#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aco s ALA 3 N 0.00 3.05 -0.72 5.13 0.00 -1.26 -5.00 121.76 122.96 1aco s ALA 3 Ca 0.00 0.27 0.05 0.00 0.00 0.00 0.00 51.96 52.28 1aco s ALA 3 Cb 0.00 -3.13 0.19 0.00 0.00 0.00 0.00 23.12 20.18 1aco s ALA 3 CO 0.00 -0.10 0.59 1.63 0.00 0.00 0.00 175.76 177.88 1aco n LYS 4 N -1.22 2.10 -3.84 0.00 5.02 -1.26 -4.95 118.16 114.01 1aco n LYS 4 Ca 0.07 -4.54 -0.36 0.00 -2.02 0.00 0.00 58.31 51.46 1aco n LYS 4 Cb 0.54 -2.30 -0.13 0.00 -0.02 0.00 0.00 35.03 33.13 1aco n LYS 4 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1aco s VAL 5 N -1.72 4.10 0.49 -0.18 1.01 -1.26 -5.04 120.40 117.81 1aco s VAL 5 Ca 0.29 -0.25 -0.22 0.00 0.00 0.00 0.00 61.98 61.80 1aco s VAL 5 Cb 0.00 -2.90 -0.07 0.00 0.00 0.00 0.00 36.38 33.41 1aco s VAL 5 CO -0.13 0.37 1.17 0.00 0.00 0.00 0.00 175.10 176.51 1aco s ALA 6 N 1.45 2.88 0.43 5.51 0.00 -1.26 -0.89 121.76 129.88 1aco s ALA 6 Ca 0.05 0.93 0.22 0.00 0.00 0.00 0.00 51.96 53.16 1aco s ALA 6 Cb -0.15 -3.39 1.24 0.00 0.00 0.00 0.00 23.12 20.82 1aco s ALA 6 CO 0.02 -0.74 2.03 0.52 0.00 0.00 0.00 175.76 177.59 1aco h MET 7 N 1.76 0.00 -2.78 0.00 2.86 -0.74 -3.43 114.93 112.59 1aco h MET 7 Ca -0.50 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.22 1aco h MET 7 Cb 1.26 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.89 1aco h MET 7 CO 0.59 0.16 0.37 -1.54 1.06 0.00 0.00 176.91 177.55 1aco s SER 8 N -6.52 -0.07 0.22 1.22 1.04 -1.26 -4.80 113.70 103.53 1aco s SER 8 Ca -0.03 -0.82 0.24 0.00 0.48 0.00 0.00 55.95 55.82 1aco s SER 8 Cb 0.14 0.69 0.91 0.00 0.10 0.00 0.00 66.02 67.86 1aco s SER 8 CO 0.63 -1.34 1.74 1.41 0.98 0.00 0.00 173.24 176.66 1aco n HIS 9 N -0.55 0.81 0.82 5.02 -0.00 -1.26 -2.66 115.22 117.39 1aco n HIS 9 Ca -0.06 0.28 0.10 0.00 -0.00 0.00 0.00 57.72 58.05 1aco n HIS 9 Cb 0.60 -0.95 -0.07 0.00 -0.00 0.00 0.00 29.99 29.56 1aco n HIS 9 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1aco n PHE 10 N -2.20 0.03 -3.56 4.41 3.72 -1.26 -4.58 117.46 114.01 1aco n PHE 10 Ca 0.04 0.01 -0.27 0.00 -0.05 0.00 0.00 57.45 57.18 1aco n PHE 10 Cb 0.31 -0.14 -0.10 0.00 -0.94 0.00 0.00 39.48 38.61 1aco n PHE 10 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1aco n GLU 11 N -1.65 1.38 0.19 -1.08 1.02 -1.09 -4.96 120.64 114.45 1aco n GLU 11 Ca 0.03 -4.00 0.14 0.00 -0.02 0.00 0.00 57.16 53.31 1aco n GLU 11 Cb 0.37 -1.96 0.66 0.00 -0.02 0.00 0.00 31.44 30.49 1aco n GLU 11 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1aco h PRO 12 N 5.00 0.00 -0.02 3.49 0.13 -1.81 -1.49 132.00 137.31 1aco h PRO 12 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1aco h PRO 12 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1aco h PRO 12 CO 0.61 0.00 -0.13 -2.39 -0.23 0.00 0.00 178.00 175.86 1aco n HIS 13 N -2.50 0.00 -3.61 1.56 1.44 -1.26 -4.62 115.22 106.23 1aco n HIS 13 Ca -0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1aco n HIS 13 Cb 0.15 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.15 1aco n HIS 13 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1aco s GLU 14 N -1.54 2.93 0.05 -1.40 0.41 -0.56 -5.05 118.70 113.54 1aco s GLU 14 Ca 0.16 -1.01 -0.03 0.00 -0.41 0.00 0.00 54.97 53.68 1aco s GLU 14 Cb 0.13 -3.70 -0.04 0.00 -1.78 0.00 0.00 34.13 28.73 1aco s GLU 14 CO 0.28 -0.64 0.25 0.71 -0.49 0.00 0.00 175.26 175.36 1aco s TYR 15 N 1.57 3.53 0.24 1.61 2.02 -1.26 -0.18 117.35 124.87 1aco s TYR 15 Ca 0.03 0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 56.83 1aco s TYR 15 Cb -0.19 -1.87 -0.10 0.00 -0.40 0.00 0.00 41.96 39.40 1aco s TYR 15 CO 0.07 0.57 1.47 0.42 -1.57 0.00 0.00 175.55 176.51 1aco s ILE 16 N -1.46 2.63 -0.75 2.71 1.01 -0.07 -4.78 121.20 120.50 1aco s ILE 16 Ca 0.33 0.52 0.03 0.00 0.00 0.00 0.00 60.65 61.53 1aco s ILE 16 Cb -0.13 -3.33 0.30 0.00 0.01 0.00 0.00 42.46 39.32 1aco s ILE 16 CO 0.23 0.08 1.12 0.54 0.00 0.00 0.00 174.94 176.90 1aco n ARG 17 N 2.59 3.59 0.25 2.79 5.12 -1.26 -4.79 116.66 124.95 1aco n ARG 17 Ca 0.08 -4.73 0.12 0.00 -1.93 0.00 0.00 57.85 51.39 1aco n ARG 17 Cb 0.40 -2.33 0.60 0.00 -1.16 0.00 0.00 32.46 29.97 1aco n ARG 17 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1aco h TYR 18 N 3.95 0.00 -0.74 -1.55 0.05 -1.98 -1.95 116.97 114.75 1aco h TYR 18 Ca 0.23 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.97 1aco h TYR 18 Cb 0.54 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1aco h TYR 18 CO 0.91 0.16 0.30 0.38 -1.05 0.00 0.00 178.16 178.86 1aco h ASP 19 N 0.00 1.02 -0.17 3.88 2.03 -1.99 0.01 116.42 121.20 1aco h ASP 19 Ca -0.00 -0.17 -0.02 0.00 -0.73 0.00 0.00 57.03 56.10 1aco h ASP 19 Cb 0.56 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1aco h ASP 19 CO 0.02 0.91 0.01 0.25 -1.03 0.00 0.00 179.24 179.40 1aco h LEU 20 N 1.06 0.28 -0.50 0.15 7.12 -1.86 -1.40 115.31 120.17 1aco h LEU 20 Ca 0.25 -0.29 0.05 0.00 0.13 0.00 0.00 57.88 58.02 1aco h LEU 20 Cb 0.21 -0.07 -0.05 0.00 -0.53 0.00 0.00 40.66 40.22 1aco h LEU 20 CO -0.02 0.50 0.24 0.25 -0.13 0.00 0.00 178.44 179.27 1aco h LEU 21 N 0.05 0.32 -0.20 2.25 5.85 -0.90 -1.03 115.31 121.67 1aco h LEU 21 Ca 0.05 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1aco h LEU 21 Cb 0.35 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1aco h LEU 21 CO 0.01 0.22 0.11 -0.08 -0.34 0.00 0.00 178.44 178.36 1aco h GLU 22 N 0.46 0.27 -0.64 1.25 4.81 -0.94 0.13 114.58 119.93 1aco h GLU 22 Ca 0.22 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1aco h GLU 22 Cb 0.16 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.44 1aco h GLU 22 CO -0.17 0.26 0.37 -0.22 -0.73 0.00 0.00 179.01 178.52 1aco h LYS 23 N 0.21 0.68 -0.22 1.92 3.64 -1.04 -0.51 116.57 121.25 1aco h LYS 23 Ca 0.07 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.21 1aco h LYS 23 Cb 0.07 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1aco h LYS 23 CO -0.01 0.45 -0.64 -0.91 -2.27 0.00 0.00 179.45 176.07 1aco h ASN 24 N 0.70 0.92 -0.91 4.20 2.35 -0.80 -2.10 115.58 119.93 1aco h ASN 24 Ca 0.27 -0.54 0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1aco h ASN 24 Cb 0.11 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.16 1aco h ASN 24 CO -0.15 1.33 0.59 0.40 -1.65 0.00 0.00 177.43 177.95 1aco h ILE 25 N 0.59 1.16 -0.14 2.81 2.04 -0.55 -2.25 117.51 121.16 1aco h ILE 25 Ca -0.01 -0.40 -0.16 0.00 1.00 0.00 0.00 64.86 65.29 1aco h ILE 25 Cb 1.25 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1aco h ILE 25 CO 0.14 0.21 -0.59 0.44 0.00 0.00 0.00 178.15 178.34 1aco h ASP 26 N 1.16 0.54 -0.32 1.72 3.32 -1.03 0.53 116.42 122.34 1aco h ASP 26 Ca 0.36 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1aco h ASP 26 Cb -0.01 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1aco h ASP 26 CO -0.11 1.01 0.20 0.40 -1.72 0.00 0.00 179.24 179.01 1aco h ILE 27 N 0.36 1.10 -0.28 0.35 2.04 -0.88 -2.89 117.51 117.31 1aco h ILE 27 Ca -0.00 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 1aco h ILE 27 Cb 1.14 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1aco h ILE 27 CO 0.11 0.10 0.02 0.58 0.00 0.00 0.00 178.15 178.95 1aco h VAL 28 N 0.41 1.25 0.00 1.67 2.07 -1.29 -2.84 116.25 117.52 1aco h VAL 28 Ca 0.11 -0.87 -0.05 0.00 0.82 0.00 0.00 66.70 66.71 1aco h VAL 28 Cb -0.01 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1aco h VAL 28 CO -0.02 0.28 -0.25 0.08 0.02 0.00 0.00 177.57 177.68 1aco h ARG 29 N 0.27 0.00 0.00 1.57 0.11 -0.90 0.04 114.38 115.48 1aco h ARG 29 Ca 0.08 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.11 1aco h ARG 29 Cb 0.39 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1aco h ARG 29 CO 0.01 0.25 -0.26 0.87 0.10 0.00 0.00 179.97 180.94 1aco h LYS 30 N 0.00 0.00 0.23 0.08 6.56 -1.34 0.13 116.57 122.22 1aco h LYS 30 Ca -0.00 0.00 -0.31 0.00 -1.06 0.00 0.00 60.65 59.27 1aco h LYS 30 Cb 0.65 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.34 1aco h LYS 30 CO 0.03 0.26 -1.41 0.00 -2.06 0.00 0.00 179.45 176.27 1aco h ARG 31 N 0.00 0.48 0.00 3.15 3.08 -0.83 -3.39 114.38 116.87 1aco h ARG 31 Ca -0.00 -0.82 -0.21 0.00 0.07 0.00 0.00 59.98 59.01 1aco h ARG 31 Cb 0.55 0.31 -0.04 0.00 0.08 0.00 0.00 29.97 30.87 1aco h ARG 31 CO 0.03 1.39 -1.55 1.28 -1.07 0.00 0.00 179.97 180.05 1aco n LEU 32 N -3.78 0.81 -3.87 3.04 4.77 -0.22 -4.98 117.00 112.77 1aco n LEU 32 Ca -0.18 0.37 -0.28 0.00 -0.03 0.00 0.00 56.01 55.89 1aco n LEU 32 Cb 1.05 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 42.26 1aco n LEU 32 CO 0.57 0.23 -0.18 0.59 -1.33 0.00 0.00 177.39 177.27 1aco n ASN 33 N -2.91 -2.11 -3.55 -1.43 3.02 0.42 -4.98 115.26 103.71 1aco n ASN 33 Ca -0.13 -1.02 -0.11 0.00 -0.03 0.00 0.00 54.58 53.29 1aco n ASN 33 Cb 0.91 -3.11 -0.03 0.00 -0.61 0.00 0.00 39.78 36.94 1aco n ASN 33 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1aco s ARG 34 N -6.40 1.26 0.52 3.52 1.70 -1.26 -5.13 118.95 113.16 1aco s ARG 34 Ca 0.18 -0.63 -0.22 0.00 -0.47 0.00 0.00 55.73 54.59 1aco s ARG 34 Cb -0.07 0.55 -0.06 0.00 -0.57 0.00 0.00 34.95 34.80 1aco s ARG 34 CO 0.88 -0.54 1.31 -2.14 -1.08 0.00 0.00 175.30 173.73 1aco s PRO 35 N -3.79 3.33 -0.07 3.89 0.02 -1.26 -4.96 135.00 132.14 1aco s PRO 35 Ca 0.03 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.18 1aco s PRO 35 Cb -0.00 -2.31 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 1aco s PRO 35 CO -0.10 -1.01 -0.06 -0.51 -0.33 0.00 0.00 177.00 174.99 1aco s LEU 36 N -3.36 3.19 1.09 -5.54 1.43 -1.26 -4.58 118.68 109.64 1aco s LEU 36 Ca 0.69 -0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.63 1aco s LEU 36 Cb -0.37 -1.70 0.23 0.00 0.03 0.00 0.00 46.19 44.38 1aco s LEU 36 CO 0.45 0.36 1.10 0.42 0.23 0.00 0.00 176.35 178.90 1aco s THR 37 N -0.78 1.86 0.17 5.49 -4.23 -1.26 -1.76 115.64 115.13 1aco s THR 37 Ca 0.12 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.50 1aco s THR 37 Cb -0.11 -2.48 0.07 0.00 1.34 0.00 0.00 72.50 71.33 1aco s THR 37 CO 0.02 0.00 1.76 0.25 -0.54 0.00 0.00 174.62 176.10 1aco h LEU 38 N -2.19 0.76 -0.93 4.79 5.85 -1.91 -1.89 115.31 119.79 1aco h LEU 38 Ca -0.52 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.01 1aco h LEU 38 Cb 1.32 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1aco h LEU 38 CO 0.49 0.67 0.08 0.77 -0.34 0.00 0.00 178.44 180.12 1aco h SER 39 N 0.79 0.82 -0.50 1.25 4.64 -1.96 -1.91 113.55 116.69 1aco h SER 39 Ca 0.20 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.32 1aco h SER 39 Cb 0.11 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 1aco h SER 39 CO -0.03 0.84 0.21 -0.33 -0.87 0.00 0.00 176.83 176.65 1aco h GLU 40 N 0.82 0.74 -0.14 4.77 5.08 -1.88 0.13 114.58 124.10 1aco h GLU 40 Ca 0.17 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1aco h GLU 40 Cb 0.38 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1aco h GLU 40 CO 0.01 0.65 0.06 0.87 -1.00 0.00 0.00 179.01 179.60 1aco h LYS 41 N 0.67 0.14 -0.24 2.33 1.57 -0.79 0.26 116.57 120.51 1aco h LYS 41 Ca 0.17 -0.01 -0.17 0.00 -1.87 0.00 0.00 60.65 58.77 1aco h LYS 41 Cb 0.17 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1aco h LYS 41 CO -0.02 0.09 -0.51 0.82 -0.57 0.00 0.00 179.45 179.26 1aco h ILE 42 N 0.14 1.30 0.20 1.86 2.04 -1.21 0.81 117.51 122.64 1aco h ILE 42 Ca 0.06 -1.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.19 1aco h ILE 42 Cb 0.02 1.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1aco h ILE 42 CO -0.04 0.55 -0.10 0.58 0.00 0.00 0.00 178.15 179.14 1aco h VAL 43 N 0.51 0.85 0.00 1.67 2.07 -0.93 -2.73 116.25 117.68 1aco h VAL 43 Ca 0.00 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.56 1aco h VAL 43 Cb 1.12 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 1aco h VAL 43 CO 0.11 0.19 -0.21 1.88 0.02 0.00 0.00 177.57 179.56 1aco h TYR 44 N -0.77 0.00 0.00 1.57 0.05 -0.55 -0.72 116.97 116.55 1aco h TYR 44 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1aco h TYR 44 Cb 0.51 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.25 1aco h TYR 44 CO 0.06 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.79 1aco n GLY 45 N -0.52 -1.12 1.14 3.88 0.00 0.28 -1.94 105.19 106.90 1aco n GLY 45 Ca -0.02 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.18 1aco n GLY 45 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1aco n HIS 46 N -2.14 1.21 -2.16 1.61 8.25 -0.28 -4.47 115.22 117.24 1aco n HIS 46 Ca 0.01 -0.81 -0.39 0.00 -0.26 0.00 0.00 57.72 56.27 1aco n HIS 46 Cb 0.17 -0.34 -0.01 0.00 1.12 0.00 0.00 29.99 30.93 1aco n HIS 46 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1aco s LEU 47 N -2.67 4.21 0.22 2.41 1.43 -0.82 -1.24 118.68 122.22 1aco s LEU 47 Ca 0.44 2.52 -0.02 0.00 -1.03 0.00 0.00 54.13 56.04 1aco s LEU 47 Cb 0.35 -3.95 0.20 0.00 0.03 0.00 0.00 46.19 42.82 1aco s LEU 47 CO 0.12 -0.77 1.59 -0.78 0.23 0.00 0.00 176.35 176.74 1aco h ASP 48 N 2.68 0.65 -2.44 2.29 3.58 -1.38 -3.38 116.42 118.42 1aco h ASP 48 Ca -0.49 -0.28 -0.59 0.00 0.42 0.00 0.00 57.03 56.09 1aco h ASP 48 Cb 1.24 -0.18 -0.38 0.00 1.72 0.00 0.00 39.33 41.73 1aco h ASP 48 CO 0.63 0.96 -0.94 -0.62 -2.88 0.00 0.00 179.24 176.38 1aco s ASP 49 N -6.84 1.75 0.58 2.28 2.15 -1.26 -4.98 116.67 110.35 1aco s ASP 49 Ca -0.08 -3.07 0.31 0.00 0.43 0.00 0.00 52.55 50.14 1aco s ASP 49 Cb 0.12 -0.52 1.80 0.00 -0.30 0.00 0.00 42.92 44.02 1aco s ASP 49 CO 0.83 -0.17 2.22 1.55 -0.17 0.00 0.00 175.17 179.43 1aco h PRO 50 N 5.70 0.00 0.03 4.34 0.13 -1.91 -1.04 132.00 139.24 1aco h PRO 50 Ca 0.25 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.17 1aco h PRO 50 Cb 0.90 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 1aco h PRO 50 CO 0.39 0.03 -0.97 0.00 -0.23 0.00 0.00 178.00 177.22 1aco h ALA 51 N 1.97 0.41 0.00 -0.56 0.00 -1.93 -3.37 119.26 115.77 1aco h ALA 51 Ca -0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1aco h ALA 51 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1aco h ALA 51 CO 0.00 1.04 -0.73 0.09 0.00 0.00 0.00 179.25 179.66 1aco n ASN 52 N -3.53 1.53 -4.67 0.00 3.02 -0.99 -5.01 115.26 105.61 1aco n ASN 52 Ca -0.03 -0.40 -0.47 0.00 -0.03 0.00 0.00 54.58 53.65 1aco n ASN 52 Cb 0.88 1.13 -0.04 0.00 -0.61 0.00 0.00 39.78 41.14 1aco n ASN 52 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1aco n GLN 53 N -1.40 2.13 -2.52 3.52 -0.06 -0.43 -4.96 117.38 113.67 1aco n GLN 53 Ca 0.00 0.77 -0.42 0.00 -2.00 0.00 0.00 57.00 55.36 1aco n GLN 53 Cb 0.14 -2.55 -0.03 0.00 -4.06 0.00 0.00 30.24 23.73 1aco n GLN 53 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 1aco s GLU 54 N 1.56 4.53 -0.28 3.69 2.02 -1.26 -5.02 118.70 123.94 1aco s GLU 54 Ca 0.82 1.68 0.00 0.00 0.02 0.00 0.00 54.97 57.49 1aco s GLU 54 Cb -0.69 -3.34 0.08 0.00 0.10 0.00 0.00 34.13 30.28 1aco s GLU 54 CO 0.41 -0.08 0.04 0.42 0.02 0.00 0.00 175.26 176.07 1aco s ILE 55 N 0.51 1.28 -0.04 -1.63 1.01 -1.26 -4.76 121.20 116.31 1aco s ILE 55 Ca 0.53 -1.41 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 1aco s ILE 55 Cb -0.28 -1.81 0.03 0.00 0.01 0.00 0.00 42.46 40.41 1aco s ILE 55 CO 0.31 -0.44 0.03 -1.61 0.00 0.00 0.00 174.94 173.24 1aco s GLU 56 N 1.45 0.15 0.27 2.79 2.02 -1.26 -5.01 118.70 119.10 1aco s GLU 56 Ca 0.04 0.24 -0.30 0.00 0.02 0.00 0.00 54.97 54.97 1aco s GLU 56 Cb -0.18 -0.58 -0.11 0.00 0.10 0.00 0.00 34.13 33.36 1aco s GLU 56 CO -0.14 -0.27 1.63 1.03 0.02 0.00 0.00 175.26 177.52 1aco s ARG 57 N 1.79 4.12 0.00 1.61 0.52 -1.26 -1.16 118.95 124.57 1aco s ARG 57 Ca 0.01 2.58 0.00 0.00 -0.52 0.00 0.00 55.73 57.80 1aco s ARG 57 Cb -0.12 -3.04 0.00 0.00 0.52 0.00 0.00 34.95 32.31 1aco s ARG 57 CO -0.03 -0.66 0.00 0.41 0.02 0.00 0.00 175.30 175.03 1aco n GLY 58 N 2.64 0.63 0.00 -3.53 0.00 0.17 -4.83 105.19 100.27 1aco n GLY 58 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1aco n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aco n LYS 59 N -1.97 0.03 -3.66 1.61 5.02 -0.31 -4.91 118.16 113.99 1aco n LYS 59 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 1aco n LYS 59 Cb 0.03 -0.75 -0.02 0.00 -0.02 0.00 0.00 35.03 34.27 1aco n LYS 59 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1aco s THR 60 N -1.51 5.18 -0.24 -0.18 -4.23 -1.06 -4.88 115.64 108.72 1aco s THR 60 Ca 0.00 -0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 59.76 1aco s THR 60 Cb 0.00 -3.83 -0.05 0.00 1.34 0.00 0.00 72.50 69.96 1aco s THR 60 CO 0.00 -0.39 0.26 -0.31 -0.54 0.00 0.00 174.62 173.64 1aco s TYR 61 N -2.10 3.31 0.16 3.99 2.02 -1.26 -0.37 117.35 123.10 1aco s TYR 61 Ca 0.38 0.34 -0.18 0.00 -0.37 0.00 0.00 57.07 57.24 1aco s TYR 61 Cb -0.10 -2.40 -0.07 0.00 -0.40 0.00 0.00 41.96 38.99 1aco s TYR 61 CO 0.32 -0.02 0.63 -0.51 -1.57 0.00 0.00 175.55 174.40 1aco s LEU 62 N 1.36 4.40 -0.29 -1.29 1.43 0.42 -4.86 118.68 119.85 1aco s LEU 62 Ca 0.12 1.28 -0.08 0.00 -1.03 0.00 0.00 54.13 54.42 1aco s LEU 62 Cb -0.14 -3.29 -0.00 0.00 0.03 0.00 0.00 46.19 42.78 1aco s LEU 62 CO 0.07 0.13 0.10 -0.13 0.23 0.00 0.00 176.35 