 495 N -5.46 0.19 0.22 1.20 4.07 0.23 -3.48 120.64 117.61 1nqt n GLU 495 Ca 0.11 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.21 1nqt n GLU 495 Cb 0.41 -1.11 0.00 0.00 -0.06 0.00 0.00 31.44 30.67 1nqt n GLU 495 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1nqt n ALA 496 N 0.43 0.79 0.00 4.31 0.00 0.08 -5.01 120.51 121.11 1nqt n ALA 496 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1nqt n ALA 496 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.71 0.56 0.00 0.00 0.00 -0.03 -3.86 105.19 101.15 1nqt n GLY 497 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 0.02 1.61 0.24 -1.26 -4.65 118.33 114.29 1nqt n VAL 498 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.12 1nqt n VAL 498 Cb 0.00 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.23 1nqt n VAL 498 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nqt h THR 499 N 0.00 1.55 -2.05 3.34 1.03 -2.03 -3.17 112.91 111.58 1nqt h THR 499 Ca 0.00 -2.39 -0.80 0.00 -0.01 0.00 0.00 66.41 63.21 1nqt h THR 499 Cb 0.00 3.11 -0.24 0.00 -1.07 0.00 0.00 68.15 69.95 1nqt h THR 499 CO 0.00 0.67 1.30 0.49 -0.01 0.00 0.00 175.52 177.96 1nqt n PHE 500 N -4.25 2.73 1.93 0.00 0.99 -1.26 -5.26 117.46 112.34 1nqt n PHE 500 Ca -0.12 -2.61 0.16 0.00 -0.00 0.00 0.00 57.45 54.87 1nqt n PHE 500 Cb 0.72 -1.32 0.89 0.00 -1.00 0.00 0.00 39.48 38.77 1nqt n PHE 500 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39