176.74 1aco s ARG 63 N -1.70 3.27 0.24 1.70 0.52 -1.26 -1.02 118.95 120.70 1aco s ARG 63 Ca 0.37 -0.74 0.11 0.00 -0.52 0.00 0.00 55.73 54.95 1aco s ARG 63 Cb -0.17 -3.41 -0.05 0.00 0.52 0.00 0.00 34.95 31.84 1aco s ARG 63 CO 0.20 -0.38 -0.21 -0.51 0.02 0.00 0.00 175.30 174.42 1aco s LEU 64 N 1.55 2.52 -0.50 2.53 1.43 0.10 -1.03 118.68 125.28 1aco s LEU 64 Ca 0.04 -0.96 0.02 0.00 -1.03 0.00 0.00 54.13 52.20 1aco s LEU 64 Cb -0.17 -1.08 0.13 0.00 0.03 0.00 0.00 46.19 45.10 1aco s LEU 64 CO 0.04 0.05 0.25 -0.13 0.23 0.00 0.00 176.35 176.78 1aco s ARG 65 N -3.18 1.99 0.74 1.70 1.81 -0.37 -1.51 118.95 120.14 1aco s ARG 65 Ca 0.25 -2.41 -0.15 0.00 -1.72 0.00 0.00 55.73 51.70 1aco s ARG 65 Cb -0.06 -3.39 0.05 0.00 -0.45 0.00 0.00 34.95 31.09 1aco s ARG 65 CO 0.12 -1.09 1.23 -2.14 -0.68 0.00 0.00 175.30 172.75 1aco s PRO 66 N 0.07 2.02 0.07 3.54 0.02 -1.26 -4.93 135.00 134.52 1aco s PRO 66 Ca 0.15 1.86 -0.02 0.00 0.02 0.00 0.00 61.00 63.01 1aco s PRO 66 Cb -0.23 -1.81 -0.27 0.00 0.02 0.00 0.00 34.50 32.21 1aco s PRO 66 CO -0.02 -1.95 1.10 -0.44 -0.33 0.00 0.00 177.00 175.35 1aco h ASP 67 N -0.33 0.34 -5.00 2.53 3.32 -1.16 -3.49 116.42 112.63 1aco h ASP 67 Ca -0.48 -0.39 0.02 0.00 0.02 0.00 0.00 57.03 56.20 1aco h ASP 67 Cb 1.31 -0.11 -0.09 0.00 0.22 0.00 0.00 39.33 40.66 1aco h ASP 67 CO 0.49 1.31 0.22 0.00 -1.72 0.00 0.00 179.24 179.54 1aco s ARG 68 N -2.66 1.51 -0.08 3.56 1.70 -1.23 -4.18 118.95 117.58 1aco s ARG 68 Ca -0.04 -0.71 0.04 0.00 -0.47 0.00 0.00 55.73 54.54 1aco s ARG 68 Cb 0.07 0.60 0.00 0.00 -0.57 0.00 0.00 34.95 35.06 1aco s ARG 68 CO 0.87 -0.68 -0.19 0.08 -1.08 0.00 0.00 175.30 174.29 1aco s VAL 69 N -3.82 1.69 -0.00 4.99 1.01 -0.18 -2.15 120.40 121.93 1aco s VAL 69 Ca 0.06 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1aco s VAL 69 Cb -0.03 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 1aco s VAL 69 CO -0.04 0.48 -0.24 0.00 0.00 0.00 0.00 175.10 175.30 1aco s ALA 70 N 0.38 1.99 0.03 5.51 0.00 -0.68 -1.60 121.76 127.39 1aco s ALA 70 Ca -0.15 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.79 1aco s ALA 70 Cb -0.16 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 1aco s ALA 70 CO 0.06 0.48 -0.12 -1.64 0.00 0.00 0.00 175.76 174.54 1aco s MET 71 N -0.74 0.81 0.24 0.00 -1.94 0.27 -1.71 119.30 116.23 1aco s MET 71 Ca 0.09 -0.69 0.08 0.00 -1.71 0.00 0.00 55.69 53.46 1aco s MET 71 Cb -0.09 -0.78 -0.04 0.00 2.01 0.00 0.00 34.83 35.93 1aco s MET 71 CO -0.00 0.19 0.11 1.14 -0.01 0.00 0.00 175.02 176.45 1aco s GLN 72 N -1.09 2.68 0.38 2.03 1.03 -1.26 -0.58 119.66 122.85 1aco s GLN 72 Ca -0.00 -1.15 0.28 0.00 0.04 0.00 0.00 55.36 54.53 1aco s GLN 72 Cb -0.08 -2.43 1.26 0.00 0.03 0.00 0.00 33.01 31.79 1aco s GLN 72 CO 0.01 0.40 1.83 0.38 -2.54 0.00 0.00 175.29 175.37 1aco h ASP 73 N 1.83 0.00 1.94 12.60 2.03 -1.20 0.16 116.42 133.79 1aco h ASP 73 Ca -0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.83 1aco h ASP 73 Cb 1.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.73 1aco h ASP 73 CO 0.61 0.00 -0.02 0.00 -1.03 0.00 0.00 179.24 178.80 1aco h ALA 74 N 2.12 0.99 0.00 4.15 0.00 -1.93 -3.33 119.26 121.27 1aco h ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aco h ALA 74 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1aco h ALA 74 CO 0.00 0.00 -0.91 0.25 0.00 0.00 0.00 179.25 178.59 1aco n THR 75 N -3.03 0.00 0.17 0.00 -2.24 -0.80 -4.63 114.28 103.75 1aco n THR 75 Ca 0.04 -0.24 0.02 0.00 -2.27 0.00 0.00 64.05 61.60 1aco n THR 75 Cb 0.52 0.62 0.32 0.00 -2.10 0.00 0.00 70.33 69.69 1aco n THR 75 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aco h ALA 76 N 0.84 1.31 -0.27 6.98 0.00 -0.81 -2.51 119.26 124.79 1aco h ALA 76 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1aco h ALA 76 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1aco h ALA 76 CO 0.00 0.52 0.13 1.96 0.00 0.00 0.00 179.25 181.86 1aco h GLN 77 N 0.00 0.39 0.01 0.00 4.20 -1.82 0.69 115.11 118.58 1aco h GLN 77 Ca -0.00 -0.06 -0.20 0.00 0.06 0.00 0.00 58.65 58.45 1aco h GLN 77 Cb 0.74 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1aco h GLN 77 CO 0.05 0.39 -0.93 1.98 -0.67 0.00 0.00 178.83 179.65 1aco h MET 78 N 0.30 0.08 -0.44 1.46 4.05 -1.72 -0.09 114.93 118.57 1aco h MET 78 Ca 0.09 -0.10 -0.02 0.00 -0.28 0.00 0.00 59.70 59.38 1aco h MET 78 Cb 0.12 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.94 1aco h MET 78 CO -0.01 0.95 0.18 0.00 0.23 0.00 0.00 176.91 178.25 1aco h ALA 79 N 1.01 0.57 -0.08 0.39 0.00 -1.27 -1.33 119.26 118.56 1aco h ALA 79 Ca -0.03 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 1aco h ALA 79 Cb 1.61 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1aco h ALA 79 CO 0.13 0.16 -0.63 0.52 0.00 0.00 0.00 179.25 179.43 1aco h MET 80 N 0.56 0.28 -0.45 0.00 2.86 -0.72 -0.82 114.93 116.65 1aco h MET 80 Ca 0.15 -0.20 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1aco h MET 80 Cb 0.18 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1aco h MET 80 CO -0.01 0.82 0.01 -0.07 1.06 0.00 0.00 176.91 178.72 1aco h LEU 81 N 0.21 0.70 -0.65 1.22 3.38 -0.85 0.11 115.31 119.43 1aco h LEU 81 Ca -0.01 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 1aco h LEU 81 Cb 1.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1aco h LEU 81 CO 0.10 0.76 -0.41 1.56 0.09 0.00 0.00 178.44 180.54 1aco h GLN 82 N 0.69 0.59 -0.54 1.13 4.20 -0.99 -2.03 115.11 118.16 1aco h GLN 82 Ca 0.14 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 1aco h GLN 82 Cb 0.41 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1aco h GLN 82 CO 0.02 0.89 0.17 0.35 -0.67 0.00 0.00 178.83 179.59 1aco h PHE 83 N 0.48 0.87 -0.69 2.96 3.57 -0.77 -2.32 116.94 121.03 1aco h PHE 83 Ca 0.04 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.47 1aco h PHE 83 Cb 0.92 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 1aco h PHE 83 CO 0.04 0.74 0.45 0.82 -2.23 0.00 0.00 178.31 178.13 1aco h ILE 84 N 0.74 1.13 -0.12 1.41 2.04 -0.72 -1.85 117.51 120.16 1aco h ILE 84 Ca 0.17 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1aco h ILE 84 Cb 0.28 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1aco h ILE 84 CO -0.01 0.16 0.08 0.28 0.00 0.00 0.00 178.15 178.67 1aco h SER 85 N 0.90 0.12 0.26 1.72 0.02 -0.93 -2.83 113.55 112.81 1aco h SER 85 Ca 0.27 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.17 1aco h SER 85 Cb -0.04 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1aco h SER 85 CO -0.08 0.09 -0.22 0.77 -1.14 0.00 0.00 176.83 176.24 1aco h SER 86 N 0.14 0.00 0.00 3.07 4.64 -0.81 -3.46 113.55 117.14 1aco h SER 86 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1aco h SER 86 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1aco h SER 86 CO -0.01 0.22 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 1aco n GLY 87 N -0.82 0.98 3.77 -0.77 0.00 -1.07 -4.95 105.19 102.33 1aco n GLY 87 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1aco n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aco s LEU 88 N 0.00 4.35 0.42 0.99 1.43 -1.26 -4.97 118.68 119.64 1aco s LEU 88 Ca 0.00 2.44 0.23 0.00 -1.03 0.00 0.00 54.13 55.77 1aco s LEU 88 Cb 0.00 -3.82 0.31 0.00 0.03 0.00 0.00 46.19 42.72 1aco s LEU 88 CO 0.00 -0.52 1.57 1.55 0.23 0.00 0.00 176.35 179.18 1aco h PRO 89 N 3.13 0.00 -2.13 1.29 0.13 -1.96 -3.47 132.00 128.99 1aco h PRO 89 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 1aco h PRO 89 Cb 1.23 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.18 1aco h PRO 89 CO 0.64 0.00 0.19 0.21 -0.23 0.00 0.00 178.00 178.82 1aco s LYS 90 N -3.22 1.09 0.44 0.86 2.47 -1.26 -4.59 119.74 115.52 1aco s LYS 90 Ca 0.06 0.17 -0.23 0.00 -1.56 0.00 0.00 55.97 54.41 1aco s LYS 90 Cb 0.05 0.51 -0.08 0.00 -1.46 0.00 0.00 37.83 36.85 1aco s LYS 90 CO 0.68 -0.36 1.10 0.14 0.16 0.00 0.00 175.35 177.07 1aco s VAL 91 N -1.52 3.43 -0.26 4.02 -7.23 -0.27 -4.86 120.40 113.71 1aco s VAL 91 Ca -0.09 1.06 0.22 0.00 -1.81 0.00 0.00 61.98 61.35 1aco s VAL 91 Cb -0.00 -3.53 0.06 0.00 0.56 0.00 0.00 36.38 33.47 1aco s VAL 91 CO 0.07 -0.03 1.15 0.00 -0.31 0.00 0.00 175.10 175.98 1aco h ALA 92 N 2.15 0.62 -2.20 1.32 0.00 -0.74 -3.48 119.26 116.93 1aco h ALA 92 Ca -0.49 -0.09 -0.40 0.00 0.00 0.00 0.00 54.91 53.93 1aco h ALA 92 Cb 1.23 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.90 1aco h ALA 92 CO 0.61 0.11 -0.71 0.14 0.00 0.00 0.00 179.25 179.39 1aco s VAL 93 N -3.28 1.43 0.07 0.00 -7.23 -1.26 -4.99 120.40 105.13 1aco s VAL 93 Ca 0.01 -2.12 -0.36 0.00 -1.81 0.00 0.00 61.98 57.70 1aco s VAL 93 Cb 0.08 -2.07 -0.15 0.00 0.56 0.00 0.00 36.38 34.80 1aco s VAL 93 CO 0.77 -0.57 1.49 -2.65 -0.31 0.00 0.00 175.10 173.83 1aco n PRO 94 N -0.35 1.57 -3.96 4.82 -0.02 -1.26 -4.83 135.00 130.97 1aco n PRO 94 Ca -0.08 0.57 -0.12 0.00 -2.02 0.00 0.00 63.50 61.85 1aco n PRO 94 Cb 0.61 -2.27 -0.13 0.00 -0.02 0.00 0.00 33.50 31.69 1aco n PRO 94 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1aco s SER 95 N 1.14 0.23 0.06 2.55 0.01 -1.26 -1.01 113.70 115.42 1aco s SER 95 Ca 0.84 -0.22 0.02 0.00 1.31 0.00 0.00 55.95 57.90 1aco s SER 95 Cb -0.85 0.03 -0.03 0.00 0.21 0.00 0.00 66.02 65.38 1aco s SER 95 CO 0.46 -0.11 -0.07 0.42 0.41 0.00 0.00 173.24 174.35 1aco s THR 96 N -0.61 0.60 -0.07 1.44 -4.23 -0.62 -1.68 115.64 110.47 1aco s THR 96 Ca -0.06 -1.42 0.03 0.00 -1.18 0.00 0.00 61.69 59.07 1aco s THR 96 Cb -0.04 -1.03 -0.02 0.00 1.34 0.00 0.00 72.50 72.74 1aco s THR 96 CO -0.00 -0.57 -0.16 -0.63 -0.54 0.00 0.00 174.62 172.71 1aco s ILE 97 N -2.26 2.89 -0.15 2.99 1.01 0.43 -0.57 121.20 125.54 1aco s ILE 97 Ca -0.01 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.89 1aco s ILE 97 Cb -0.04 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.31 1aco s ILE 97 CO -0.02 0.57 -0.19 -1.00 0.00 0.00 0.00 174.94 174.30 1aco s HIS 98 N -0.40 2.54 -0.94 3.97 3.76 0.26 -0.80 115.29 123.68 1aco s HIS 98 Ca 0.04 -1.36 -0.15 0.00 -0.15 0.00 0.00 55.06 53.44 1aco s HIS 98 Cb -0.12 -1.76 0.20 0.00 1.11 0.00 0.00 32.58 32.00 1aco s HIS 98 CO 0.02 -0.66 1.00 0.00 -0.85 0.00 0.00 174.74 174.25 1aco n ASP 100 N 4.75 1.83 -0.04 0.00 5.75 -1.26 -4.06 116.55 123.52 1aco n ASP 100 Ca 0.21 -0.14 0.11 0.00 -0.01 0.00 0.00 54.79 54.96 1aco n ASP 100 Cb 0.46 0.64 0.04 0.00 -1.03 0.00 0.00 41.12 41.24 1aco n ASP 100 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1aco n HIS 101 N -0.83 0.00 -1.00 2.11 8.25 -1.26 -1.43 115.22 121.07 1aco n HIS 101 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.54 1aco n HIS 101 Cb 0.00 -0.10 0.28 0.00 1.12 0.00 0.00 29.99 31.29 1aco n HIS 101 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1aco n LEU 102 N -1.39 4.14 -4.27 2.41 4.77 -1.26 -4.77 117.00 116.63 1aco n LEU 102 Ca 0.05 -3.03 -0.38 0.00 -0.03 0.00 0.00 56.01 52.63 1aco n LEU 102 Cb 0.34 -0.57 -0.12 0.00 -2.33 0.00 0.00 43.42 40.74 1aco n LEU 102 CO 0.39 0.68 -0.25 -0.63 -1.33 0.00 0.00 177.39 176.24 1aco s ILE 103 N -2.84 3.77 0.02 -0.08 1.01 -1.26 -4.91 121.20 116.91 1aco s ILE 103 Ca 0.44 -1.17 -0.30 0.00 0.00 0.00 0.00 60.65 59.62 1aco s ILE 103 Cb 0.35 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 1aco s ILE 103 CO 0.10 -0.20 1.05 -0.70 0.00 0.00 0.00 174.94 175.18 1aco s GLU 104 N 1.39 4.52 -0.09 2.79 2.12 -1.26 -3.95 118.70 124.22 1aco s GLU 104 Ca -0.01 1.53 -0.30 0.00 0.36 0.00 0.00 54.97 56.55 1aco s GLU 104 Cb -0.20 -3.42 -0.02 0.00 0.26 0.00 0.00 34.13 30.75 1aco s GLU 104 CO 0.03 -0.11 1.03 0.00 -0.54 0.00 0.00 175.26 175.67 1aco s ALA 105 N 1.02 3.40 0.14 6.30 0.00 0.14 -4.81 121.76 127.95 1aco s ALA 105 Ca 0.54 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1aco s ALA 105 Cb -0.24 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1aco s ALA 105 CO 0.28 -0.61 0.00 0.94 0.00 0.00 0.00 175.76 176.38 1aco n GLN 106 N 4.97 0.00 0.02 0.00 7.27 -1.26 -0.90 117.38 127.48 1aco n GLN 106 Ca 0.09 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.27 1aco n GLN 106 Cb 0.48 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.11 1aco n GLN 106 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1aco n LEU 107 N -2.88 0.56 0.00 1.69 4.32 -1.26 -4.99 117.00 114.44 1aco n LEU 107 Ca 0.00 -0.04 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 1aco n LEU 107 Cb 0.00 -0.07 0.00 0.00 -1.62 0.00 0.00 43.42 41.73 1aco n LEU 107 CO 0.00 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 176.82 1aco n GLY 108 N 1.35 2.08 0.00 -0.72 0.00 -1.26 -4.86 105.19 101.78 1aco n GLY 108 Ca 0.01 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1aco n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aco n GLY 109 N 1.94 0.00 0.31 -0.02 0.00 0.15 -1.49 105.19 106.08 1aco n GLY 109 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1aco n GLY 109 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1aco h GLU 110 N 0.00 0.87 -0.15 1.61 4.11 -1.92 -2.16 114.58 116.93 1aco h GLU 110 Ca 0.00 -0.18 -0.02 0.00 0.07 0.00 0.00 59.36 59.24 1aco h GLU 110 Cb 0.00 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1aco h GLU 110 CO 0.00 0.77 0.03 0.87 0.07 0.00 0.00 179.01 180.75 1aco h LYS 111 N 0.84 0.24 -0.14 1.06 1.57 -1.85 -1.55 116.57 116.73 1aco h LYS 111 Ca 0.18 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1aco h LYS 111 Cb 0.29 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1aco h LYS 111 CO -0.00 0.42 -0.16 -0.44 -0.57 0.00 0.00 179.45 178.69 1aco h ASP 112 N 0.03 0.21 -0.25 0.86 3.32 -1.09 -2.28 116.42 117.22 1aco h ASP 112 Ca 0.04 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1aco h ASP 112 Cb 0.29 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 1aco h ASP 112 CO 0.00 0.39 -0.36 0.25 -1.72 0.00 0.00 179.24 177.80 1aco h LEU 113 N 0.21 0.75 -0.47 1.55 5.85 -1.22 -0.17 115.31 121.81 1aco h LEU 113 Ca 0.04 -0.51 -0.00 0.00 0.84 0.00 0.00 57.88 58.24 1aco h LEU 113 Cb 0.42 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1aco h LEU 113 CO 0.03 1.12 0.28 0.03 -0.34 0.00 0.00 178.44 179.56 1aco h ARG 114 N 0.41 0.64 -0.50 1.25 3.08 -1.09 -1.79 114.38 116.38 1aco h ARG 114 Ca 0.03 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1aco h ARG 114 Cb 0.95 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 1aco h ARG 114 CO 0.08 0.47 0.25 -0.09 -1.07 0.00 0.00 179.97 179.61 1aco h ARG 115 N 0.63 0.72 -0.68 0.04 2.43 -1.38 -2.58 114.38 113.55 1aco h ARG 115 Ca 0.17 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1aco h ARG 115 Cb -0.00 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 1aco h ARG 115 CO -0.03 0.59 0.34 0.00 -1.51 0.00 0.00 179.97 179.36 1aco h ALA 116 N 1.09 1.31 0.00 2.80 0.00 -0.76 -0.97 119.26 122.72 1aco h ALA 116 Ca 0.17 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1aco h ALA 116 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1aco h ALA 116 CO -0.02 0.54 -0.34 0.87 0.00 0.00 0.00 179.25 180.30 1aco h LYS 117 N 0.96 0.00 0.16 0.00 1.57 -1.14 0.20 116.57 118.33 1aco h LYS 117 Ca 0.24 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1aco h LYS 117 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1aco h LYS 117 CO -0.03 0.34 -0.08 0.22 -0.57 0.00 0.00 179.45 179.33 1aco h ASP 118 N 0.00 -0.19 -0.89 0.86 3.58 -1.05 -3.01 116.42 115.72 1aco h ASP 118 Ca -0.00 -0.13 0.16 0.00 0.42 0.00 0.00 57.03 57.48 1aco h ASP 118 Cb 0.62 0.05 -0.10 0.00 1.72 0.00 0.00 39.33 41.62 1aco h ASP 118 CO 0.04 0.34 0.48 0.40 -2.88 0.00 0.00 179.24 177.62 1aco h ILE 119 N -1.03 0.71 -0.45 2.25 2.04 -1.15 -2.64 117.51 117.23 1aco h ILE 119 Ca -0.02 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1aco h ILE 119 Cb 0.30 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 1aco h ILE 119 CO 0.04 0.12 0.00 0.59 0.00 0.00 0.00 178.15 178.89 1aco n ASN 120 N -4.86 4.29 -0.30 1.72 3.02 0.69 -4.67 115.26 115.14 1aco n ASN 120 Ca 0.19 -2.63 0.14 0.00 -0.03 0.00 0.00 54.58 52.25 1aco n ASN 120 Cb 0.48 -0.52 0.30 0.00 -0.61 0.00 0.00 39.78 39.44 1aco n ASN 120 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 1aco h GLN 121 N 2.94 0.26 -0.50 3.52 -0.00 -1.32 -1.17 115.11 118.83 1aco h GLN 121 Ca 0.00 -0.02 0.02 0.00 -0.00 0.00 0.00 58.65 58.66 1aco h GLN 121 Cb 1.40 -0.06 -0.03 0.00 0.00 0.00 0.00 27.48 28.79 1aco h GLN 121 CO 0.23 0.17 0.30 1.49 0.00 0.00 0.00 178.83 181.01 1aco h GLU 122 N 0.27 0.57 -0.05 1.69 4.81 -1.85 -0.90 114.58 119.12 1aco h GLU 122 Ca 0.56 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.66 1aco h GLU 122 Cb 1.13 -0.13 0.01 0.00 0.63 0.00 0.00 28.75 30.39 1aco h GLU 122 CO -0.61 0.38 -0.35 0.28 -0.73 0.00 0.00 179.01 177.97 1aco h VAL 123 N 0.59 1.45 -0.31 0.32 2.07 -1.65 -1.45 116.25 117.27 1aco h VAL 123 Ca 0.20 -1.82 -0.05 0.00 0.82 0.00 0.00 66.70 65.86 1aco h VAL 123 Cb 0.02 2.44 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1aco h VAL 123 CO -0.09 0.52 -0.02 1.88 0.02 0.00 0.00 177.57 179.88 1aco h TYR 124 N -0.21 0.50 -0.44 1.57 0.05 -1.18 -0.68 116.97 116.57 1aco h TYR 124 Ca -0.03 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.68 1aco h TYR 124 Cb 1.03 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.60 1aco h TYR 124 CO 0.14 0.50 0.21 -0.97 -1.05 0.00 0.00 178.16 176.99 1aco h ASN 125 N 0.46 0.59 0.04 3.88 -1.24 -1.15 -0.74 115.58 117.41 1aco h ASN 125 Ca 0.10 -0.14 -0.00 0.00 0.71 0.00 0.00 56.30 56.97 1aco h ASN 125 Cb 0.33 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.23 1aco h ASN 125 CO 0.01 0.56 -0.02 0.15 -1.29 0.00 0.00 177.43 176.85 1aco h PHE 126 N 0.58 -0.04 -0.62 0.67 3.57 -0.47 -1.74 116.94 118.88 1aco h PHE 126 Ca 0.15 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.55 1aco h PHE 126 Cb 0.14 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1aco h PHE 126 CO -0.01 0.09 0.02 -0.07 -2.23 0.00 0.00 178.31 176.11 1aco h LEU 127 N -0.17 1.06 -0.76 0.59 3.38 -1.04 0.25 115.31 118.62 1aco h LEU 127 Ca -0.00 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 1aco h LEU 127 Cb 0.15 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1aco h LEU 127 CO 0.01 1.10 0.31 0.00 0.09 0.00 0.00 178.44 179.95 1aco h ALA 128 N 1.00 0.99 -0.23 1.53 0.00 -1.11 0.66 119.26 122.10 1aco h ALA 128 Ca 0.18 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1aco h ALA 128 Cb 0.55 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1aco h ALA 128 CO 0.03 0.61 -0.57 1.15 0.00 0.00 0.00 179.25 180.47 1aco h THR 129 N 1.10 1.29 -0.35 0.00 2.02 -1.03 -0.48 112.91 115.46 1aco h THR 129 Ca 0.25 -1.77 -0.10 0.00 0.77 0.00 0.00 66.41 65.56 1aco h THR 129 Cb 0.21 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 1aco h THR 129 CO -0.02 0.57 -0.19 0.00 0.37 0.00 0.00 175.52 176.24 1aco h ALA 130 N 0.62 1.01 -0.19 6.16 0.00 -0.89 -1.38 119.26 124.59 1aco h ALA 130 Ca -0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1aco h ALA 130 Cb 1.18 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1aco h ALA 130 CO 0.12 0.59 0.10 0.78 0.00 0.00 0.00 179.25 180.84 1aco h GLY 131 N 0.99 0.28 1.27 0.00 0.00 -0.58 -1.34 103.07 103.69 1aco h GLY 131 Ca 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1aco h GLY 131 CO 0.05 0.12 0.26 0.00 0.00 0.00 0.00 176.54 176.98 1aco h ALA 132 N 0.98 1.26 -0.11 3.60 0.00 -0.93 0.22 119.26 124.27 1aco h ALA 132 Ca 0.06 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1aco h ALA 132 Cb 0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1aco h ALA 132 CO -0.01 0.55 -0.18 -0.22 0.00 0.00 0.00 179.25 179.39 1aco h LYS 133 N 0.92 0.32 -0.10 0.00 3.64 -1.03 -3.32 116.57 117.00 1aco h LYS 133 Ca 0.22 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1aco h LYS 133 Cb 0.17 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1aco h LYS 133 CO -0.02 0.77 0.00 0.66 -2.27 0.00 0.00 179.45 178.59 1aco n TYR 134 N -4.55 0.11 -2.01 1.91 4.01 -0.52 -4.86 117.16 111.25 1aco n TYR 134 Ca -0.07 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1aco n TYR 134 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1aco n TYR 134 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aco n GLY 135 N 1.29 0.64 3.41 2.72 0.00 -0.44 -1.12 105.19 111.69 1aco n GLY 135 Ca 0.17 -0.51 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1aco n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aco s VAL 136 N -2.87 3.11 0.47 1.61 1.01 0.63 -4.73 120.40 119.63 1aco s VAL 136 Ca 0.00 -0.65 -0.23 0.00 0.00 0.00 0.00 61.98 61.10 1aco s VAL 136 Cb 0.00 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 1aco s VAL 136 CO 0.00 0.54 1.17 -0.83 0.00 0.00 0.00 175.10 175.98 1aco s GLY 137 N 0.08 2.77 -0.13 4.51 0.00 -0.67 -4.33 107.32 109.55 1aco s GLY 137 Ca -0.05 0.93 0.01 0.00 0.00 0.00 0.00 44.72 45.61 1aco s GLY 137 CO 0.04 1.38 -0.15 -0.12 0.00 0.00 0.00 173.10 174.25 1aco s PHE 138 N -1.56 2.13 -0.28 1.90 5.36 -0.72 -0.43 117.98 124.38 1aco s PHE 138 Ca 0.64 -1.11 -0.09 0.00 -0.96 0.00 0.00 56.93 55.41 1aco s PHE 138 Cb -0.28 -1.54 -0.03 0.00 -0.34 0.00 0.00 43.02 40.82 1aco s PHE 138 CO 0.34 -0.59 0.14 -1.58 -1.46 0.00 0.00 175.22 172.07 1aco s TRP 139 N 1.24 3.16 0.76 10.12 0.52 0.02 -0.05 118.94 134.72 1aco s TRP 139 Ca -0.01 -0.27 -0.13 0.00 0.02 0.00 0.00 56.10 55.72 1aco s TRP 139 Cb -0.14 -2.33 0.06 0.00 -1.15 0.00 0.00 33.47 29.91 1aco s TRP 139 CO -0.06 -0.32 1.16 1.03 0.02 0.00 0.00 176.95 178.78 1aco s ARG 140 N 1.67 2.05 0.17 4.98 0.52 -0.21 -2.39 118.95 125.74 1aco s ARG 140 Ca 0.06 1.56 -0.33 0.00 -0.52 0.00 0.00 55.73 56.50 1aco s ARG 140 Cb -0.16 -1.84 -0.15 0.00 0.52 0.00 0.00 34.95 33.32 1aco s ARG 140 CO 0.07 -1.86 1.31 -0.35 0.02 0.00 0.00 175.30 174.49 1aco n PRO 141 N -3.09 1.51 0.00 3.54 -0.04 -1.26 -1.35 135.00 134.31 1aco n PRO 141 Ca 0.12 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1aco n PRO 141 Cb 0.51 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1aco n PRO 141 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1aco n GLY 142 N 2.31 2.97 0.32 0.55 0.00 -1.26 -4.96 105.19 105.14 1aco n GLY 142 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 1aco n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1aco h SER 143 N 0.14 0.91 -3.27 1.61 4.64 -1.47 -3.39 113.55 112.73 1aco h SER 143 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1aco h SER 143 Cb 0.00 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1aco h SER 143 CO 0.00 0.63 0.00 0.61 -0.87 0.00 0.00 176.83 177.20 1aco n GLY 144 N -1.33 2.35 3.75 -0.77 0.00 -1.23 -1.32 105.19 106.64 1aco n GLY 144 Ca 0.10 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 1aco n GLY 144 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aco s ILE 145 N -1.77 3.53 0.28 -0.61 1.01 0.56 -4.54 121.20 119.66 1aco s ILE 145 Ca 0.00 1.44 -0.02 0.00 0.00 0.00 0.00 60.65 62.06 1aco s ILE 145 Cb 0.00 -3.92 0.37 0.00 0.01 0.00 0.00 42.46 38.92 1aco s ILE 145 CO 0.00 0.30 1.60 -0.29 0.00 0.00 0.00 174.94 176.55 1aco h ILE 146 N 3.35 0.15 0.00 2.92 2.10 -1.91 -2.03 117.51 122.09 1aco h ILE 146 Ca -0.46 -0.02 -0.07 0.00 1.08 0.00 0.00 64.86 65.40 1aco h ILE 146 Cb 1.21 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 37.02 1aco h ILE 146 CO 0.70 0.01 -0.31 0.45 -1.08 0.00 0.00 178.15 177.91 1aco h HIS 147 N 0.05 0.00 0.10 2.19 3.86 -1.93 -0.75 115.15 118.68 1aco h HIS 147 Ca 0.52 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.47 1aco h HIS 147 Cb 0.99 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.49 1aco h HIS 147 CO -0.49 0.31 -1.06 0.37 0.86 0.00 0.00 177.93 177.93 1aco h GLN 148 N 0.00 0.54 -0.75 2.45 5.75 -1.66 -1.47 115.11 119.97 1aco h GLN 148 Ca -0.00 -0.72 -0.03 0.00 -0.15 0.00 0.00 58.65 57.76 1aco h GLN 148 Cb 1.16 0.24 -0.03 0.00 1.07 0.00 0.00 27.48 29.91 1aco h GLN 148 CO 0.04 1.31 0.37 0.82 -2.65 0.00 0.00 178.83 178.72 1aco h ILE 149 N 0.11 1.24 -0.27 2.39 1.08 -1.23 -1.21 117.51 119.62 1aco h ILE 149 Ca -0.16 -0.67 -0.03 0.00 -0.39 0.00 0.00 64.86 63.62 1aco h ILE 149 Cb 1.76 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 35.80 1aco h ILE 149 CO 0.20 0.28 0.07 0.40 -0.69 0.00 0.00 178.15 178.41 1aco h ILE 150 N 1.05 1.21 -0.58 -0.67 2.04 -1.11 -1.30 117.51 118.15 1aco h ILE 150 Ca 0.26 -0.69 -0.06 0.00 1.00 0.00 0.00 64.86 65.37 1aco h ILE 150 Cb 0.11 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1aco h ILE 150 CO -0.03 0.22 0.11 0.25 0.00 0.00 0.00 178.15 178.71 1aco h LEU 151 N 0.26 0.87 -1.13 1.44 5.85 -0.94 0.16 115.31 121.82 1aco h LEU 151 Ca 0.08 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1aco h LEU 151 Cb 0.28 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 1aco h LEU 151 CO 0.00 0.87 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.50 1aco h GLU 152 N 0.88 0.00 0.00 1.25 5.08 -1.15 -3.40 114.58 117.24 1aco h GLU 152 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1aco h GLU 152 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1aco h GLU 152 CO 0.00 0.14 -0.33 0.09 -1.00 0.00 0.00 179.01 177.92 1aco n ASN 153 N -3.27 1.64 0.00 1.42 3.02 -0.50 -4.94 115.26 112.63 1aco n ASN 153 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1aco n ASN 153 Cb 0.40 0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.81 1aco n ASN 153 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1aco n TYR 154 N -0.77 0.00 -2.73 3.10 4.01 0.44 -4.57 117.16 116.64 1aco n TYR 154 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 1aco n TYR 154 Cb 0.09 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 1aco n TYR 154 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1aco s ALA 155 N -1.74 3.31 0.14 -0.72 0.00 -0.45 -4.98 121.76 117.32 1aco s ALA 155 Ca 0.00 0.62 -0.10 0.00 0.00 0.00 0.00 51.96 52.47 1aco s ALA 155 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.88 1aco s ALA 155 CO 0.00 0.12 0.28 1.52 0.00 0.00 0.00 175.76 177.68 1aco s TYR 156 N -0.77 0.21 0.20 0.00 -0.85 -1.26 -4.94 117.35 109.93 1aco s TYR 156 Ca 0.43 -0.59 -0.33 0.00 -0.52 0.00 0.00 57.07 56.06 1aco s TYR 156 Cb -0.25 0.01 -0.13 0.00 0.38 0.00 0.00 41.96 41.96 1aco s TYR 156 CO 0.32 -0.67 1.56 -2.30 -1.52 0.00 0.00 175.55 172.94 1aco n PRO 157 N -0.17 2.26 -0.51 -3.49 -0.02 -0.76 -2.42 135.00 129.88 1aco n PRO 157 Ca -0.11 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1aco n PRO 157 Cb 0.63 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1aco n PRO 157 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aco n GLY 158 N 3.08 1.28 3.77 -1.23 0.00 -0.33 -4.87 105.19 106.90 1aco n GLY 158 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1aco n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aco s VAL 159 N -3.25 3.17 -0.28 1.61 0.11 -1.02 -4.83 120.40 115.91 1aco s VAL 159 Ca 0.00 0.73 0.00 0.00 -2.93 0.00 0.00 61.98 59.78 1aco s VAL 159 Cb 0.00 -3.29 0.05 0.00 -1.53 0.00 0.00 36.38 31.61 1aco s VAL 159 CO 0.00 -0.16 -0.05 -0.22 -3.33 0.00 0.00 175.10 171.34 1aco s LEU 160 N -3.80 3.65 -0.04 2.54 2.96 -1.26 -0.80 118.68 121.93 1aco s LEU 160 Ca 0.73 -1.28 0.06 0.00 -0.22 0.00 0.00 54.13 53.41 1aco s LEU 160 Cb -0.24 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 1aco s LEU 160 CO 0.27 -0.22 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.63 1aco s LEU 161 N 1.20 2.03 0.07 -0.68 0.20 -0.03 -0.45 118.68 121.03 1aco s LEU 161 Ca -0.06 -0.45 0.06 0.00 0.69 0.00 0.00 54.13 54.37 1aco s LEU 161 Cb -0.20 -1.24 -0.04 0.00 -0.43 0.00 0.00 46.19 44.28 1aco s LEU 161 CO -0.03 0.24 -0.12 0.27 -0.29 0.00 0.00 176.35 176.42 1aco s ILE 162 N -0.26 3.21 0.01 6.68 -4.36 -0.91 -1.09 121.20 124.48 1aco s ILE 162 Ca 0.01 -1.16 0.01 0.00 -0.26 0.00 0.00 60.65 59.24 1aco s ILE 162 Cb -0.12 -2.44 -0.01 0.00 1.25 0.00 0.00 42.46 41.15 1aco s ILE 162 CO 0.02 0.23 -0.03 -0.83 0.24 0.00 0.00 174.94 174.57 1aco s GLY 163 N -1.82 0.18 -1.43 6.27 0.00 -0.55 -1.69 107.32 108.28 1aco s GLY 163 Ca 0.18 -0.30 -0.11 0.00 0.00 0.00 0.00 44.72 44.49 1aco s GLY 163 CO 0.10 -0.32 2.32 -1.30 0.00 0.00 0.00 173.10 173.90 1aco n THR 164 N 2.46 4.09 -3.64 0.90 -2.24 -0.69 -1.52 114.28 113.64 1aco n THR 164 Ca -0.17 -3.43 -0.03 0.00 -2.27 0.00 0.00 64.05 58.15 1aco n THR 164 Cb 0.58 -2.48 -0.07 0.00 -2.10 0.00 0.00 70.33 66.26 1aco n THR 164 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1aco s ASP 165 N 2.02 -0.51 0.41 3.42 2.15 -1.25 -4.53 116.67 118.39 1aco s ASP 165 Ca 0.51 0.83 0.29 0.00 0.43 0.00 0.00 52.55 54.60 1aco s ASP 165 Cb 0.14 1.17 1.38 0.00 -0.30 0.00 0.00 42.92 45.31 1aco s ASP 165 CO -0.06 -0.13 1.87 0.77 -0.17 0.00 0.00 175.17 177.45 1aco h SER 166 N 5.86 0.00 -0.52 -0.34 4.64 -1.88 -2.69 113.55 118.62 1aco h SER 166 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1aco h SER 166 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1aco h SER 166 CO 0.19 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.56 1aco n HIS 167 N -2.56 1.05 0.03 4.77 8.25 -1.26 -4.50 115.22 121.00 1aco n HIS 167 Ca -0.00 -0.44 0.20 0.00 -0.26 0.00 0.00 57.72 57.22 1aco n HIS 167 Cb 0.16 -0.15 0.72 0.00 1.12 0.00 0.00 29.99 31.84 1aco n HIS 167 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1aco h THR 168 N 3.21 0.63 0.00 1.59 2.02 -1.79 -2.24 112.91 116.32 1aco h THR 168 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1aco h THR 168 Cb 1.06 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 1aco h THR 168 CO 0.13 0.00 0.50 -0.65 0.37 0.00 0.00 175.52 175.88 1aco h PRO 169 N 0.00 0.00 -0.99 6.66 0.11 -1.75 -2.57 132.00 133.46 1aco h PRO 169 Ca 0.23 0.00 0.20 0.00 0.11 0.00 0.00 66.00 66.54 1aco h PRO 169 Cb 1.00 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.00 1aco h PRO 169 CO -0.00 0.00 0.59 -0.97 -0.21 0.00 0.00 178.00 177.40 1aco h ASN 170 N 0.00 0.73 0.18 -2.05 -1.24 -1.61 -0.29 115.58 111.30 1aco h ASN 170 Ca 0.00 0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.12 1aco h ASN 170 Cb 1.01 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.04 1aco h ASN 170 CO 0.00 0.23 0.00 0.61 -1.29 0.00 0.00 177.43 176.98 1aco n GLY 171 N -1.32 -0.69 0.25 1.57 0.00 -0.97 -1.95 105.19 102.08 1aco n GLY 171 Ca 0.24 -0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.42 1aco n GLY 171 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aco h GLY 172 N 0.88 0.00 2.00 -0.02 0.00 -1.17 -2.11 103.07 102.65 1aco h GLY 172 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1aco h GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1aco n GLY 173 N -0.49 -1.22 0.98 4.60 0.00 -0.82 -1.90 105.19 106.34 1aco n GLY 173 Ca -0.00 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1aco n GLY 173 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1aco n LEU 174 N -2.16 3.76 -0.22 0.99 7.94 -0.80 -4.55 117.00 121.97 1aco n LEU 174 Ca 0.02 -3.71 -0.03 0.00 -1.11 0.00 0.00 56.01 51.19 1aco n LEU 174 Cb 0.21 -0.60 -0.01 0.00 0.53 0.00 0.00 43.42 43.55 1aco n LEU 174 CO 0.18 1.21 -0.03 0.61 -1.11 0.00 0.00 177.39 178.26 1aco n GLY 175 N -1.09 0.60 3.86 -3.96 0.00 -0.80 -1.83 105.19 101.98 1aco n GLY 175 Ca 0.29 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 1aco n GLY 175 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aco s GLY 176 N -2.64 1.79 -0.33 -0.02 0.00 -1.23 -1.19 107.32 103.71 1aco s GLY 176 Ca 0.00 -1.66 -0.12 0.00 0.00 0.00 0.00 44.72 42.94 1aco s GLY 176 CO 0.00 -1.57 0.21 -0.42 0.00 0.00 0.00 173.10 171.32 1aco s ILE 177 N -2.31 5.13 -0.14 0.90 -1.09 0.02 -3.97 121.20 119.74 1aco s ILE 177 Ca 0.42 -0.23 -0.01 0.00 -2.23 0.00 0.00 60.65 58.60 1aco s ILE 177 Cb -0.06 -3.61 0.04 0.00 -1.58 0.00 0.00 42.46 37.25 1aco s ILE 177 CO 0.27 0.03 -0.03 0.00 -1.23 0.00 0.00 174.94 173.98 1aco s ILE 179 N 1.76 1.38 0.12 0.00 1.01 -0.25 -2.82 121.20 122.41 1aco s ILE 179 Ca 0.02 -0.65 -0.31 0.00 0.00 0.00 0.00 60.65 59.72 1aco s ILE 179 Cb -0.14 -1.22 -0.08 0.00 0.01 0.00 0.00 42.46 41.02 1aco s ILE 179 CO -0.07 0.41 1.39 -0.83 0.00 0.00 0.00 174.94 175.83 1aco s GLY 180 N 0.41 2.01 0.14 6.18 0.00 -1.26 -1.48 107.32 113.31 1aco s GLY 180 Ca -0.12 1.12 -0.02 0.00 0.00 0.00 0.00 44.72 45.70 1aco s GLY 180 CO 0.04 2.33 0.09 -1.34 0.00 0.00 0.00 173.10 174.22 1aco s VAL 181 N 1.01 0.09 0.62 1.40 -7.23 -0.58 -4.92 120.40 110.79 1aco s VAL 181 Ca 0.64 -1.85 -0.10 0.00 -1.81 0.00 0.00 61.98 58.86 1aco s VAL 181 Cb -0.37 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.48 1aco s VAL 181 CO 0.31 -0.40 1.00 -0.83 -0.31 0.00 0.00 175.10 174.88 1aco s GLY 182 N -3.05 1.63 0.34 2.32 0.00 -1.26 -3.80 107.32 103.50 1aco s GLY 182 Ca 0.25 -0.22 0.07 0.00 0.00 0.00 0.00 44.72 44.81 1aco s GLY 182 CO 0.03 0.05 1.87 -1.33 0.00 0.00 0.00 173.10 173.72 1aco h GLY 183 N -0.30 1.29 2.00 0.20 0.00 -1.88 -1.95 103.07 102.42 1aco h GLY 183 Ca -0.45 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 46.50 1aco h GLY 183 CO 0.62 0.12 -0.24 0.00 0.00 0.00 0.00 176.54 177.05 1aco h ALA 184 N 1.58 1.58 -0.42 3.60 0.00 -1.92 -1.99 119.26 121.69 1aco h ALA 184 Ca 0.45 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 1aco h ALA 184 Cb 0.61 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1aco h ALA 184 CO -0.21 0.30 -0.29 -0.44 0.00 0.00 0.00 179.25 178.61 1aco h ASP 185 N 0.00 0.99 -0.69 0.00 5.19 -1.74 -2.67 116.42 117.50 1aco h ASP 185 Ca -0.00 -0.43 -0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1aco h ASP 185 Cb 0.43 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 39.63 1aco h ASP 185 CO 0.03 1.21 0.43 0.00 -3.12 0.00 0.00 179.24 177.78 1aco h ALA 186 N 0.81 1.43 -0.63 3.45 0.00 -1.34 -2.58 119.26 120.41 1aco h ALA 186 Ca 0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1aco h ALA 186 Cb 0.88 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1aco h ALA 186 CO 0.08 0.49 0.24 0.28 0.00 0.00 0.00 179.25 180.35 1aco h VAL 187 N 0.96 1.24 -0.33 0.00 2.07 -1.18 -0.30 116.25 118.71 1aco h VAL 187 Ca 0.25 -0.74 0.07 0.00 0.82 0.00 0.00 66.70 67.10 1aco h VAL 187 Cb -0.05 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 30.20 1aco h VAL 187 CO -0.05 0.29 -0.19 0.44 0.02 0.00 0.00 177.57 178.08 1aco h ASP 188 N 0.88 -0.64 -0.31 0.57 3.32 -1.12 0.14 116.42 119.26 1aco h ASP 188 Ca 0.21 0.14 -0.14 0.00 0.02 0.00 0.00 57.03 57.26 1aco h ASP 188 Cb 0.22 0.33 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 1aco h ASP 188 CO -0.02 -0.23 -0.34 0.58 -1.72 0.00 0.00 179.24 177.51 1aco h VAL 189 N -0.15 1.29 0.00 -1.35 2.07 -1.36 0.04 116.25 116.80 1aco h VAL 189 Ca 0.17 -1.52 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 1aco h VAL 189 Cb 0.41 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1aco h VAL 189 CO -0.42 0.49 -0.22 0.24 0.02 0.00 0.00 177.57 177.68 1aco h MET 190 N 0.54 0.00 0.00 1.57 2.86 -0.85 -0.95 114.93 118.09 1aco h MET 190 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1aco h MET 190 Cb 0.93 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.59 1aco h MET 190 CO 0.08 0.22 -0.10 0.00 1.06 0.00 0.00 176.91 178.18 1aco h ALA 191 N 1.78 0.94 0.00 6.32 0.00 -0.16 0.24 119.26 128.39 1aco h ALA 191 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aco h ALA 191 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1aco h ALA 191 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1aco n GLY 192 N 1.27 0.77 3.93 0.00 0.00 -0.16 -4.87 105.19 106.13 1aco n GLY 192 Ca 0.05 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 1aco n GLY 192 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1aco s ILE 193 N -2.00 5.34 0.29 -0.61 -4.36 -0.26 -5.00 121.20 114.60 1aco s ILE 193 Ca 0.00 -0.44 -0.30 0.00 -0.26 0.00 0.00 60.65 59.65 1aco s ILE 193 Cb 0.00 -3.67 -0.13 0.00 1.25 0.00 0.00 42.46 39.92 1aco s ILE 193 CO 0.00 0.04 1.42 -2.65 0.24 0.00 0.00 174.94 173.99 1aco n PRO 194 N -0.03 2.24 -3.35 0.37 -0.02 -1.26 -4.11 135.00 128.84 1aco n PRO 194 Ca -0.05 0.79 -0.38 0.00 -2.02 0.00 0.00 63.50 61.84 1aco n PRO 194 Cb 0.52 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.48 1aco n PRO 194 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1aco s TRP 195 N -0.43 3.74 -0.09 6.00 -0.00 -0.57 -4.83 118.94 122.77 1aco s TRP 195 Ca 0.62 1.14 -0.02 0.00 -0.00 0.00 0.00 56.10 57.84 1aco s TRP 195 Cb -0.58 -2.44 -0.03 0.00 -0.00 0.00 0.00 33.47 30.41 1aco s TRP 195 CO 0.54 0.55 0.02 -1.21 -0.00 0.00 0.00 176.95 176.85 1aco s GLU 196 N -0.86 3.03 -0.05 5.86 2.02 -1.26 -0.72 118.70 126.71 1aco s GLU 196 Ca 0.27 -0.38 -0.02 0.00 0.02 0.00 0.00 54.97 54.86 1aco s GLU 196 Cb -0.18 -2.83 0.03 0.00 0.10 0.00 0.00 34.13 31.25 1aco s GLU 196 CO 0.16 0.71 0.11 -1.17 0.02 0.00 0.00 175.26 175.09 1aco s LEU 197 N -0.89 0.97 0.17 1.80 2.96 -0.18 -4.94 118.68 118.57 1aco s LEU 197 Ca 0.13 0.23 -0.32 0.00 -0.22 0.00 0.00 54.13 53.95 1aco s LEU 197 Cb -0.11 0.27 -0.11 0.00 0.50 0.00 0.00 46.19 46.74 1aco s LEU 197 CO 0.02 -0.12 1.72 -0.75 -1.32 0.00 0.00 176.35 175.90 1aco s LYS 198 N 0.93 4.15 -0.16 1.98 2.47 -1.26 -0.44 119.74 127.40 1aco s LYS 198 Ca -0.07 2.54 -0.35 0.00 -1.56 0.00 0.00 55.97 56.53 1aco s LYS 198 Cb -0.10 -3.24 -0.12 0.00 -1.46 0.00 0.00 37.83 32.91 1aco s LYS 198 CO -0.04 -0.75 1.90 0.00 0.16 0.00 0.00 175.35 176.62 1aco s PRO 200 N 4.28 3.69 0.88 0.00 0.04 -1.26 0.41 135.00 143.03 1aco s PRO 200 Ca 0.96 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 63.09 1aco s PRO 200 Cb -0.78 -2.09 0.12 0.00 0.04 0.00 0.00 34.50 31.80 1aco s PRO 200 CO 0.54 -0.51 1.13 0.15 0.04 0.00 0.00 177.00 178.35 1aco s LYS 201 N -3.69 1.36 -0.08 4.56 -0.14 -0.44 -4.06 119.74 117.24 1aco s LYS 201 Ca 0.64 0.36 -0.01 0.00 -1.36 0.00 0.00 55.97 55.61 1aco s LYS 201 Cb -0.14 -1.86 0.03 0.00 -1.68 0.00 0.00 37.83 34.17 1aco s LYS 201 CO 0.28 -2.06 -0.03 0.08 -0.76 0.00 0.00 175.35 172.85 1aco s VAL 202 N -3.26 0.64 -0.21 3.17 1.01 -1.26 -0.83 120.40 119.67 1aco s VAL 202 Ca 0.63 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.44 1aco s VAL 202 Cb -0.15 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 1aco s VAL 202 CO 0.53 0.30 0.17 -0.63 0.00 0.00 0.00 175.10 175.47 1aco s ILE 203 N 1.77 5.38 -0.13 2.22 1.01 -0.26 -0.22 121.20 130.97 1aco s ILE 203 Ca 0.03 0.25 -0.06 0.00 0.00 0.00 0.00 60.65 60.87 1aco s ILE 203 Cb -0.13 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1aco s ILE 203 CO -0.06 0.40 0.10 -0.83 0.00 0.00 0.00 174.94 174.56 1aco s GLY 204 N 0.59 2.06 -0.21 6.18 0.00 0.20 -0.60 107.32 115.54 1aco s GLY 204 Ca 0.09 -0.69 0.01 0.00 0.00 0.00 0.00 44.72 44.14 1aco s GLY 204 CO 0.01 -0.30 -0.12 0.14 0.00 0.00 0.00 173.10 172.82 1aco s VAL 205 N -0.67 1.87 -0.23 1.40 1.01 -0.61 -0.73 120.40 122.44 1aco s VAL 205 Ca 0.12 -1.18 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 1aco s VAL 205 Cb -0.12 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1aco s VAL 205 CO 0.02 0.18 0.46 -0.75 0.00 0.00 0.00 175.10 175.01 1aco s LYS 206 N 1.29 4.12 -0.17 2.72 2.20 0.33 -1.55 119.74 128.67 1aco s LYS 206 Ca -0.02 0.26 -0.08 0.00 -0.36 0.00 0.00 55.97 55.77 1aco s LYS 206 Cb -0.17 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 1aco s LYS 206 CO -0.08 -0.20 0.09 -0.51 -0.36 0.00 0.00 175.35 174.28 1aco s LEU 207 N 1.83 4.00 0.23 5.43 1.43 0.15 -0.29 118.68 131.46 1aco s LEU 207 Ca 0.20 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.58 1aco s LEU 207 Cb -0.15 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 1aco s LEU 207 CO 0.09 0.23 -0.16 -0.89 0.23 0.00 0.00 176.35 175.85 1aco s THR 208 N 0.04 1.98 0.00 5.49 2.01 -0.02 -0.82 115.64 124.32 1aco s THR 208 Ca 0.07 -2.28 0.00 0.00 0.31 0.00 0.00 61.69 59.79 1aco s THR 208 Cb -0.12 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.26 1aco s THR 208 CO 0.00 -0.53 0.00 0.61 -0.69 0.00 0.00 174.62 174.01 1aco n GLY 209 N -0.46 -0.44 3.34 4.40 0.00 -1.26 -0.42 105.19 110.35 1aco n GLY 209 Ca -0.07 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 1aco n GLY 209 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aco s SER 210 N -4.00 -0.35 0.34 1.61 1.04 -1.26 -4.13 113.70 106.95 1aco s SER 210 Ca 0.00 0.22 -0.28 0.00 0.48 0.00 0.00 55.95 56.36 1aco s SER 210 Cb 0.00 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.43 1aco s SER 210 CO 0.00 -0.58 1.30 -0.76 0.98 0.00 0.00 173.24 174.19 1aco s LEU 211 N -1.56 4.40 -0.00 2.42 1.43 -1.26 -2.85 118.68 121.25 1aco s LEU 211 Ca -0.10 2.67 -0.01 0.00 -1.03 0.00 0.00 54.13 55.67 1aco s LEU 211 Cb -0.02 -3.69 -0.00 0.00 0.03 0.00 0.00 46.19 42.51 1aco s LEU 211 CO 0.03 -0.57 0.01 -0.94 0.23 0.00 0.00 176.35 175.11 1aco s SER 212 N -0.54 0.02 1.44 2.29 1.04 -1.26 -5.02 113.70 111.68 1aco s SER 212 Ca 0.50 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.88 1aco s SER 212 Cb -0.39 0.05 0.00 0.00 0.10 0.00 0.00 66.02 65.78 1aco s SER 212 CO 0.52 -0.06 0.00 0.61 0.98 0.00 0.00 173.24 175.29 1aco n GLY 213 N 2.80 2.63 0.22 7.32 0.00 -1.26 -2.59 105.19 114.30 1aco n GLY 213 Ca -0.14 -0.29 0.14 0.00 0.00 0.00 0.00 46.02 45.73 1aco n GLY 213 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1aco h TRP 214 N 0.00 0.00 -3.41 1.61 4.06 -1.93 -3.42 115.95 112.85 1aco h TRP 214 Ca 0.00 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.43 1aco h TRP 214 Cb 0.00 0.00 0.04 0.00 -1.00 0.00 0.00 29.16 28.20 1aco h TRP 214 CO 0.00 0.00 0.66 0.99 -3.56 0.00 0.00 178.44 176.53 1aco s THR 215 N -3.33 3.11 0.34 1.49 2.01 -1.07 -4.80 115.64 113.39 1aco s THR 215 Ca 0.06 0.92 0.04 0.00 0.31 0.00 0.00 61.69 63.02 1aco s THR 215 Cb 0.07 -3.59 -0.06 0.00 0.01 0.00 0.00 72.50 68.93 1aco s THR 215 CO 0.61 0.14 0.06 -0.94 -0.69 0.00 0.00 174.62 173.80 1aco s SER 216 N 0.29 2.55 0.29 3.53 1.04 -1.26 -4.46 113.70 115.68 1aco s SER 216 Ca 0.57 -1.40 0.04 0.00 0.48 0.00 0.00 55.95 55.64 1aco s SER 216 Cb -0.37 -0.07 0.70 0.00 0.10 0.00 0.00 66.02 66.37 1aco s SER 216 CO 0.40 -0.61 1.76 -0.65 0.98 0.00 0.00 173.24 175.11 1aco h PRO 217 N 2.06 0.66 -0.95 4.02 0.11 -1.95 -2.13 132.00 133.81 1aco h PRO 217 Ca -0.41 -0.04 0.21 0.00 0.11 0.00 0.00 66.00 65.87 1aco h PRO 217 Cb 1.25 -0.15 -0.08 0.00 0.11 0.00 0.00 31.00 32.13 1aco h PRO 217 CO 0.70 0.43 0.62 -0.22 -0.21 0.00 0.00 178.00 179.32 1aco h LYS 218 N 0.68 0.47 0.00 1.05 1.63 -1.93 -1.81 116.57 116.67 1aco h LYS 218 Ca 0.55 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 60.29 1aco h LYS 218 Cb 0.88 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1aco h LYS 218 CO -0.40 0.31 -0.16 -0.44 -3.45 0.00 0.00 179.45 175.31 1aco h ASP 219 N 0.48 0.00 0.08 4.20 3.32 -1.75 -0.99 116.42 121.76 1aco h ASP 219 Ca 0.52 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.56 1aco h ASP 219 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1aco h ASP 219 CO -0.24 0.16 -0.04 0.58 -1.72 0.00 0.00 179.24 177.99 1aco h VAL 220 N 0.00 1.13 0.00 -1.35 2.07 -1.43 -1.26 116.25 115.41 1aco h VAL 220 Ca -0.00 -0.75 -0.11 0.00 0.82 0.00 0.00 66.70 66.65 1aco h VAL 220 Cb 0.40 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1aco h VAL 220 CO 0.02 0.19 -0.52 -0.29 0.02 0.00 0.00 177.57 176.98 1aco h ILE 221 N -0.45 1.02 -0.64 4.57 6.09 -1.55 -1.44 117.51 125.12 1aco h ILE 221 Ca -0.01 -2.10 -0.05 0.00 -1.37 0.00 0.00 64.86 61.33 1aco h ILE 221 Cb 0.38 2.27 -0.03 0.00 0.47 0.00 0.00 36.82 39.91 1aco h ILE 221 CO 0.02 0.51 0.21 -0.07 -3.07 0.00 0.00 178.15 175.75 1aco h LEU 222 N 0.00 0.89 -0.08 2.19 3.38 -1.12 -0.64 115.31 119.93 1aco h LEU 222 Ca -0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1aco h LEU 222 Cb 1.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 1aco h LEU 222 CO 0.07 0.83 -0.05 0.50 0.09 0.00 0.00 178.44 179.88 1aco h LYS 223 N 0.94 0.17 -0.68 1.13 1.63 -1.11 -2.64 116.57 116.00 1aco h LYS 223 Ca 0.21 -0.08 0.06 0.00 -0.85 0.00 0.00 60.65 59.99 1aco h LYS 223 Cb 0.25 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.82 1aco h LYS 223 CO -0.01 0.56 0.39 0.28 -3.45 0.00 0.00 179.45 177.22 1aco h VAL 224 N -0.22 0.98 -0.59 2.00 2.07 -1.13 -1.16 116.25 118.20 1aco h VAL 224 Ca 0.02 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.30 1aco h VAL 224 Cb 0.52 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1aco h VAL 224 CO 0.01 0.13 0.39 0.00 0.02 0.00 0.00 177.57 178.12 1aco h ALA 225 N 1.35 0.74 -0.90 1.67 0.00 -1.12 0.63 119.26 121.64 1aco h ALA 225 Ca 0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1aco h ALA 225 Cb 0.18 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1aco h ALA 225 CO -0.18 0.18 0.48 0.78 0.00 0.00 0.00 179.25 180.51 1aco h GLY 226 N 0.79 1.35 0.48 0.00 0.00 -1.08 0.89 103.07 105.50 1aco h GLY 226 Ca 0.22 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1aco h GLY 226 CO -0.05 0.60 -0.05 -2.22 0.00 0.00 0.00 176.54 174.82 1aco h ILE 227 N 1.26 1.10 0.00 2.60 2.04 -0.72 -3.35 117.51 120.44 1aco h ILE 227 Ca 0.31 -1.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.04 1aco h ILE 227 Cb 0.04 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1aco h ILE 227 CO -0.05 0.25 -0.43 -0.07 0.00 0.00 0.00 178.15 177.85 1aco h LEU 228 N -0.66 0.00 -0.22 1.44 4.07 -0.81 -3.51 115.31 115.62 1aco h LEU 228 Ca -0.01 0.00 0.17 0.00 0.08 0.00 0.00 57.88 58.11 1aco h LEU 228 Cb 0.52 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.18 1aco h LEU 228 CO 0.02 0.30 -0.46 0.35 -1.08 0.00 0.00 178.44 177.57 1aco n THR 229 N -3.12 -0.11 0.27 0.22 -2.24 0.30 -2.31 114.28 107.29 1aco n THR 229 Ca 0.02 0.28 0.18 0.00 -2.27 0.00 0.00 64.05 62.25 1aco n THR 229 Cb 0.66 -0.50 0.95 0.00 -2.10 0.00 0.00 70.33 69.33 1aco n THR 229 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1aco h VAL 230 N -0.64 0.00 -0.27 2.28 -1.51 -1.78 -1.71 116.25 112.62 1aco h VAL 230 Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 1aco h VAL 230 Cb 0.63 0.77 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 1aco h VAL 230 CO 0.03 0.00 0.00 2.29 -1.23 0.00 0.00 177.57 178.66 1aco n LYS 231 N -2.74 2.16 0.15 5.19 2.85 -1.26 -3.47 118.16 121.04 1aco n LYS 231 Ca -0.02 -1.85 0.13 0.00 -1.05 0.00 0.00 58.31 55.52 1aco n LYS 231 Cb 0.08 -1.29 0.38 0.00 -0.65 0.00 0.00 35.03 33.56 1aco n LYS 231 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1aco h GLY 232 N 2.41 0.00 -2.15 2.58 0.00 -0.89 -3.17 103.07 101.86 1aco h GLY 232 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1aco h GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1aco n GLY 233 N 0.95 1.54 3.67 4.60 0.00 0.66 -4.97 105.19 111.65 1aco n GLY 233 Ca 0.04 -0.70 -0.48 0.00 0.00 0.00 0.00 46.02 44.88 1aco n GLY 233 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1aco n THR 234 N 1.40 0.29 -1.01 2.61 -1.04 -1.20 -2.01 114.28 113.32 1aco n THR 234 Ca 0.18 -0.05 -0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1aco n THR 234 Cb 0.59 -1.63 -0.00 0.00 -1.82 0.00 0.00 70.33 67.47 1aco n THR 234 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aco n GLY 235 N 3.87 0.46 3.27 3.41 0.00 -1.25 -4.96 105.19 109.99 1aco n GLY 235 Ca 0.20 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1aco n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aco s ALA 236 N -1.91 1.73 -0.04 4.61 0.00 -0.85 -1.32 121.76 123.97 1aco s ALA 236 Ca 0.00 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.62 1aco s ALA 236 Cb 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 1aco s ALA 236 CO 0.00 0.34 0.32 0.42 0.00 0.00 0.00 175.76 176.84 1aco s ILE 237 N -1.17 5.19 -0.22 0.00 1.01 -0.01 -0.35 121.20 125.64 1aco s ILE 237 Ca 0.05 0.63 -0.13 0.00 0.00 0.00 0.00 60.65 61.20 1aco s ILE 237 Cb -0.10 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1aco s ILE 237 CO 0.04 0.59 0.29 -0.69 0.00 0.00 0.00 174.94 175.17 1aco s VAL 238 N -1.03 5.27 -0.27 2.92 1.01 -0.46 -1.10 120.40 126.75 1aco s VAL 238 Ca 0.21 0.47 0.03 0.00 0.00 0.00 0.00 61.98 62.69 1aco s VAL 238 Cb -0.15 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.67 1aco s VAL 238 CO 0.10 0.30 -0.09 -0.70 0.00 0.00 0.00 175.10 174.71 1aco s GLU 239 N 1.17 2.18 0.16 2.72 2.12 0.23 -1.18 118.70 126.10 1aco s GLU 239 Ca 0.14 -1.39 -0.27 0.00 0.36 0.00 0.00 54.97 53.81 1aco s GLU 239 Cb -0.14 -2.93 -0.08 0.00 0.26 0.00 0.00 34.13 31.24 1aco s GLU 239 CO 0.06 -0.61 0.83 0.71 -0.54 0.00 0.00 175.26 175.72 1aco s TYR 240 N 1.09 3.90 0.32 5.30 1.51 -0.72 -1.57 117.35 127.19 1aco s TYR 240 Ca -0.07 1.70 -0.15 0.00 -1.01 0.00 0.00 57.07 57.54 1aco s TYR 240 Cb -0.20 -2.85 0.03 0.00 -0.11 0.00 0.00 41.96 38.83 1aco s TYR 240 CO -0.05 0.45 0.67 -3.38 -1.11 0.00 0.00 175.55 172.12 1aco s HIS 241 N -0.92 0.22 0.00 2.71 -3.43 -0.60 -4.22 115.29 109.04 1aco s HIS 241 Ca 0.38 -0.71 0.00 0.00 -0.80 0.00 0.00 55.06 53.94 1aco s HIS 241 Cb -0.24 0.55 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 1aco s HIS 241 CO 0.28 -1.31 0.00 0.41 -2.00 0.00 0.00 174.74 172.12 1aco n GLY 242 N -0.49 2.48 0.29 -1.38 0.00 -1.26 -0.68 105.19 104.16 1aco n GLY 242 Ca -0.04 -2.02 0.13 0.00 0.00 0.00 0.00 46.02 44.09 1aco n GLY 242 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aco h PRO 243 N 0.00 0.00 0.00 1.61 0.13 -1.91 -2.43 132.00 129.40 1aco h PRO 243 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1aco h PRO 243 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1aco h PRO 243 CO 0.00 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 178.55 1aco h GLY 244 N 0.00 0.00 0.87 1.56 0.00 -1.14 -3.21 103.07 101.16 1aco h GLY 244 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.39 1aco h GLY 244 CO -0.00 0.00 0.63 -2.08 0.00 0.00 0.00 176.54 175.09 1aco h VAL 245 N 0.00 1.14 0.00 4.60 2.07 -1.63 -2.14 116.25 120.29 1aco h VAL 245 Ca 0.00 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1aco h VAL 245 Cb 0.50 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1aco h VAL 245 CO 0.00 0.22 0.00 0.47 0.02 0.00 0.00 177.57 178.28 1aco n ASP 246 N -4.46 0.46 0.21 0.57 8.00 -1.21 -1.44 116.55 118.67 1aco n ASP 246 Ca 0.14 0.62 0.15 0.00 0.71 0.00 0.00 54.79 56.41 1aco n ASP 246 Cb 0.13 -0.72 0.55 0.00 -0.02 0.00 0.00 41.12 41.07 1aco n ASP 246 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1aco h SER 247 N 0.00 0.00 -3.28 -2.24 0.87 -1.59 -3.46 113.55 103.85 1aco h SER 247 Ca 0.00 0.00 -0.65 0.00 -1.23 0.00 0.00 61.79 59.91 1aco h SER 247 Cb 0.29 0.00 -0.16 0.00 -0.44 0.00 0.00 62.40 62.08 1aco h SER 247 CO 0.00 0.00 -0.61 -0.63 -0.53 0.00 0.00 176.83 175.06 1aco s ILE 248 N -3.46 4.38 0.86 2.23 1.01 -0.52 -4.78 121.20 120.92 1aco s ILE 248 Ca 0.03 -0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.38 1aco s ILE 248 Cb 0.09 -2.90 0.11 0.00 0.01 0.00 0.00 42.46 39.77 1aco s ILE 248 CO 0.51 0.54 1.12 -0.94 0.00 0.00 0.00 174.94 176.17 1aco s SER 249 N -0.29 3.55 0.20 3.58 1.04 -1.26 -4.81 113.70 115.71 1aco s SER 249 Ca 0.07 1.97 -0.11 0.00 0.48 0.00 0.00 55.95 58.36 1aco s SER 249 Cb -0.12 -2.52 0.16 0.00 0.10 0.00 0.00 66.02 63.64 1aco s SER 249 CO 0.02 -2.67 1.85 0.00 0.98 0.00 0.00 173.24 173.42 1aco h THR 251 N 0.87 1.14 -0.75 0.00 1.35 -1.93 -1.82 112.91 111.77 1aco h THR 251 Ca 0.27 -1.50 -0.03 0.00 -0.55 0.00 0.00 66.41 64.59 1aco h THR 251 Cb -0.03 1.85 -0.03 0.00 -1.73 0.00 0.00 68.15 68.21 1aco h THR 251 CO -0.09 0.41 0.35 1.23 -0.25 0.00 0.00 175.52 177.17 1aco h GLY 252 N 1.57 1.16 1.32 5.82 0.00 -1.68 -0.39 103.07 110.86 1aco h GLY 252 Ca -0.00 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.64 1aco h GLY 252 CO 0.05 0.56 -0.11 -0.33 0.00 0.00 0.00 176.54 176.71 1aco h MET 253 N 1.05 0.81 -0.69 4.80 0.00 -0.48 -2.62 114.93 117.80 1aco h MET 253 Ca 0.25 -0.27 -0.07 0.00 0.00 0.00 0.00 59.70 59.61 1aco h MET 253 Cb 0.14 -0.07 -0.03 0.00 0.00 0.00 0.00 31.60 31.64 1aco h MET 253 CO -0.03 0.88 0.14 0.00 0.00 0.00 0.00 176.91 177.90 1aco h ALA 254 N 1.15 0.91 -0.48 6.32 0.00 -0.85 -1.41 119.26 124.90 1aco h ALA 254 Ca 0.12 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.85 1aco h ALA 254 Cb 0.60 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 1aco h ALA 254 CO 0.04 0.66 0.12 1.15 0.00 0.00 0.00 179.25 181.21 1aco h THR 255 N 1.05 0.76 -0.32 0.00 2.02 -0.76 0.10 112.91 115.77 1aco h THR 255 Ca 0.21 -0.09 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 1aco h THR 255 Cb 0.41 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1aco h THR 255 CO 0.01 0.05 -0.08 0.40 0.37 0.00 0.00 175.52 176.26 1aco h ILE 256 N 0.26 1.28 -0.60 3.11 2.04 -1.17 -2.83 117.51 119.60 1aco h ILE 256 Ca 0.24 -1.13 -0.07 0.00 1.00 0.00 0.00 64.86 64.89 1aco h ILE 256 Cb 0.29 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1aco h ILE 256 CO -0.29 0.37 0.09 0.00 0.00 0.00 0.00 178.15 178.32 1aco h ASN 258 N 0.92 -0.94 -0.00 0.00 -0.73 -0.60 -2.77 115.58 111.45 1aco h ASN 258 Ca 0.19 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.47 1aco h ASN 258 Cb 0.41 0.36 0.00 0.00 0.27 0.00 0.00 38.32 39.36 1aco h ASN 258 CO 0.01 -0.40 0.00 0.80 -0.37 0.00 0.00 177.43 177.47 1aco n MET 259 N -5.42 1.05 0.14 6.67 1.56 -1.08 -2.19 117.12 117.85 1aco n MET 259 Ca -0.06 -0.07 0.11 0.00 -0.27 0.00 0.00 57.70 57.40 1aco n MET 259 Cb 0.33 -1.46 0.52 0.00 2.15 0.00 0.00 33.22 34.76 1aco n MET 259 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1aco n GLY 260 N 0.97 -1.01 0.25 -5.12 0.00 -1.04 -1.08 105.19 98.15 1aco n GLY 260 Ca 0.22 0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.45 1aco n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aco h ALA 261 N 2.12 1.88 0.00 4.61 0.00 -1.62 -2.46 119.26 123.79 1aco h ALA 261 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1aco h ALA 261 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1aco h ALA 261 CO 0.00 0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.71 1aco n GLU 262 N -4.44 0.40 -0.18 0.00 4.71 -0.24 -1.75 120.64 119.14 1aco n GLU 262 Ca -0.03 0.04 0.07 0.00 -0.01 0.00 0.00 57.16 57.24 1aco n GLU 262 Cb 0.14 -1.50 0.17 0.00 -1.01 0.00 0.00 31.44 29.24 1aco n GLU 262 CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 177.13 177.66 1aco n ILE 263 N -1.26 0.76 -0.85 -3.67 -5.35 -0.93 -4.15 119.36 103.91 1aco n ILE 263 Ca 0.13 -0.88 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 1aco n ILE 263 Cb 0.19 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 38.78 1aco n ILE 263 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1aco n GLY 264 N 0.84 0.57 3.75 3.28 0.00 -0.72 -0.25 105.19 112.66 1aco n GLY 264 Ca 0.14 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1aco n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aco s ALA 265 N -2.00 2.76 0.32 4.61 0.00 -1.18 -3.58 121.76 122.70 1aco s ALA 265 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1aco s ALA 265 Cb 0.00 -3.55 0.53 0.00 0.00 0.00 0.00 23.12 20.11 1aco s ALA 265 CO 0.00 -1.35 1.96 1.15 0.00 0.00 0.00 175.76 177.53 1aco h THR 266 N 1.34 1.19 -2.04 0.00 2.02 -0.84 -3.45 112.91 111.13 1aco h THR 266 Ca -0.51 -0.43 0.34 0.00 0.77 0.00 0.00 66.41 66.58 1aco h THR 266 Cb 1.30 0.26 -0.06 0.00 -1.74 0.00 0.00 68.15 67.91 1aco h THR 266 CO 0.57 0.20 0.87 1.07 0.37 0.00 0.00 175.52 178.59 1aco n THR 267 N -4.40 0.00 -4.07 3.16 5.66 -1.26 -4.44 114.28 108.93 1aco n THR 267 Ca 0.07 -0.11 -0.11 0.00 -3.05 0.00 0.00 64.05 60.85 1aco n THR 267 Cb 0.08 0.52 -0.11 0.00 -1.55 0.00 0.00 70.33 69.26 1aco n THR 267 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1aco s SER 268 N -3.66 0.72 -0.01 1.09 0.01 -1.26 -1.35 113.70 109.24 1aco s SER 268 Ca 0.29 -0.72 -0.16 0.00 1.31 0.00 0.00 55.95 56.67 1aco s SER 268 Cb -0.01 0.09 0.03 0.00 0.21 0.00 0.00 66.02 66.34 1aco s SER 268 CO -0.01 -0.35 0.33 0.54 0.41 0.00 0.00 173.24 174.15 1aco s VAL 269 N -2.34 0.06 0.09 3.43 0.11 -0.32 -4.29 120.40 117.13 1aco s VAL 269 Ca -0.03 -0.48 0.07 0.00 -2.93 0.00 0.00 61.98 58.61 1aco s VAL 269 Cb -0.03 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1aco s VAL 269 CO -0.03 -0.26 -0.13 -0.36 -3.33 0.00 0.00 175.10 170.99 1aco s PHE 270 N -1.51 2.67 0.45 1.54 0.40 -1.02 -1.76 117.98 118.76 1aco s PHE 270 Ca -0.12 -0.19 -0.23 0.00 -0.60 0.00 0.00 56.93 55.79 1aco s PHE 270 Cb -0.04 -1.43 -0.08 0.00 0.51 0.00 0.00 43.02 41.98 1aco s PHE 270 CO 0.03 0.38 1.12 -1.25 0.70 0.00 0.00 175.22 176.21 1aco s PRO 271 N -1.99 3.84 0.28 0.24 0.04 -1.26 -3.96 135.00 132.19 1aco s PRO 271 Ca 0.19 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 1aco s PRO 271 Cb -0.11 -2.39 -0.12 0.00 0.04 0.00 0.00 34.50 31.92 1aco s PRO 271 CO 0.11 -0.45 1.51 0.98 0.04 0.00 0.00 177.00 179.18 1aco n TYR 272 N -0.47 2.59 -3.91 0.56 9.36 -0.85 -4.90 117.16 119.54 1aco n TYR 272 Ca 0.07 0.34 -0.11 0.00 3.32 0.00 0.00 57.90 61.52 1aco n TYR 272 Cb 0.49 -2.54 -0.00 0.00 -0.63 0.00 0.00 39.34 36.66 1aco n TYR 272 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1aco s ASN 273 N 0.34 0.37 0.47 2.98 2.20 -1.26 -4.88 114.94 115.16 1aco s ASN 273 Ca 0.64 -1.28 0.20 0.00 -0.94 0.00 0.00 52.86 51.48 1aco s ASN 273 Cb -0.55 0.78 1.17 0.00 -2.00 0.00 0.00 41.25 40.66 1aco s ASN 273 CO 0.51 -1.55 2.01 1.12 -2.94 0.00 0.00 177.10 176.25 1aco h HIS 274 N 2.04 0.00 -0.25 1.54 2.07 -1.99 -2.17 115.15 116.38 1aco h HIS 274 Ca -0.31 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.10 1aco h HIS 274 Cb 1.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.21 1aco h HIS 274 CO 1.43 0.17 -0.33 0.00 -3.07 0.00 0.00 177.93 176.13 1aco h ARG 275 N 0.00 0.53 -0.29 5.12 2.47 -1.93 -2.12 114.38 118.15 1aco h ARG 275 Ca -0.00 -0.24 -0.11 0.00 -1.26 0.00 0.00 59.98 58.37 1aco h ARG 275 Cb 0.35 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 1aco h ARG 275 CO 0.02 0.80 -0.26 0.52 0.56 0.00 0.00 179.97 181.60 1aco h MET 276 N 0.45 0.70 -0.67 0.04 2.86 -1.82 -2.18 114.93 114.31 1aco h MET 276 Ca 0.05 -0.36 0.06 0.00 -2.06 0.00 0.00 59.70 57.40 1aco h MET 276 Cb 0.79 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.41 1aco h MET 276 CO 0.06 0.97 0.36 -0.22 1.06 0.00 0.00 176.91 179.15 1aco h LYS 277 N 0.45 0.65 -0.42 1.72 3.64 -1.22 -0.11 116.57 121.27 1aco h LYS 277 Ca 0.05 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1aco h LYS 277 Cb 0.83 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 1aco h LYS 277 CO 0.07 0.43 0.22 -0.22 -2.27 0.00 0.00 179.45 177.68 1aco h LYS 278 N 0.67 0.60 -0.38 1.90 3.64 -1.34 -0.92 116.57 120.73 1aco h LYS 278 Ca 0.30 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1aco h LYS 278 Cb 0.21 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1aco h LYS 278 CO -0.19 0.49 0.15 -0.92 -2.27 0.00 0.00 179.45 176.71 1aco h TYR 279 N 0.55 0.59 -0.76 1.91 3.20 -0.67 -1.35 116.97 120.44 1aco h TYR 279 Ca 0.15 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.02 1aco h TYR 279 Cb 0.08 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.12 1aco h TYR 279 CO -0.02 0.54 0.47 -0.07 -1.64 0.00 0.00 178.16 177.43 1aco h LEU 280 N 0.47 0.74 -0.46 2.82 3.38 -0.80 -1.03 115.31 120.43 1aco h LEU 280 Ca 0.13 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1aco h LEU 280 Cb 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1aco h LEU 280 CO -0.01 0.49 -0.16 0.28 0.09 0.00 0.00 178.44 179.14 1aco h SER 281 N 0.88 0.94 1.03 -0.43 0.02 -0.97 0.25 113.55 115.27 1aco h SER 281 Ca 0.32 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1aco h SER 281 Cb 0.11 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1aco h SER 281 CO -0.15 1.10 0.00 0.50 -1.14 0.00 0.00 176.83 177.14 1aco h LYS 282 N 0.76 0.00 -0.87 3.45 1.63 -0.88 -2.87 116.57 117.79 1aco h LYS 282 Ca 0.11 0.00 -0.52 0.00 -0.85 0.00 0.00 60.65 59.39 1aco h LYS 282 Cb 0.72 0.00 -0.28 0.00 -0.60 0.00 0.00 32.23 32.07 1aco h LYS 282 CO 0.05 0.00 0.49 0.25 -3.45 0.00 0.00 179.45 176.79 1aco n THR 283 N -2.53 3.20 -1.18 1.00 -2.24 -0.42 -4.65 114.28 107.45 1aco n THR 283 Ca 0.02 -2.61 -0.06 0.00 -2.27 0.00 0.00 64.05 59.13 1aco n THR 283 Cb 0.31 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 67.77 1aco n THR 283 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aco n GLY 284 N -1.03 0.85 2.38 3.38 0.00 -1.08 -4.93 105.19 104.76 1aco n GLY 284 Ca 0.55 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 1aco n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aco n ARG 285 N -2.76 2.81 -0.31 1.61 1.74 0.85 -4.82 116.66 115.78 1aco n ARG 285 Ca -0.06 -3.91 0.03 0.00 -0.77 0.00 0.00 57.85 53.14 1aco n ARG 285 Cb 0.21 -1.99 0.23 0.00 -1.02 0.00 0.00 32.46 29.89 1aco n ARG 285 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aco h ALA 286 N 2.40 1.48 -0.71 7.54 0.00 -1.79 -1.95 119.26 126.24 1aco h ALA 286 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1aco h ALA 286 Cb 1.38 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1aco h ALA 286 CO 0.54 0.39 0.41 0.38 0.00 0.00 0.00 179.25 180.98 1aco h ASP 287 N 1.06 0.86 -0.27 0.00 2.03 -1.93 -0.19 116.42 117.97 1aco h ASP 287 Ca 0.38 -0.05 -0.10 0.00 -0.73 0.00 0.00 57.03 56.53 1aco h ASP 287 Cb 0.15 -0.22 -0.01 0.00 -0.83 0.00 0.00 39.33 38.43 1aco h ASP 287 CO -0.14 0.67 -0.21 0.40 -1.03 0.00 0.00 179.24 178.94 1aco h ILE 288 N 0.98 1.31 -0.53 4.15 2.04 -1.80 -0.70 117.51 122.97 1aco h ILE 288 Ca 0.25 -1.35 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 1aco h ILE 288 Cb -0.01 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1aco h ILE 288 CO -0.05 0.43 0.25 0.00 0.00 0.00 0.00 178.15 178.78 1aco h ALA 289 N 0.71 1.46 -0.33 1.87 0.00 -0.80 -0.48 119.26 121.68 1aco h ALA 289 Ca 0.05 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1aco h ALA 289 Cb 0.75 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1aco h ALA 289 CO 0.05 0.43 -0.27 -0.91 0.00 0.00 0.00 179.25 178.56 1aco h ASN 290 N 0.74 0.80 -0.58 0.00 2.35 -0.82 -0.46 115.58 117.60 1aco h ASN 290 Ca 0.18 -0.45 -0.06 0.00 -0.55 0.00 0.00 56.30 55.42 1aco h ASN 290 Cb 0.08 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1aco h ASN 290 CO -0.02 1.08 0.13 0.25 -1.65 0.00 0.00 177.43 177.22 1aco h LEU 291 N 0.53 0.90 -1.23 1.61 5.85 -0.81 -2.69 115.31 119.46 1aco h LEU 291 Ca 0.06 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 1aco h LEU 291 Cb 0.84 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1aco h LEU 291 CO 0.07 0.91 0.06 0.00 -0.34 0.00 0.00 178.44 179.14 1aco h ALA 292 N 1.02 1.38 -0.99 1.25 0.00 -0.94 -1.26 119.26 119.72 1aco h ALA 292 Ca 0.18 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1aco h ALA 292 Cb 0.37 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1aco h ALA 292 CO 0.00 0.44 0.65 -0.44 0.00 0.00 0.00 179.25 179.91 1aco h ASP 293 N 0.57 1.11 0.49 0.00 3.32 -0.76 0.64 116.42 121.78 1aco h ASP 293 Ca 0.13 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1aco h ASP 293 Cb 0.27 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1aco h ASP 293 CO 0.00 0.78 -0.43 -0.33 -1.72 0.00 0.00 179.24 177.53 1aco h GLU 294 N 1.29 0.00 -0.44 3.56 5.08 -0.99 -3.12 114.58 119.96 1aco h GLU 294 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1aco h GLU 294 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1aco h GLU 294 CO -0.11 0.43 0.00 1.19 -1.00 0.00 0.00 179.01 179.53 1aco n PHE 295 N -3.94 1.39 -0.34 4.33 3.01 -0.71 -4.76 117.46 116.43 1aco n PHE 295 Ca -0.02 -0.75 0.24 0.00 1.01 0.00 0.00 57.45 57.93 1aco n PHE 295 Cb 0.47 -0.35 0.48 0.00 -0.01 0.00 0.00 39.48 40.07 1aco n PHE 295 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1aco h LYS 296 N 2.96 0.34 -0.08 -1.08 1.63 -0.83 -0.84 116.57 118.67 1aco h LYS 296 Ca 0.00 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.80 1aco h LYS 296 Cb 1.57 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 33.12 1aco h LYS 296 CO 0.30 0.23 0.06 -0.44 -3.45 0.00 0.00 179.45 176.14 1aco h ASP 297 N 0.35 0.00 0.22 4.20 3.32 -1.87 -0.64 116.42 122.01 1aco h ASP 297 Ca 0.71 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.76 1aco h ASP 297 Cb 1.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.21 1aco h ASP 297 CO -0.54 0.00 -0.15 1.41 -1.72 0.00 0.00 179.24 178.24 1aco n HIS 298 N -4.40 0.00 -0.28 4.55 8.25 -0.32 -3.98 115.22 119.03 1aco n HIS 298 Ca -0.01 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.50 1aco n HIS 298 Cb 0.17 -0.11 0.13 0.00 1.12 0.00 0.00 29.99 31.30 1aco n HIS 298 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1aco n LEU 299 N -0.60 2.81 -4.20 2.41 4.77 -0.25 -4.73 117.00 117.21 1aco n LEU 299 Ca 0.15 -2.18 -0.13 0.00 -0.03 0.00 0.00 56.01 53.82 1aco n LEU 299 Cb 0.32 -0.23 -0.10 0.00 -2.33 0.00 0.00 43.42 41.08 1aco n LEU 299 CO 0.23 0.67 -0.40 0.68 -1.33 0.00 0.00 177.39 177.24 1aco s VAL 300 N -1.31 0.93 0.71 4.08 -7.23 -1.19 -2.00 120.40 114.39 1aco s VAL 300 Ca 0.21 -1.95 -0.14 0.00 -1.81 0.00 0.00 61.98 58.29 1aco s VAL 300 Cb 0.13 -1.71 0.03 0.00 0.56 0.00 0.00 36.38 35.39 1aco s VAL 300 CO 0.11 -0.78 1.13 -2.16 -0.31 0.00 0.00 175.10 173.08 1aco s PRO 301 N -3.67 2.44 0.53 4.82 0.04 -1.26 -4.60 135.00 133.31 1aco s PRO 301 Ca 0.13 1.43 -0.19 0.00 0.04 0.00 0.00 61.00 62.41 1aco s PRO 301 Cb 0.03 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 1aco s PRO 301 CO -0.02 -1.54 1.06 -0.51 0.04 0.00 0.00 177.00 176.03 1aco s ASP 302 N -2.64 6.06 0.21 6.66 1.01 -0.72 -4.91 116.67 122.34 1aco s ASP 302 Ca 0.67 1.93 -0.31 0.00 0.71 0.00 0.00 52.55 55.56 1aco s ASP 302 Cb -0.22 -2.55 -0.10 0.00 1.01 0.00 0.00 42.92 41.06 1aco s ASP 302 CO 0.46 -0.97 1.47 -0.55 0.21 0.00 0.00 175.17 175.79 1aco s SER 303 N -2.21 6.66 -0.74 0.27 0.15 -1.26 -2.15 113.70 114.42 1aco s SER 303 Ca 0.67 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.93 1aco s SER 303 Cb -0.17 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 1aco s SER 303 CO 0.26 -0.73 0.00 0.61 1.20 0.00 0.00 173.24 174.59 1aco n GLY 304 N 2.80 0.84 3.76 9.45 0.00 -1.26 -4.80 105.19 115.98 1aco n GLY 304 Ca 0.09 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 1aco n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aco s HIS 306 N -1.94 3.34 -0.00 0.00 5.65 -1.26 -4.99 115.29 116.08 1aco s HIS 306 Ca 0.72 0.40 -0.12 0.00 0.25 0.00 0.00 55.06 56.31 1aco s HIS 306 Cb -0.24 -2.39 -0.05 0.00 -1.18 0.00 0.00 32.58 28.71 1aco s HIS 306 CO 0.35 0.02 0.36 0.71 -0.65 0.00 0.00 174.74 175.52 1aco s TYR 307 N 1.21 3.67 -0.07 3.88 2.02 -1.26 -4.88 117.35 121.92 1aco s TYR 307 Ca 0.13 0.86 0.27 0.00 -0.37 0.00 0.00 57.07 57.95 1aco s TYR 307 Cb -0.14 -2.19 0.85 0.00 -0.40 0.00 0.00 41.96 40.07 1aco s TYR 307 CO 0.06 0.63 1.79 -0.44 -1.57 0.00 0.00 175.55 176.02 1aco h ASP 308 N 4.50 0.00 -4.04 2.29 3.32 -0.98 -3.44 116.42 118.06 1aco h ASP 308 Ca -0.52 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.39 1aco h ASP 308 Cb 1.21 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.52 1aco h ASP 308 CO 0.62 0.10 -0.34 -1.58 -1.72 0.00 0.00 179.24 176.32 1aco s GLN 309 N -3.47 0.41 -0.03 3.56 0.74 -1.23 -5.03 119.66 114.62 1aco s GLN 309 Ca 0.03 0.32 0.05 0.00 0.05 0.00 0.00 55.36 55.81 1aco s GLN 309 Cb 0.08 0.20 -0.01 0.00 1.10 0.00 0.00 33.01 34.38 1aco s GLN 309 CO 0.62 -0.07 -0.18 -1.17 -0.55 0.00 0.00 175.29 173.95 1aco s LEU 310 N -0.09 1.96 -0.00 3.68 1.98 -1.26 -0.63 118.68 124.33 1aco s LEU 310 Ca -0.02 -0.35 0.05 0.00 -2.89 0.00 0.00 54.13 50.91 1aco s LEU 310 Cb -0.03 -0.97 -0.01 0.00 0.66 0.00 0.00 46.19 45.84 1aco s LEU 310 CO 0.01 0.18 -0.15 -0.63 -1.89 0.00 0.00 176.35 173.88 1aco s ILE 311 N -0.14 1.16 -0.06 6.68 1.01 0.09 -4.96 121.20 124.98 1aco s ILE 311 Ca 0.00 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 60.00 1aco s ILE 311 Cb -0.10 -0.99 -0.01 0.00 0.01 0.00 0.00 42.46 41.38 1aco s ILE 311 CO 0.01 0.26 -0.25 -0.70 0.00 0.00 0.00 174.94 174.27 1aco s GLU 312 N -0.51 2.62 -0.10 2.79 2.12 -1.26 -0.51 118.70 123.84 1aco s GLU 312 Ca 0.05 -0.90 0.02 0.00 0.36 0.00 0.00 54.97 54.50 1aco s GLU 312 Cb -0.06 -2.19 0.02 0.00 0.26 0.00 0.00 34.13 32.16 1aco s GLU 312 CO -0.00 0.36 -0.13 0.42 -0.54 0.00 0.00 175.26 175.37 1aco s ILE 313 N -0.11 1.34 -0.51 -3.70 1.01 0.60 -4.94 121.20 114.89 1aco s ILE 313 Ca -0.05 -0.55 -0.20 0.00 0.00 0.00 0.00 60.65 59.85 1aco s ILE 313 Cb -0.14 -1.24 0.05 0.00 0.01 0.00 0.00 42.46 41.14 1aco s ILE 313 CO 0.04 0.41 0.68 0.21 0.00 0.00 0.00 174.94 176.29 1aco s ASN 314 N 1.02 6.25 0.51 3.58 2.47 -1.26 -0.84 114.94 126.67 1aco s ASN 314 Ca -0.07 -0.78 0.19 0.00 0.42 0.00 0.00 52.86 52.63 1aco s ASN 314 Cb -0.15 -2.32 1.29 0.00 -1.45 0.00 0.00 41.25 38.62 1aco s ASN 314 CO -0.01 -0.95 2.08 -0.07 -3.72 0.00 0.00 177.10 174.43 1aco h LEU 315 N 9.93 0.04 -0.95 3.21 4.07 -1.03 -2.27 115.31 128.31 1aco h LEU 315 Ca -0.27 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.62 1aco h LEU 315 Cb 1.09 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.81 1aco h LEU 315 CO 0.98 0.03 -0.33 0.28 -1.08 0.00 0.00 178.44 178.32 1aco h SER 316 N 0.05 0.00 0.02 -0.43 0.02 -1.69 -2.91 113.55 108.61 1aco h SER 316 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1aco h SER 316 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1aco h SER 316 CO -0.01 0.33 -0.17 -0.62 -1.14 0.00 0.00 176.83 175.22 1aco n GLU 317 N -3.48 1.67 -2.43 3.45 4.71 -0.87 -4.91 120.64 118.78 1aco n GLU 317 Ca -0.00 -1.27 -0.41 0.00 -0.01 0.00 0.00 57.16 55.47 1aco n GLU 317 Cb 0.49 -1.47 -0.04 0.00 -1.01 0.00 0.00 31.44 29.41 1aco n GLU 317 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1aco s LEU 318 N -2.21 4.45 0.28 -4.62 2.96 -1.10 -5.04 118.68 113.41 1aco s LEU 318 Ca 0.27 2.15 0.10 0.00 -0.22 0.00 0.00 54.13 56.43 1aco s LEU 318 Cb 0.20 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.24 1aco s LEU 318 CO 0.42 -0.33 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.53 1aco s LYS 319 N -0.12 2.12 0.28 1.98 -0.14 -1.26 -4.75 119.74 117.84 1aco s LYS 319 Ca 0.52 -1.54 -0.30 0.00 -1.36 0.00 0.00 55.97 53.29 1aco s LYS 319 Cb -0.31 -2.04 -0.13 0.00 -1.68 0.00 0.00 37.83 33.67 1aco s LYS 319 CO 0.35 0.33 1.27 -2.30 -0.76 0.00 0.00 175.35 174.23 1aco n PRO 320 N -0.84 1.85 -4.46 -1.68 -0.02 -1.26 -4.91 135.00 123.67 1aco n PRO 320 Ca -0.06 0.65 -0.23 0.00 -2.02 0.00 0.00 63.50 61.84 1aco n PRO 320 Cb 0.60 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.76 1aco n PRO 320 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1aco s HIS 321 N -0.60 2.15 -0.12 6.00 3.76 -1.26 -0.89 115.29 124.33 1aco s HIS 321 Ca 0.63 -0.52 -0.05 0.00 -0.15 0.00 0.00 55.06 54.96 1aco s HIS 321 Cb -0.65 -1.12 0.05 0.00 1.11 0.00 0.00 32.58 31.97 1aco s HIS 321 CO 0.56 0.51 0.27 -1.50 -0.85 0.00 0.00 174.74 173.72 1aco s ILE 322 N -2.74 -0.14 0.03 0.60 2.07 0.05 -4.54 121.20 116.53 1aco s ILE 322 Ca 0.30 0.18 0.06 0.00 -1.41 0.00 0.00 60.65 59.78 1aco s ILE 322 Cb 0.00 -0.42 -0.03 0.00 0.13 0.00 0.00 42.46 42.14 1aco s ILE 322 CO 0.13 0.07 -0.17 0.20 -1.91 0.00 0.00 174.94 173.27 1aco s ASN 323 N 1.57 3.88 0.00 4.50 -0.87 0.18 -1.43 114.94 122.78 1aco s ASN 323 Ca -0.07 -0.38 0.00 0.00 -1.57 0.00 0.00 52.86 50.84 1aco s ASN 323 Cb -0.11 -0.67 0.00 0.00 -0.02 0.00 0.00 41.25 40.45 1aco s ASN 323 CO -0.09 0.27 0.00 0.61 -2.57 0.00 0.00 177.10 175.32 1aco n GLY 324 N 1.63 0.80 0.74 0.66 0.00 0.32 -0.85 105.19 108.49 1aco n GLY 324 Ca -0.16 -2.14 0.12 0.00 0.00 0.00 0.00 46.02 43.84 1aco n GLY 324 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1aco n PRO 325 N -0.87 1.93 0.00 1.61 -0.04 -1.26 -4.83 135.00 131.54 1aco n PRO 325 Ca 0.00 -1.48 0.00 0.00 -0.04 0.00 0.00 63.50 61.98 1aco n PRO 325 Cb 0.00 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 1aco n PRO 325 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1aco n PHE 326 N 0.76 0.00 -4.11 0.54 3.72 -1.26 -3.64 117.46 113.47 1aco n PHE 326 Ca 0.15 -0.03 -0.14 0.00 -0.05 0.00 0.00 57.45 57.37 1aco n PHE 326 Cb 0.51 -0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.92 1aco n PHE 326 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1aco s THR 327 N -0.06 0.56 -1.85 4.37 -4.23 -1.26 -4.00 115.64 109.16 1aco s THR 327 Ca 0.00 -0.85 0.30 0.00 -1.18 0.00 0.00 61.69 59.97 1aco s THR 327 Cb 0.00 -0.58 0.66 0.00 1.34 0.00 0.00 72.50 73.92 1aco s THR 327 CO 0.00 -0.21 2.03 -0.81 -0.54 0.00 0.00 174.62 175.09 1aco n PRO 328 N 1.90 0.89 -0.34 3.99 -0.04 -1.26 -3.48 135.00 136.65 1aco n PRO 328 Ca -0.20 -0.19 0.09 0.00 -0.04 0.00 0.00 63.50 63.16 1aco n PRO 328 Cb 0.56 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.78 1aco n PRO 328 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1aco n ASP 329 N -0.89 3.70 -4.39 3.54 5.75 -1.26 -4.71 116.55 118.30 1aco n ASP 329 Ca 0.19 -2.14 -0.45 0.00 -0.01 0.00 0.00 54.79 52.38 1aco n ASP 329 Cb 0.21 -0.41 -0.03 0.00 -1.03 0.00 0.00 41.12 39.86 1aco n ASP 329 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1aco s LEU 330 N -1.26 5.57 -0.15 -2.12 0.20 -1.25 -4.10 118.68 115.56 1aco s LEU 330 Ca 0.39 -1.86 -0.11 0.00 0.69 0.00 0.00 54.13 53.24 1aco s LEU 330 Cb 0.22 -2.31 -0.05 0.00 -0.43 0.00 0.00 46.19 43.62 1aco s LEU 330 CO 0.24 -1.00 0.22 0.00 -0.29 0.00 0.00 176.35 175.52 1aco s ALA 331 N 2.18 3.69 0.02 5.97 0.00 -1.26 -0.53 121.76 131.83 1aco s ALA 331 Ca 0.19 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.65 1aco s ALA 331 Cb -0.16 -2.24 -0.02 0.00 0.00 0.00 0.00 23.12 20.71 1aco s ALA 331 CO -0.01 0.25 -0.12 -1.01 0.00 0.00 0.00 175.76 174.87 1aco s HIS 332 N -0.00 1.09 0.54 0.00 0.09 -0.51 -4.99 115.29 111.50 1aco s HIS 332 Ca 0.14 -0.29 -0.22 0.00 -0.00 0.00 0.00 55.06 54.69 1aco s HIS 332 Cb -0.13 -0.67 -0.05 0.00 -0.00 0.00 0.00 32.58 31.74 1aco s HIS 332 CO 0.03 0.01 1.32 -2.14 -0.00 0.00 0.00 174.74 173.95 1aco s PRO 333 N -0.79 3.22 0.28 8.40 0.02 -1.26 -0.77 135.00 144.11 1aco s PRO 333 Ca 0.02 2.14 -0.03 0.00 0.02 0.00 0.00 61.00 63.14 1aco s PRO 333 Cb -0.06 -2.26 0.39 0.00 0.02 0.00 0.00 34.50 32.58 1aco s PRO 333 CO 0.00 -1.09 1.96 0.28 -0.33 0.00 0.00 177.00 177.82 1aco h VAL 334 N 1.47 1.22 -0.52 3.83 2.07 -1.29 -0.29 116.25 122.74 1aco h VAL 334 Ca -0.51 -0.41 0.15 0.00 0.82 0.00 0.00 66.70 66.75 1aco h VAL 334 Cb 1.29 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1aco h VAL 334 CO 0.58 0.22 0.51 0.00 0.02 0.00 0.00 177.57 178.89 1aco h ALA 335 N 1.45 2.28 -0.00 1.67 0.00 -1.91 -2.58 119.26 120.17 1aco h ALA 335 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1aco h ALA 335 Cb -0.13 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1aco h ALA 335 CO -0.07 -0.77 -0.22 0.39 0.00 0.00 0.00 179.25 178.58 1aco n GLU 336 N -3.81 3.61 0.00 0.00 1.02 -0.17 -4.66 120.64 116.64 1aco n GLU 336 Ca 0.10 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1aco n GLU 336 Cb 0.71 -0.89 0.31 0.00 -0.02 0.00 0.00 31.44 31.55 1aco n GLU 336 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1aco h VAL 337 N 0.37 1.19 -1.00 2.62 3.04 -0.99 -1.99 116.25 119.49 1aco h VAL 337 Ca 0.00 -0.74 0.13 0.00 -1.01 0.00 0.00 66.70 65.08 1aco h VAL 337 Cb 0.19 0.92 -0.09 0.00 -2.01 0.00 0.00 31.29 30.31 1aco h VAL 337 CO 0.00 0.25 0.63 1.23 -1.01 0.00 0.00 177.57 178.67 1aco h GLY 338 N 0.81 1.62 1.43 3.17 0.00 -1.74 0.25 103.07 108.61 1aco h GLY 338 Ca 0.11 -0.41 -0.23 0.00 0.00 0.00 0.00 47.33 46.79 1aco h GLY 338 CO 0.01 0.14 -1.32 1.76 0.00 0.00 0.00 176.54 177.13 1aco h SER 339 N 0.96 0.00 0.09 0.19 0.02 -1.71 -3.10 113.55 109.99 1aco h SER 339 Ca 0.50 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.26 1aco h SER 339 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1aco h SER 339 CO -0.27 0.90 -0.72 0.58 -1.14 0.00 0.00 176.83 176.18 1aco h VAL 340 N 0.00 1.34 -0.44 2.27 2.07 -0.91 -2.31 116.25 118.25 1aco h VAL 340 Ca -0.15 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 65.34 1aco h VAL 340 Cb 1.82 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 33.59 1aco h VAL 340 CO 0.09 0.63 0.28 0.00 0.02 0.00 0.00 177.57 178.59 1aco h ALA 341 N 0.81 0.56 0.03 1.67 0.00 -1.06 0.10 119.26 121.37 1aco h ALA 341 Ca -0.03 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1aco h ALA 341 Cb 1.31 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1aco h ALA 341 CO 0.13 0.03 -0.13 1.49 0.00 0.00 0.00 179.25 180.78 1aco h GLU 342 N 0.60 -0.23 -0.64 0.00 4.81 -1.53 0.47 114.58 118.06 1aco h GLU 342 Ca 0.16 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1aco h GLU 342 Cb -0.04 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 1aco h GLU 342 CO -0.03 -0.15 0.19 -0.22 -0.73 0.00 0.00 179.01 178.07 1aco h LYS 343 N -0.23 0.97 -0.01 1.92 3.64 -1.13 -3.13 116.57 118.60 1aco h LYS 343 Ca 0.04 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1aco h LYS 343 Cb 0.28 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1aco h LYS 343 CO -0.11 0.84 -0.24 -1.91 -2.27 0.00 0.00 179.45 175.76 1aco n GLU 344 N -4.27 1.01 -1.84 1.90 4.07 0.33 -4.93 120.64 116.91 1aco n GLU 344 Ca 0.05 -0.63 -0.04 0.00 -0.06 0.00 0.00 57.16 56.49 1aco n GLU 344 Cb 0.22 -1.49 -0.01 0.00 -0.06 0.00 0.00 31.44 30.10 1aco n GLU 344 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1aco n GLY 345 N 1.32 0.32 3.74 8.31 0.00 0.04 -5.02 105.19 113.91 1aco n GLY 345 Ca 0.13 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 1aco n GLY 345 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1aco s TRP 346 N -2.19 3.76 0.10 1.61 0.51 -0.52 -5.00 118.94 117.21 1aco s TRP 346 Ca 0.00 1.57 -0.35 0.00 -2.12 0.00 0.00 56.10 55.21 1aco s TRP 346 Cb 0.00 -2.90 -0.14 0.00 -0.81 0.00 0.00 33.47 29.62 1aco s TRP 346 CO 0.00 0.25 1.59 -2.30 -0.51 0.00 0.00 176.95 175.98 1aco n PRO 347 N 2.82 1.97 0.06 4.98 -0.02 -1.26 -4.53 135.00 139.02 1aco n PRO 347 Ca -0.01 0.71 -0.07 0.00 -2.02 0.00 0.00 63.50 62.12 1aco n PRO 347 Cb 0.50 -2.47 -0.12 0.00 -0.02 0.00 0.00 33.50 31.39 1aco n PRO 347 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1aco h LEU 348 N 6.22 0.00 -9.50 2.45 -0.00 -1.94 -3.42 115.31 109.11 1aco h LEU 348 Ca -0.46 0.00 -0.54 0.00 -0.00 0.00 0.00 57.88 56.88 1aco h LEU 348 Cb 1.27 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.89 1aco h LEU 348 CO 0.88 0.98 0.20 1.51 -0.00 0.00 0.00 178.44 182.02 1aco s ASP 349 N -6.65 7.24 -0.30 -0.43 -4.77 -1.26 -1.06 116.67 109.45 1aco s ASP 349 Ca 0.01 1.49 -0.15 0.00 -3.30 0.00 0.00 52.55 50.59 1aco s ASP 349 Cb 0.10 -2.49 -0.03 0.00 -1.09 0.00 0.00 42.92 39.41 1aco s ASP 349 CO 0.82 -0.04 0.37 -0.63 0.70 0.00 0.00 175.17 176.39 1aco s ILE 350 N 0.18 5.16 -0.07 2.11 1.01 -0.79 -3.91 121.20 124.89 1aco s ILE 350 Ca 0.41 0.40 -0.22 0.00 0.00 0.00 0.00 60.65 61.24 1aco s ILE 350 Cb -0.21 -3.75 -0.30 0.00 0.01 0.00 0.00 42.46 38.22 1aco s ILE 350 CO 0.24 0.06 0.82 0.03 0.00 0.00 0.00 174.94 176.09 1aco h ARG 351 N 8.28 0.26 -4.10 2.79 2.47 -1.29 -3.41 114.38 119.40 1aco h ARG 351 Ca -0.31 -0.45 -0.31 0.00 -1.26 0.00 0.00 59.98 57.65 1aco h ARG 351 Cb 1.16 0.17 -0.29 0.00 -1.65 0.00 0.00 29.97 29.35 1aco h ARG 351 CO 0.66 1.22 -0.75 0.08 0.56 0.00 0.00 179.97 181.74 1aco s VAL 352 N -2.42 0.29 -0.17 2.04 1.01 -1.26 -0.82 120.40 119.07 1aco s VAL 352 Ca -0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 1aco s VAL 352 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 1aco s VAL 352 CO 0.81 0.10 -0.10 -0.83 0.00 0.00 0.00 175.10 175.07 1aco s GLY 353 N 0.06 1.56 -0.16 4.51 0.00 0.02 -1.96 107.32 111.35 1aco s GLY 353 Ca -0.00 -1.04 0.01 0.00 0.00 0.00 0.00 44.72 43.68 1aco s GLY 353 CO -0.00 0.13 -0.16 1.08 0.00 0.00 0.00 173.10 174.14 1aco s LEU 354 N 0.93 1.84 0.16 0.66 1.02 -0.19 -1.37 118.68 121.73 1aco s LEU 354 Ca -0.02 -0.55 0.06 0.00 0.02 0.00 0.00 54.13 53.65 1aco s LEU 354 Cb -0.15 -1.28 -0.04 0.00 0.02 0.00 0.00 46.19 44.75 1aco s LEU 354 CO -0.00 -0.04 0.04 0.27 0.02 0.00 0.00 176.35 176.64 1aco s ILE 355 N 1.42 4.00 0.00 -0.59 -4.36 -0.67 -1.13 121.20 119.87 1aco s ILE 355 Ca 0.05 -1.26 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 1aco s ILE 355 Cb -0.13 -3.01 0.00 0.00 1.25 0.00 0.00 42.46 40.57 1aco s ILE 355 CO -0.11 -0.08 0.00 0.61 0.24 0.00 0.00 174.94 175.60 1aco n GLY 356 N -0.10 0.20 0.42 6.27 0.00 -1.18 -0.96 105.19 109.84 1aco n GLY 356 Ca -0.09 -1.99 0.06 0.00 0.00 0.00 0.00 46.02 43.99 1aco n GLY 356 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1aco n SER 357 N 0.00 -2.50 0.28 1.61 3.41 -1.26 -3.49 113.62 111.67 1aco n SER 357 Ca 0.00 0.24 0.16 0.00 -0.26 0.00 0.00 58.87 59.01 1aco n SER 357 Cb 0.00 -1.31 0.83 0.00 -0.26 0.00 0.00 64.21 63.47 1aco n SER 357 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aco h THR 359 N 0.00 1.24 -0.19 0.00 2.02 -1.85 -3.39 112.91 110.75 1aco h THR 359 Ca -0.00 -1.93 -0.26 0.00 0.77 0.00 0.00 66.41 64.98 1aco h THR 359 Cb 0.27 2.08 -0.17 0.00 -1.74 0.00 0.00 68.15 68.59 1aco h THR 359 CO 0.01 0.53 -0.51 0.59 0.37 0.00 0.00 175.52 176.51 1aco n ASN 360 N -3.69 -2.00 -0.83 4.18 5.03 -0.94 -4.51 115.26 112.49 1aco n ASN 360 Ca -0.01 -3.55 0.05 0.00 0.87 0.00 0.00 54.58 51.94 1aco n ASN 360 Cb 0.59 1.62 0.10 0.00 -1.02 0.00 0.00 39.78 41.07 1aco n ASN 360 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1aco n SER 361 N 0.28 1.29 -4.87 6.41 3.41 -1.12 -3.10 113.62 115.92 1aco n SER 361 Ca 0.07 -2.82 -0.30 0.00 -0.26 0.00 0.00 58.87 55.56 1aco n SER 361 Cb 0.71 -0.38 0.05 0.00 -0.26 0.00 0.00 64.21 64.33 1aco n SER 361 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1aco s SER 362 N -2.41 5.31 0.22 4.04 1.04 -1.26 -3.26 113.70 117.39 1aco s SER 362 Ca 0.30 1.19 -0.07 0.00 0.48 0.00 0.00 55.95 57.84 1aco s SER 362 Cb 0.31 -1.99 0.34 0.00 0.10 0.00 0.00 66.02 64.79 1aco s SER 362 CO -0.08 -1.43 1.74 0.22 0.98 0.00 0.00 173.24 174.67 1aco h TYR 363 N -0.72 0.46 -0.80 5.02 3.20 -1.94 -0.65 116.97 121.54 1aco h TYR 363 Ca -0.45 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 1aco h TYR 363 Cb 1.25 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.38 1aco h TYR 363 CO 0.51 0.10 0.46 1.49 -1.64 0.00 0.00 178.16 179.07 1aco h GLU 364 N 0.45 1.11 -0.33 1.82 4.81 -1.73 -0.94 114.58 119.77 1aco h GLU 364 Ca 0.35 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1aco h GLU 364 Cb 0.45 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1aco h GLU 364 CO -0.33 0.81 0.07 -0.44 -0.73 0.00 0.00 179.01 178.38 1aco h ASP 365 N 1.11 0.50 -0.45 1.04 3.32 -1.70 0.03 116.42 120.27 1aco h ASP 365 Ca 0.28 -0.24 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1aco h ASP 365 Cb 0.01 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1aco h ASP 365 CO -0.05 0.61 0.12 0.24 -1.72 0.00 0.00 179.24 178.44 1aco h MET 366 N 0.37 0.79 -0.24 3.56 2.86 -1.08 -1.15 114.93 120.04 1aco h MET 366 Ca 0.10 -0.16 -0.19 0.00 -2.06 0.00 0.00 59.70 57.40 1aco h MET 366 Cb 0.31 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1aco h MET 366 CO 0.00 0.71 -0.60 0.78 1.06 0.00 0.00 176.91 178.87 1aco h GLY 367 N 0.94 0.86 0.91 8.32 0.00 -0.84 -0.52 103.07 112.74 1aco h GLY 367 Ca 0.17 -1.04 -0.04 0.00 0.00 0.00 0.00 47.33 46.41 1aco h GLY 367 CO -0.00 0.93 0.05 3.21 0.00 0.00 0.00 176.54 180.73 1aco h ARG 368 N 0.59 0.58 -0.65 4.80 3.08 -0.71 -0.33 114.38 121.74 1aco h ARG 368 Ca -0.00 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 1aco h ARG 368 Cb 1.19 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.15 1aco h ARG 368 CO 0.13 0.66 0.32 0.77 -1.07 0.00 0.00 179.97 180.78 1aco h SER 369 N 0.41 0.84 -0.02 7.04 0.02 -1.22 -2.55 113.55 118.07 1aco h SER 369 Ca 0.11 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1aco h SER 369 Cb 0.37 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1aco h SER 369 CO 0.01 0.72 -0.05 0.00 -1.14 0.00 0.00 176.83 176.37 1aco h ALA 370 N 1.15 1.65 -0.10 3.77 0.00 -0.83 -1.77 119.26 123.14 1aco h ALA 370 Ca 0.22 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1aco h ALA 370 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1aco h ALA 370 CO -0.03 0.26 -0.34 0.00 0.00 0.00 0.00 179.25 179.13 1aco h ALA 371 N 1.75 1.24 -0.02 0.00 0.00 -0.66 0.88 119.26 122.45 1aco h ALA 371 Ca 0.05 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 1aco h ALA 371 Cb 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1aco h ALA 371 CO 0.01 0.52 -0.24 0.28 0.00 0.00 0.00 179.25 179.82 1aco h VAL 372 N 0.17 1.51 -0.75 0.00 2.07 -1.12 -3.32 116.25 114.80 1aco h VAL 372 Ca 0.02 -1.82 -0.00 0.00 0.82 0.00 0.00 66.70 65.72 1aco h VAL 372 Cb 0.69 2.61 -0.04 0.00 -1.52 0.00 0.00 31.29 33.03 1aco h VAL 372 CO 0.05 0.50 0.45 0.00 0.02 0.00 0.00 177.57 178.60 1aco h ALA 373 N 0.32 0.95 -0.01 1.67 0.00 -1.20 -2.33 119.26 118.66 1aco h ALA 373 Ca -0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1aco h ALA 373 Cb 0.95 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1aco h ALA 373 CO 0.05 0.41 -0.08 1.57 0.00 0.00 0.00 179.25 181.20 1aco h LYS 374 N 1.02 0.01 -0.39 0.00 5.09 -0.94 -1.51 116.57 119.85 1aco h LYS 374 Ca 0.27 -0.00 -0.13 0.00 0.09 0.00 0.00 60.65 60.87 1aco h LYS 374 Cb -0.04 -0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.27 1aco h LYS 374 CO -0.05 0.10 -0.28 1.96 -2.09 0.00 0.00 179.45 179.08 1aco h GLN 375 N 0.01 0.83 -0.25 0.07 4.20 -1.52 -0.74 115.11 117.71 1aco h GLN 375 Ca 0.00 -0.37 -0.06 0.00 0.06 0.00 0.00 58.65 58.28 1aco h GLN 375 Cb 0.15 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1aco h GLN 375 CO 0.01 1.01 -0.09 0.00 -0.67 0.00 0.00 178.83 179.09 1aco h ALA 376 N 0.97 0.35 -0.76 3.87 0.00 -1.16 -3.03 119.26 119.51 1aco h ALA 376 Ca 0.08 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1aco h ALA 376 Cb 0.83 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1aco h ALA 376 CO 0.07 0.19 0.46 -0.07 0.00 0.00 0.00 179.25 179.90 1aco h LEU 377 N 0.24 0.72 -2.10 0.00 3.38 -1.12 -0.69 115.31 115.73 1aco h LEU 377 Ca 0.06 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.13 1aco h LEU 377 Cb 0.58 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1aco h LEU 377 CO 0.03 0.48 0.27 0.00 0.09 0.00 0.00 178.44 179.31 1aco h ALA 378 N 1.35 2.07 -0.65 1.53 0.00 -1.08 0.01 119.26 122.50 1aco h ALA 378 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1aco h ALA 378 Cb 0.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1aco h ALA 378 CO -0.15 -0.43 0.00 0.72 0.00 0.00 0.00 179.25 179.39 1aco n HIS 379 N -4.03 1.38 -2.17 0.00 8.25 -0.39 -4.96 115.22 113.30 1aco n HIS 379 Ca 0.04 -0.60 -0.11 0.00 -0.26 0.00 0.00 57.72 56.80 1aco n HIS 379 Cb 0.43 -0.21 -0.01 0.00 1.12 0.00 0.00 29.99 31.33 1aco n HIS 379 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1aco n GLY 380 N 1.16 -0.03 3.79 -1.41 0.00 -0.01 -0.61 105.19 108.08 1aco n GLY 380 Ca 0.25 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 1aco n GLY 380 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aco s LEU 381 N -3.02 3.70 0.32 0.99 1.43 -0.50 -4.54 118.68 117.06 1aco s LEU 381 Ca 0.00 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 1aco s LEU 381 Cb 0.00 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 1aco s LEU 381 CO 0.00 -0.02 0.13 -0.54 0.23 0.00 0.00 176.35 176.15 1aco s LYS 382 N -3.76 1.63 0.34 1.70 1.02 -1.26 -3.80 119.74 115.62 1aco s LYS 382 Ca 0.32 -1.93 -0.29 0.00 0.02 0.00 0.00 55.97 54.09 1aco s LYS 382 Cb -0.08 -0.33 -0.11 0.00 -0.52 0.00 0.00 37.83 36.79 1aco s LYS 382 CO 0.24 -0.39 1.45 0.00 -0.92 0.00 0.00 175.35 175.72 1aco h LYS 384 N 3.53 0.17 -7.46 0.00 3.64 -1.02 -3.46 116.57 111.97 1aco h LYS 384 Ca -0.49 -0.30 -0.48 0.00 -1.27 0.00 0.00 60.65 58.11 1aco h LYS 384 Cb 1.23 0.11 0.10 0.00 -0.41 0.00 0.00 32.23 33.27 1aco h LYS 384 CO 0.68 1.14 0.36 -1.12 -2.27 0.00 0.00 179.45 178.24 1aco s SER 385 N -6.82 4.62 0.64 4.20 0.01 -0.46 -4.97 113.70 110.92 1aco s SER 385 Ca -0.19 1.17 -0.16 0.00 1.31 0.00 0.00 55.95 58.08 1aco s SER 385 Cb 0.02 -1.88 -0.01 0.00 0.21 0.00 0.00 66.02 64.36 1aco s SER 385 CO 0.74 -1.87 1.15 -1.58 0.41 0.00 0.00 173.24 172.09 1aco s GLN 386 N -5.26 2.77 -0.12 12.44 0.74 -0.00 -4.87 119.66 125.37 1aco s GLN 386 Ca 0.61 1.58 -0.04 0.00 0.05 0.00 0.00 55.36 57.56 1aco s GLN 386 Cb -0.13 -1.93 0.06 0.00 1.10 0.00 0.00 33.01 32.10 1aco s GLN 386 CO 0.53 -1.31 0.17 0.12 -0.55 0.00 0.00 175.29 174.25 1aco s PHE 387 N -2.05 -0.17 0.18 1.67 5.36 -1.26 -0.80 117.98 120.92 1aco s PHE 387 Ca 0.71 0.46 0.09 0.00 -0.96 0.00 0.00 56.93 57.23 1aco s PHE 387 Cb -0.24 -0.32 -0.04 0.00 -0.34 0.00 0.00 43.02 42.08 1aco s PHE 387 CO 0.38 -0.36 -0.08 0.95 -1.46 0.00 0.00 175.22 174.66 1aco s THR 388 N 2.29 3.29 -0.08 0.12 -4.23 -0.47 -1.14 115.64 115.41 1aco s THR 388 Ca 0.04 -1.63 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 1aco s THR 388 Cb -0.13 -2.64 0.03 0.00 1.34 0.00 0.00 72.50 71.10 1aco s THR 388 CO -0.07 -0.12 -0.02 -0.63 -0.54 0.00 0.00 174.62 173.24 1aco s ILE 389 N -1.73 0.55 -0.36 2.99 1.01 0.06 -1.66 121.20 122.06 1aco s ILE 389 Ca 0.26 0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.82 1aco s ILE 389 Cb -0.09 -0.67 0.04 0.00 0.01 0.00 0.00 42.46 41.76 1aco s ILE 389 CO 0.16 0.29 0.16 -0.89 0.00 0.00 0.00 174.94 174.66 1aco s THR 390 N 1.83 4.15 0.37 2.92 2.01 -0.13 -0.61 115.64 126.17 1aco s THR 390 Ca 0.04 -1.06 -0.27 0.00 0.31 0.00 0.00 61.69 60.71 1aco s THR 390 Cb -0.12 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 68.94 1aco s THR 390 CO -0.06 -0.24 1.28 -2.84 -0.69 0.00 0.00 174.62 172.08 1aco s PRO 391 N 1.46 4.15 0.41 4.92 0.02 -1.26 -4.06 135.00 140.63 1aco s PRO 391 Ca 0.00 2.14 0.21 0.00 0.02 0.00 0.00 61.00 63.37 1aco s PRO 391 Cb -0.20 -2.88 0.79 0.00 0.02 0.00 0.00 34.50 32.23 1aco s PRO 391 CO 0.04 -0.34 1.78 0.78 -0.33 0.00 0.00 177.00 178.93 1aco h GLY 392 N 2.98 0.00 -1.91 0.52 0.00 -1.86 -3.38 103.07 99.42 1aco h GLY 392 Ca -0.49 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.86 1aco h GLY 392 CO 0.64 0.00 0.15 -1.35 0.00 0.00 0.00 176.54 175.97 1aco s SER 393 N -6.32 -0.14 0.23 0.19 1.04 -1.26 -0.32 113.70 107.12 1aco s SER 393 Ca 0.00 -0.79 -0.02 0.00 0.48 0.00 0.00 55.95 55.62 1aco s SER 393 Cb 0.11 0.72 0.25 0.00 0.10 0.00 0.00 66.02 67.20 1aco s SER 393 CO 0.66 -1.36 1.66 -0.08 0.98 0.00 0.00 173.24 175.11 1aco h GLU 394 N 2.06 0.70 0.10 4.02 4.57 -1.40 -1.17 114.58 123.46 1aco h GLU 394 Ca -0.23 -0.27 -0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1aco h GLU 394 Cb 1.25 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1aco h GLU 394 CO 0.29 0.86 -0.07 0.37 -1.18 0.00 0.00 179.01 179.28 1aco h GLN 395 N 0.62 -0.16 -0.46 1.92 4.15 -1.76 0.63 115.11 120.04 1aco h GLN 395 Ca 0.09 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.52 1aco h GLN 395 Cb 0.69 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.40 1aco h GLN 395 CO 0.05 -0.11 0.29 0.82 -1.93 0.00 0.00 178.83 177.96 1aco h ILE 396 N -0.17 1.13 0.07 2.39 2.04 -1.77 -0.52 117.51 120.68 1aco h ILE 396 Ca -0.00 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.62 1aco h ILE 396 Cb 0.15 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 1aco h ILE 396 CO -0.00 0.12 -0.16 -0.09 0.00 0.00 0.00 178.15 178.02 1aco h ARG 397 N 0.61 -0.29 -0.98 2.37 2.43 -1.10 0.10 114.38 117.52 1aco h ARG 397 Ca 0.17 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1aco h ARG 397 Cb -0.05 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.52 1aco h ARG 397 CO -0.03 -0.20 0.64 0.00 -1.51 0.00 0.00 179.97 178.87 1aco h ALA 398 N 0.56 1.29 -0.11 2.80 0.00 -0.77 -1.75 119.26 121.28 1aco h ALA 398 Ca 0.03 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 1aco h ALA 398 Cb 0.33 -0.40 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1aco h ALA 398 CO -0.10 0.66 -0.84 1.15 0.00 0.00 0.00 179.25 180.11 1aco h THR 399 N 1.33 1.28 0.00 0.00 2.02 -0.82 -1.19 112.91 115.53 1aco h THR 399 Ca 0.36 -2.04 -0.02 0.00 0.77 0.00 0.00 66.41 65.48 1aco h THR 399 Cb -0.14 2.09 -0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1aco h THR 399 CO -0.08 0.64 -0.11 0.16 0.37 0.00 0.00 175.52 176.50 1aco h ILE 400 N 0.49 0.26 -0.01 3.11 3.07 -0.71 0.81 117.51 124.54 1aco h ILE 400 Ca -0.07 -0.92 -0.00 0.00 1.55 0.00 0.00 64.86 65.41 1aco h ILE 400 Cb 1.48 1.75 -0.00 0.00 -0.27 0.00 0.00 36.82 39.77 1aco h ILE 400 CO 0.17 0.11 -0.01 -0.08 -1.05 0.00 0.00 178.15 177.30 1aco h GLU 401 N 0.00 0.01 -0.49 0.16 4.57 -1.23 0.04 114.58 117.65 1aco h GLU 401 Ca -0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1aco h GLU 401 Cb 0.74 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.30 1aco h GLU 401 CO 0.01 0.52 0.30 -0.09 -1.18 0.00 0.00 179.01 178.58 1aco h ARG 402 N -0.49 0.65 -0.23 1.92 1.12 -0.70 -2.62 114.38 114.03 1aco h ARG 402 Ca 0.00 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.82 1aco h ARG 402 Cb 0.52 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.34 1aco h ARG 402 CO 0.00 0.46 0.00 -0.25 -3.11 0.00 0.00 179.97 177.07 1aco n ASP 403 N -4.72 1.35 0.00 -3.80 8.00 0.23 -4.90 116.55 112.71 1aco n ASP 403 Ca 0.02 -1.93 0.00 0.00 0.71 0.00 0.00 54.79 53.59 1aco n ASP 403 Cb 0.04 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 1aco n ASP 403 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aco n GLY 404 N 0.93 0.78 0.14 0.44 0.00 -0.99 -4.93 105.19 101.57 1aco n GLY 404 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 1aco n GLY 404 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1aco h TYR 405 N 0.00 0.56 -0.57 1.61 0.05 -1.26 -3.17 116.97 114.19 1aco h TYR 405 Ca 0.00 -0.32 -0.04 0.00 0.05 0.00 0.00 58.73 58.42 1aco h TYR 405 Cb 0.00 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 1aco h TYR 405 CO 0.00 1.16 0.21 0.00 -1.05 0.00 0.00 178.16 178.47 1aco h ALA 406 N 0.74 0.75 -0.41 3.88 0.00 -1.65 -2.34 119.26 120.22 1aco h ALA 406 Ca -0.09 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1aco h ALA 406 Cb 1.64 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1aco h ALA 406 CO 0.17 0.38 0.03 0.37 0.00 0.00 0.00 179.25 180.20 1aco h GLN 407 N 0.79 0.63 -0.54 0.00 5.75 -1.82 0.38 115.11 120.30 1aco h GLN 407 Ca 0.19 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.53 1aco h GLN 407 Cb 0.24 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.67 1aco h GLN 407 CO -0.01 0.63 0.26 0.28 -2.65 0.00 0.00 178.83 177.34 1aco h VAL 408 N 0.61 1.20 -0.39 2.39 2.07 -1.46 0.17 116.25 120.84 1aco h VAL 408 Ca 0.13 -0.57 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 1aco h VAL 408 Cb 0.34 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1aco h VAL 408 CO 0.01 0.23 -0.28 -0.07 0.02 0.00 0.00 177.57 177.48 1aco h LEU 409 N 0.73 0.84 -0.24 2.57 3.38 -1.07 -1.73 115.31 119.79 1aco h LEU 409 Ca 0.19 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1aco h LEU 409 Cb 0.12 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1aco h LEU 409 CO -0.02 1.07 0.07 0.03 0.09 0.00 0.00 178.44 179.67 1aco h ARG 410 N 0.70 0.39 -0.28 1.13 3.08 -0.51 -1.18 114.38 117.70 1aco h ARG 410 Ca 0.08 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1aco h ARG 410 Cb 0.81 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 1aco h ARG 410 CO 0.07 0.48 0.10 -0.44 -1.07 0.00 0.00 179.97 179.11 1aco h ASP 411 N 0.23 0.35 0.20 7.04 3.32 -0.33 -0.73 116.42 126.49 1aco h ASP 411 Ca 0.08 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1aco h ASP 411 Cb 0.26 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1aco h ASP 411 CO -0.00 0.33 0.00 1.33 -1.72 0.00 0.00 179.24 179.17 1aco n VAL 412 N -4.42 0.17 0.00 -1.35 0.24 -0.68 -4.85 118.33 107.45 1aco n VAL 412 Ca 0.01 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 1aco n VAL 412 Cb 0.13 -0.69 0.00 0.00 -1.47 0.00 0.00 33.84 31.81 1aco n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aco n GLY 413 N 0.46 1.48 3.89 7.63 0.00 -0.29 -0.33 105.19 118.04 1aco n GLY 413 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1aco n GLY 413 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aco s GLY 414 N -2.00 1.96 -0.15 -0.02 0.00 -0.45 -4.35 107.32 102.30 1aco s GLY 414 Ca 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 44.72 44.31 1aco s GLY 414 CO 0.00 -0.26 -0.11 -1.50 0.00 0.00 0.00 173.10 171.23 1aco s ILE 415 N -2.12 3.15 -0.28 0.90 1.10 -0.29 -4.42 121.20 119.23 1aco s ILE 415 Ca 0.47 -0.61 -0.22 0.00 -0.51 0.00 0.00 60.65 59.78 1aco s ILE 415 Cb -0.11 -2.35 -0.01 0.00 0.15 0.00 0.00 42.46 40.14 1aco s ILE 415 CO 0.29 0.50 0.69 -0.69 -2.11 0.00 0.00 174.94 173.62 1aco s VAL 416 N 0.65 4.91 0.63 4.00 1.01 -1.26 -0.76 120.40 129.57 1aco s VAL 416 Ca -0.06 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 63.04 1aco s VAL 416 Cb -0.15 -4.03 0.06 0.00 0.00 0.00 0.00 36.38 32.26 1aco s VAL 416 CO 0.03 -0.10 0.89 -0.76 0.00 0.00 0.00 175.10 175.16 1aco s LEU 417 N 2.68 3.09 1.02 3.92 1.43 0.22 -0.67 118.68 130.36 1aco s LEU 417 Ca 0.28 0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.32 1aco s LEU 417 Cb -0.15 -2.77 0.20 0.00 0.03 0.00 0.00 46.19 43.50 1aco s LEU 417 CO 0.10 -1.42 1.08 0.00 0.23 0.00 0.00 176.35 176.34 1aco s ALA 418 N -2.98 0.66 -1.25 4.21 0.00 -1.26 -4.35 121.76 116.78 1aco s ALA 418 Ca 0.60 0.06 -0.17 0.00 0.00 0.00 0.00 51.96 52.45 1aco s ALA 418 Cb -0.09 -3.28 0.09 0.00 0.00 0.00 0.00 23.12 19.84 1aco s ALA 418 CO 0.41 -3.10 1.64 -0.80 0.00 0.00 0.00 175.76 173.91 1aco s ASN 419 N -2.86 6.87 0.13 0.00 0.01 -1.26 -4.55 114.94 113.28 1aco s ASN 419 Ca 0.66 -2.52 -0.24 0.00 -0.71 0.00 0.00 52.86 50.05 1aco s ASN 419 Cb -0.22 -2.53 0.07 0.00 0.41 0.00 0.00 41.25 38.98 1aco s ASN 419 CO 0.60 -1.09 0.72 0.00 -1.51 0.00 0.00 177.10 175.83 1aco s ALA 420 N 3.61 -1.61 0.16 0.60 0.00 -1.26 -3.54 121.76 119.71 1aco s ALA 420 Ca 0.50 0.49 -0.19 0.00 0.00 0.00 0.00 51.96 52.76 1aco s ALA 420 Cb 0.02 0.74 0.06 0.00 0.00 0.00 0.00 23.12 23.94 1aco s ALA 420 CO 0.05 -0.81 1.66 0.00 0.00 0.00 0.00 175.76 176.66 1aco n GLY 422 N -1.33 3.77 0.32 0.00 0.00 -1.25 -1.55 105.19 105.15 1aco n GLY 422 Ca 0.01 0.10 0.16 0.00 0.00 0.00 0.00 46.02 46.29 1aco n GLY 422 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1aco h PRO 423 N 0.00 0.00 -0.63 1.61 0.11 -1.88 -0.65 132.00 130.57 1aco h PRO 423 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1aco h PRO 423 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1aco h PRO 423 CO 0.00 0.00 0.37 0.00 -0.21 0.00 0.00 178.00 178.16 1aco n ILE 425 N -4.40 2.67 -0.97 0.00 -6.64 -0.86 -4.72 119.36 104.44 1aco n ILE 425 Ca 0.06 -2.12 0.00 0.00 -1.77 0.00 0.00 62.75 58.93 1aco n ILE 425 Cb 0.08 -0.33 0.00 0.00 -1.44 0.00 0.00 39.64 37.94 1aco n ILE 425 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1aco n GLY 426 N -0.70 0.40 3.31 3.28 0.00 -0.76 -2.20 105.19 108.52 1aco n GLY 426 Ca 0.36 -1.05 -0.44 0.00 0.00 0.00 0.00 46.02 44.88 1aco n GLY 426 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1aco n GLN 427 N -2.97 3.59 -3.61 1.61 1.13 -0.31 -4.55 117.38 112.27 1aco n GLN 427 Ca 0.00 -4.17 -0.09 0.00 -1.94 0.00 0.00 57.00 50.80 1aco n GLN 427 Cb 0.00 -2.76 -0.10 0.00 0.11 0.00 0.00 30.24 27.49 1aco n GLN 427 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 1aco s TRP 428 N -0.27 -0.74 -1.24 1.08 -0.00 -1.26 -0.68 118.94 115.83 1aco s TRP 428 Ca 0.36 1.32 -0.15 0.00 -0.00 0.00 0.00 56.10 57.63 1aco s TRP 428 Cb -0.04 0.20 0.14 0.00 -0.00 0.00 0.00 33.47 33.77 1aco s TRP 428 CO -0.02 -0.50 1.54 0.34 -0.00 0.00 0.00 176.95 178.31 1aco s ASP 429 N 2.57 7.00 -0.21 5.86 2.15 -0.08 -4.93 116.67 129.03 1aco s ASP 429 Ca 0.01 -2.82 -0.26 0.00 0.43 0.00 0.00 52.55 49.91 1aco s ASP 429 Cb -0.13 -2.46 -0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1aco s ASP 429 CO -0.12 -0.89 0.90 -0.60 -0.17 0.00 0.00 175.17 174.29 1aco s ARG 430 N 2.45 4.25 0.00 4.34 6.06 -1.26 -4.86 118.95 129.93 1aco s ARG 430 Ca 0.47 1.10 0.00 0.00 -2.50 0.00 0.00 55.73 54.80 1aco s ARG 430 Cb -0.01 -3.62 0.00 0.00 0.06 0.00 0.00 34.95 31.39 1aco s ARG 430 CO 0.03 -0.48 0.12 1.63 -2.50 0.00 0.00 175.30 174.09 1aco n LYS 431 N 5.81 3.99 0.05 5.12 4.76 -1.26 -4.72 118.16 131.91 1aco n LYS 431 Ca 0.07 -0.12 0.09 0.00 -2.87 0.00 0.00 58.31 55.49 1aco n LYS 431 Cb 0.48 -0.56 0.39 0.00 -1.84 0.00 0.00 35.03 33.50 1aco n LYS 431 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1aco n ASP 432 N -0.60 0.26 -4.27 4.39 5.75 -1.26 -4.77 116.55 116.05 1aco n ASP 432 Ca 0.00 0.56 -0.15 0.00 -0.01 0.00 0.00 54.79 55.19 1aco n ASP 432 Cb 0.01 -0.62 -0.10 0.00 -1.03 0.00 0.00 41.12 39.38 1aco n ASP 432 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1aco s ILE 433 N -3.11 1.16 0.44 2.12 -5.25 -1.26 -5.16 121.20 110.14 1aco s ILE 433 Ca 0.07 -2.06 0.00 0.00 -0.99 0.00 0.00 60.65 57.67 1aco s ILE 433 Cb 0.10 -1.94 -0.01 0.00 2.95 0.00 0.00 42.46 43.56 1aco s ILE 433 CO 0.34 -0.67 0.66 -1.59 -1.79 0.00 0.00 174.94 171.89 1aco s LYS 434 N -3.76 3.12 0.52 0.37 -2.85 -1.26 -5.00 119.74 110.87 1aco s LYS 434 Ca 0.19 -0.45 -0.21 0.00 -1.00 0.00 0.00 55.97 54.50 1aco s LYS 434 Cb 0.03 -2.56 -0.06 0.00 -2.06 0.00 0.00 37.83 33.18 1aco s LYS 434 CO 0.02 -0.23 1.18 0.21 0.10 0.00 0.00 175.35 176.63 1aco s LYS 435 N -4.54 3.44 0.00 1.78 2.47 -1.26 -1.97 119.74 119.66 1aco s LYS 435 Ca 0.47 1.77 0.00 0.00 -1.56 0.00 0.00 55.97 56.65 1aco s LYS 435 Cb -0.10 -2.18 0.00 0.00 -1.46 0.00 0.00 37.83 34.09 1aco s LYS 435 CO 0.38 -0.82 0.00 0.41 0.16 0.00 0.00 175.35 175.48 1aco n GLY 436 N 0.38 1.02 3.70 5.54 0.00 -1.26 -5.00 105.19 109.57 1aco n GLY 436 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1aco n GLY 436 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1aco s GLU 437 N -0.08 4.38 0.02 1.61 2.12 -0.83 -4.84 118.70 121.08 1aco s GLU 437 Ca 0.00 0.93 -0.30 0.00 0.36 0.00 0.00 54.97 55.96 1aco s GLU 437 Cb 0.00 -3.50 -0.06 0.00 0.26 0.00 0.00 34.13 30.84 1aco s GLU 437 CO 0.00 -0.09 1.34 0.21 -0.54 0.00 0.00 175.26 176.18 1aco s LYS 438 N 1.32 4.32 0.22 4.30 2.20 -1.26 -4.40 119.74 126.44 1aco s LYS 438 Ca 0.38 1.92 -0.22 0.00 -0.36 0.00 0.00 55.97 57.68 1aco s LYS 438 Cb -0.17 -3.48 0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1aco s LYS 438 CO 0.16 -0.49 0.73 0.54 -0.36 0.00 0.00 175.35 175.93 1aco s ASN 439 N 1.58 -0.33 -0.10 1.43 4.22 -1.12 -4.98 114.94 115.63 1aco s ASN 439 Ca 0.62 -0.41 0.03 0.00 -2.14 0.00 0.00 52.86 50.97 1aco s ASN 439 Cb -0.31 0.66 0.00 0.00 1.28 0.00 0.00 41.25 42.88 1aco s ASN 439 CO 0.27 -1.17 -0.22 -0.89 -2.04 0.00 0.00 177.10 173.05 1aco s THR 440 N -3.77 1.91 0.09 0.54 2.01 -1.25 -0.14 115.64 115.02 1aco s THR 440 Ca 0.08 -0.93 0.10 0.00 0.31 0.00 0.00 61.69 61.26 1aco s THR 440 Cb -0.04 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.77 1aco s THR 440 CO 0.01 0.53 -0.26 0.27 -0.69 0.00 0.00 174.62 174.48 1aco s ILE 441 N 0.47 2.10 -0.06 1.82 -4.36 -0.51 -0.80 121.20 119.86 1aco s ILE 441 Ca -0.16 -1.55 0.05 0.00 -0.26 0.00 0.00 60.65 58.73 1aco s ILE 441 Cb -0.17 -1.84 -0.01 0.00 1.25 0.00 0.00 42.46 41.70 1aco s ILE 441 CO 0.06 0.18 -0.22 0.68 0.24 0.00 0.00 174.94 175.89 1aco s VAL 442 N -0.95 1.80 0.23 8.37 -7.23 -0.83 -1.90 120.40 119.88 1aco s VAL 442 Ca 0.12 -0.91 0.08 0.00 -1.81 0.00 0.00 61.98 59.45 1aco s VAL 442 Cb -0.10 -1.54 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 1aco s VAL 442 CO 0.04 0.50 -0.12 0.42 -0.31 0.00 0.00 175.10 175.63 1aco s THR 443 N 0.03 1.75 -0.62 5.32 -4.23 0.34 -1.02 115.64 117.22 1aco s THR 443 Ca -0.07 -2.20 -0.01 0.00 -1.18 0.00 0.00 61.69 58.23 1aco s THR 443 Cb -0.14 -2.17 0.45 0.00 1.34 0.00 0.00 72.50 71.98 1aco s THR 443 CO 0.04 -0.50 1.93 -1.54 -0.54 0.00 0.00 174.62 174.01 1aco n SER 444 N -0.45 7.30 -0.30 3.99 3.41 -0.29 -0.74 113.62 126.55 1aco n SER 444 Ca -0.07 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 54.76 1aco n SER 444 Cb 0.61 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 1aco n SER 444 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1aco n TYR 445 N -0.90 0.00 0.05 7.33 4.01 -1.26 -4.25 117.16 122.14 1aco n TYR 445 Ca 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.35 1aco n TYR 445 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.74 1aco n TYR 445 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1aco n ASN 446 N 0.00 -0.08 -4.92 7.72 0.23 -1.26 -4.73 115.26 112.22 1aco n ASN 446 Ca 0.00 0.17 -0.28 0.00 -0.53 0.00 0.00 54.58 53.94 1aco n ASN 446 Cb 0.00 0.16 -0.03 0.00 -2.08 0.00 0.00 39.78 37.83 1aco n ASN 446 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1aco s ARG 447 N -2.00 3.54 -0.17 -3.83 0.52 -1.26 -4.72 118.95 111.04 1aco s ARG 447 Ca 0.00 -0.27 0.20 0.00 -0.52 0.00 0.00 55.73 55.13 1aco s ARG 447 Cb 0.00 -2.81 0.41 0.00 0.52 0.00 0.00 34.95 33.07 1aco s ARG 447 CO 0.00 0.38 1.19 0.27 0.02 0.00 0.00 175.30 177.15 1aco n ASN 448 N -0.65 0.60 -4.76 0.23 6.94 -1.26 -5.01 115.26 111.36 1aco n ASN 448 Ca -0.04 -2.04 -0.35 0.00 -0.02 0.00 0.00 54.58 52.13 1aco n ASN 448 Cb 0.54 -0.14 0.04 0.00 -2.36 0.00 0.00 39.78 37.85 1aco n ASN 448 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1aco s PHE 449 N -1.60 2.43 -0.28 -2.53 0.08 -1.26 -4.33 117.98 110.50 1aco s PHE 449 Ca 0.23 1.55 -0.43 0.00 0.12 0.00 0.00 56.93 58.40 1aco s PHE 449 Cb 0.33 -3.37 -0.19 0.00 -0.57 0.00 0.00 43.02 39.22 1aco s PHE 449 CO -0.09 -2.04 1.47 2.41 -0.10 0.00 0.00 175.22 176.87 1aco n THR 450 N -1.96 0.06 -1.33 0.64 -1.04 -1.26 -1.78 114.28 107.61 1aco n THR 450 Ca 0.12 -0.01 -0.13 0.00 -2.04 0.00 0.00 64.05 62.00 1aco n THR 450 Cb 0.51 -0.53 -0.05 0.00 -1.82 0.00 0.00 70.33 68.43 1aco n THR 450 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aco n GLY 451 N 3.27 1.22 0.16 3.41 0.00 -1.25 -4.92 105.19 107.08 1aco n GLY 451 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.21 1aco n GLY 451 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1aco h ARG 452 N 0.00 0.26 0.00 1.61 2.43 -1.67 -0.62 114.38 116.39 1aco h ARG 452 Ca -0.26 -0.21 -0.19 0.00 -0.81 0.00 0.00 59.98 58.51 1aco h ARG 452 Cb 1.07 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 1aco h ARG 452 CO 0.38 0.86 -1.32 -0.91 -1.51 0.00 0.00 179.97 177.47 1aco h ASN 453 N 0.17 0.00 0.00 -3.80 4.21 -1.82 -2.01 115.58 112.34 1aco h ASN 453 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 1aco h ASN 453 Cb 1.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 1aco h ASN 453 CO 0.11 0.71 -0.16 -0.90 -1.29 0.00 0.00 177.43 175.90 1aco n ASP 454 N -3.02 0.00 -0.46 5.81 5.68 -1.25 -3.96 116.55 119.36 1aco n ASP 454 Ca -0.09 -1.32 -0.06 0.00 -0.50 0.00 0.00 54.79 52.82 1aco n ASP 454 Cb 0.89 -0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.78 1aco n ASP 454 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1aco n ALA 455 N 0.00 -0.09 -2.49 2.12 0.00 -0.24 -4.95 120.51 114.86 1aco n ALA 455 Ca 0.00 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.12 1aco n ALA 455 Cb 0.56 -1.58 -0.10 0.00 0.00 0.00 0.00 19.45 18.33 1aco n ALA 455 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1aco s ASN 456 N -2.13 6.09 0.67 0.00 2.47 -1.26 -4.85 114.94 115.93 1aco s ASN 456 Ca 0.00 -0.67 0.44 0.00 0.42 0.00 0.00 52.86 53.05 1aco s ASN 456 Cb 0.00 -2.15 2.39 0.00 -1.45 0.00 0.00 41.25 40.04 1aco s ASN 456 CO 0.00 -0.35 2.35 1.55 -3.72 0.00 0.00 177.10 176.93 1aco h PRO 457 N 8.56 0.00 -0.34 0.43 0.13 -1.91 -2.22 132.00 136.66 1aco h PRO 457 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1aco h PRO 457 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1aco h PRO 457 CO 0.69 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 1aco n GLU 458 N -3.06 2.05 -2.61 0.86 -0.58 -1.26 -4.59 120.64 111.45 1aco n GLU 458 Ca -0.03 -1.61 -0.42 0.00 -0.42 0.00 0.00 57.16 54.68 1aco n GLU 458 Cb 0.09 -1.41 -0.03 0.00 -0.57 0.00 0.00 31.44 29.52 1aco n GLU 458 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1aco s THR 459 N -1.56 4.59 -0.47 2.62 2.01 -0.83 -2.81 115.64 119.19 1aco s THR 459 Ca 0.34 1.87 -0.18 0.00 0.31 0.00 0.00 61.69 64.03 1aco s THR 459 Cb 0.18 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.54 1aco s THR 459 CO 0.26 0.06 0.52 -1.00 -0.69 0.00 0.00 174.62 173.77 1aco s HIS 460 N 1.65 3.13 -0.17 4.92 3.76 0.80 -4.78 115.29 124.60 1aco s HIS 460 Ca 0.52 -0.53 -0.02 0.00 -0.15 0.00 0.00 55.06 54.88 1aco s HIS 460 Cb -0.22 -3.24 -0.02 0.00 1.11 0.00 0.00 32.58 30.22 1aco s HIS 460 CO 0.23 -0.87 -0.08 0.00 -0.85 0.00 0.00 174.74 173.18 1aco s ALA 461 N 2.29 2.77 -0.09 -1.40 0.00 -1.24 -1.43 121.76 122.66 1aco s ALA 461 Ca 0.12 -0.97 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 1aco s ALA 461 Cb -0.19 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.44 1aco s ALA 461 CO 0.12 0.01 -0.06 -0.06 0.00 0.00 0.00 175.76 175.76 1aco s PHE 462 N 0.74 2.96 -0.12 0.00 0.40 -0.80 -4.44 117.98 116.71 1aco s PHE 462 Ca -0.04 -0.08 -0.02 0.00 -0.60 0.00 0.00 56.93 56.20 1aco s PHE 462 Cb -0.15 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 1aco s PHE 462 CO 0.02 0.23 -0.05 0.14 0.70 0.00 0.00 175.22 176.26 1aco s VAL 463 N -0.50 3.81 0.00 -0.44 -7.23 -0.03 -0.50 120.40 115.52 1aco s VAL 463 Ca 0.07 -0.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.84 1aco s VAL 463 Cb -0.12 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.19 1aco s VAL 463 CO 0.02 0.53 0.00 1.07 -0.31 0.00 0.00 175.10 176.41 1aco n THR 464 N 3.06 0.00 -2.32 5.32 5.66 0.08 -0.65 114.28 125.44 1aco n THR 464 Ca -0.18 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.50 1aco n THR 464 Cb 0.53 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.28 1aco n THR 464 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1aco s SER 465 N -0.39 6.46 0.37 1.09 1.04 -1.26 -4.10 113.70 116.92 1aco s SER 465 Ca 0.00 1.61 0.06 0.00 0.48 0.00 0.00 55.95 58.11 1aco s SER 465 Cb 0.00 -2.51 0.73 0.00 0.10 0.00 0.00 66.02 64.34 1aco s SER 465 CO 0.00 -0.70 1.94 1.55 0.98 0.00 0.00 173.24 177.02 1aco h PRO 466 N 0.81 0.46 -0.13 4.02 0.13 -1.90 -1.62 132.00 133.77 1aco h PRO 466 Ca -0.47 -0.08 -0.14 0.00 -0.87 0.00 0.00 66.00 64.45 1aco h PRO 466 Cb 1.19 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1aco h PRO 466 CO 0.61 0.45 -0.53 1.05 -0.23 0.00 0.00 178.00 179.34 1aco h GLU 467 N 0.45 0.37 -0.13 0.86 9.09 -1.87 -0.93 114.58 122.42 1aco h GLU 467 Ca 0.11 -0.23 -0.21 0.00 0.05 0.00 0.00 59.36 59.08 1aco h GLU 467 Cb 0.21 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 1aco h GLU 467 CO -0.00 0.81 -0.75 0.82 0.05 0.00 0.00 179.01 179.94 1aco h ILE 468 N 0.29 1.32 -0.49 -1.06 1.08 -1.83 -1.85 117.51 114.96 1aco h ILE 468 Ca 0.01 -2.03 0.04 0.00 -0.39 0.00 0.00 64.86 62.48 1aco h ILE 468 Cb 1.03 2.02 -0.04 0.00 -3.07 0.00 0.00 36.82 36.76 1aco h ILE 468 CO 0.09 0.63 0.26 0.58 -0.69 0.00 0.00 178.15 179.02 1aco h VAL 469 N 0.44 0.98 -0.49 1.67 2.07 -1.11 0.19 116.25 119.99 1aco h VAL 469 Ca -0.04 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1aco h VAL 469 Cb 1.36 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1aco h VAL 469 CO 0.15 0.09 0.31 0.74 0.02 0.00 0.00 177.57 178.87 1aco h THR 470 N 0.50 1.14 -0.22 2.57 2.02 -1.08 0.17 112.91 118.01 1aco h THR 470 Ca 0.21 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1aco h THR 470 Cb 0.11 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1aco h THR 470 CO -0.14 0.14 0.08 0.00 0.37 0.00 0.00 175.52 175.97 1aco h ALA 471 N 1.15 0.29 0.00 6.16 0.00 -0.78 -1.99 119.26 124.09 1aco h ALA 471 Ca 0.18 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1aco h ALA 471 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1aco h ALA 471 CO -0.04 -0.10 -0.29 -0.07 0.00 0.00 0.00 179.25 178.76 1aco h LEU 472 N 0.20 0.00 -0.63 0.00 3.38 -0.76 -2.27 115.31 115.22 1aco h LEU 472 Ca 0.07 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.89 1aco h LEU 472 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1aco h LEU 472 CO -0.00 0.29 -0.59 0.00 0.09 0.00 0.00 178.44 178.22 1aco h ALA 473 N 1.71 0.82 -0.22 1.53 0.00 -0.22 0.37 119.26 123.26 1aco h ALA 473 Ca -0.00 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 1aco h ALA 473 Cb 0.63 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1aco h ALA 473 CO 0.04 0.72 -0.13 0.82 0.00 0.00 0.00 179.25 180.69 1aco h ILE 474 N 0.22 1.31 -0.05 0.00 2.04 -1.09 0.15 117.51 120.10 1aco h ILE 474 Ca -0.00 -1.23 -0.18 0.00 1.00 0.00 0.00 64.86 64.45 1aco h ILE 474 Cb 1.10 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.82 1aco h ILE 474 CO 0.10 0.37 -0.76 0.00 0.00 0.00 0.00 178.15 177.86 1aco h ALA 475 N 0.69 0.61 -0.00 1.87 0.00 -1.28 -3.21 119.26 117.94 1aco h ALA 475 Ca 0.04 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1aco h ALA 475 Cb 0.64 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1aco h ALA 475 CO 0.04 0.80 -0.00 0.41 0.00 0.00 0.00 179.25 180.50 1aco n GLY 476 N 0.61 0.48 3.11 0.00 0.00 0.13 -4.89 105.19 104.63 1aco n GLY 476 Ca -0.04 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1aco n GLY 476 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1aco s THR 477 N -1.97 0.06 0.34 2.61 -1.32 -1.24 -1.89 115.64 112.23 1aco s THR 477 Ca 0.00 -0.52 0.20 0.00 -1.21 0.00 0.00 61.69 60.16 1aco s THR 477 Cb 0.00 -0.42 0.19 0.00 -1.51 0.00 0.00 72.50 70.76 1aco s THR 477 CO 0.00 -0.29 1.91 -0.07 -2.21 0.00 0.00 174.62 173.97 1aco h LEU 478 N 4.57 0.00 -5.61 9.08 3.38 -1.44 -3.29 115.31 122.00 1aco h LEU 478 Ca -0.29 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.10 1aco h LEU 478 Cb 1.19 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.96 1aco h LEU 478 CO 0.40 0.25 3.02 0.29 0.09 0.00 0.00 178.44 182.49 1aco n LYS 479 N -3.79 2.59 -3.65 1.13 5.02 -1.26 -3.64 118.16 114.55 1aco n LYS 479 Ca -0.01 -1.96 -0.05 0.00 -2.02 0.00 0.00 58.31 54.27 1aco n LYS 479 Cb 0.35 -2.80 -0.07 0.00 -0.02 0.00 0.00 35.03 32.50 1aco n LYS 479 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1aco s PHE 480 N 3.31 -1.07 -0.34 2.13 5.36 -1.24 -5.06 117.98 121.07 1aco s PHE 480 Ca 0.53 1.95 -0.07 0.00 -0.96 0.00 0.00 56.93 58.38 1aco s PHE 480 Cb 0.14 0.57 0.03 0.00 -0.34 0.00 0.00 43.02 43.42 1aco s PHE 480 CO -0.02 -0.57 0.11 1.21 -1.46 0.00 0.00 175.22 174.49 1aco s ASN 481 N 2.60 5.33 0.58 6.13 2.47 -1.26 -4.93 114.94 125.85 1aco s ASN 481 Ca -0.05 -1.07 0.27 0.00 0.42 0.00 0.00 52.86 52.43 1aco s ASN 481 Cb -0.11 -1.88 1.69 0.00 -1.45 0.00 0.00 41.25 39.49 1aco s ASN 481 CO -0.16 -0.31 2.20 -0.65 -3.72 0.00 0.00 177.10 174.45 1aco h PRO 482 N 8.24 0.00 -0.04 0.43 0.11 -1.96 -0.89 132.00 137.89 1aco h PRO 482 Ca -0.24 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.68 1aco h PRO 482 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1aco h PRO 482 CO 0.61 0.00 -0.77 0.93 -0.21 0.00 0.00 178.00 178.56 1aco h GLU 483 N 0.00 0.28 0.00 1.05 5.08 -1.94 -3.41 114.58 115.65 1aco h GLU 483 Ca 0.03 -0.25 -0.14 0.00 -1.00 0.00 0.00 59.36 57.99 1aco h GLU 483 Cb 0.14 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1aco h GLU 483 CO -0.00 0.92 -1.53 0.25 -1.00 0.00 0.00 179.01 177.65 1aco n THR 484 N -3.78 0.53 -2.70 1.13 -2.24 -0.45 -5.01 114.28 101.77 1aco n THR 484 Ca -0.04 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.18 1aco n THR 484 Cb 0.73 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1aco n THR 484 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1aco s ASP 485 N -4.15 6.17 -0.05 3.42 1.01 -0.58 -5.07 116.67 117.43 1aco s ASP 485 Ca -0.06 0.83 -0.01 0.00 0.71 0.00 0.00 52.55 54.02 1aco s ASP 485 Cb 0.02 -2.13 -0.04 0.00 1.01 0.00 0.00 42.92 41.78 1aco s ASP 485 CO 0.29 -0.61 0.05 -0.36 0.21 0.00 0.00 175.17 174.75 1aco s PHE 486 N -2.72 3.25 0.36 4.23 0.40 -1.26 -4.53 117.98 117.71 1aco s PHE 486 Ca 0.47 0.22 0.08 0.00 -0.60 0.00 0.00 56.93 57.10 1aco s PHE 486 Cb -0.10 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.63 1aco s PHE 486 CO 0.44 0.53 0.31 -0.51 0.70 0.00 0.00 175.22 176.69 1aco s LEU 487 N -1.33 3.54 -0.19 -0.37 1.02 0.19 -4.88 118.68 116.66 1aco s LEU 487 Ca 0.18 -0.56 -0.00 0.00 0.02 0.00 0.00 54.13 53.77 1aco s LEU 487 Cb -0.12 -2.17 0.01 0.00 0.02 0.00 0.00 46.19 43.93 1aco s LEU 487 CO 0.08 -0.43 -0.16 -0.89 0.02 0.00 0.00 176.35 174.97 1aco s THR 488 N -2.35 2.40 1.07 5.49 2.01 -1.26 -1.30 115.64 121.69 1aco s THR 488 Ca 0.43 -0.83 -0.18 0.00 0.31 0.00 0.00 61.69 61.42 1aco s THR 488 Cb -0.05 -2.03 0.26 0.00 0.01 0.00 0.00 72.50 70.69 1aco s THR 488 CO 0.27 0.51 1.00 0.61 -0.69 0.00 0.00 174.62 176.32 1aco n GLY 489 N 4.66 -2.58 0.18 4.40 0.00 0.64 -4.90 105.19 107.58 1aco n GLY 489 Ca -0.20 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.22 1aco n GLY 489 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1aco h LYS 490 N 0.00 0.53 0.00 1.61 3.64 -1.10 -2.22 116.57 119.04 1aco h LYS 490 Ca -0.37 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1aco h LYS 490 Cb 1.11 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1aco h LYS 490 CO 0.24 0.41 0.00 -0.40 -2.27 0.00 0.00 179.45 177.43 1aco n ASP 491 N -4.77 0.00 0.00 4.20 5.75 -1.26 -4.86 116.55 115.61 1aco n ASP 491 Ca 0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 54.79 54.51 1aco n ASP 491 Cb 0.06 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1aco n ASP 491 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1aco n GLY 492 N -0.28 2.15 3.75 6.12 0.00 -0.83 -5.05 105.19 111.05 1aco n GLY 492 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1aco n GLY 492 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aco s LYS 493 N -0.54 4.80 0.34 1.61 1.02 -1.26 -4.70 119.74 121.01 1aco s LYS 493 Ca 0.00 1.52 -0.26 0.00 0.02 0.00 0.00 55.97 57.25 1aco s LYS 493 Cb 0.00 -3.23 -0.09 0.00 -0.52 0.00 0.00 37.83 33.99 1aco s LYS 493 CO 0.00 0.45 1.01 0.15 -0.92 0.00 0.00 175.35 176.04 1aco s LYS 494 N -1.29 4.45 0.08 1.68 -0.14 -1.26 -0.26 119.74 123.00 1aco s LYS 494 Ca 0.42 1.49 -0.13 0.00 -1.36 0.00 0.00 55.97 56.39 1aco s LYS 494 Cb -0.26 -2.80 0.02 0.00 -1.68 0.00 0.00 37.83 33.11 1aco s LYS 494 CO 0.33 0.13 0.29 -0.59 -0.76 0.00 0.00 175.35 174.75 1aco s PHE 495 N -1.53 -0.05 0.04 3.18 -0.71 -0.42 -4.91 117.98 113.58 1aco s PHE 495 Ca 0.51 -0.22 0.07 0.00 -1.04 0.00 0.00 56.93 56.25 1aco s PHE 495 Cb -0.23 0.09 -0.03 0.00 -1.21 0.00 0.00 43.02 41.64 1aco s PHE 495 CO 0.29 -0.57 -0.16 0.15 -1.34 0.00 0.00 175.22 173.59 1aco s LYS 496 N -3.28 2.14 -0.01 1.99 1.02 -1.26 -0.64 119.74 119.70 1aco s LYS 496 Ca 0.00 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.74 1aco s LYS 496 Cb 0.02 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.04 1aco s LYS 496 CO -0.08 0.54 1.19 -0.51 -0.92 0.00 0.00 175.35 175.57 1aco s LEU 497 N -1.53 4.32 0.26 3.17 1.02 -1.26 -5.03 118.68 119.62 1aco s LEU 497 Ca 0.16 1.88 -0.30 0.00 0.02 0.00 0.00 54.13 55.90 1aco s LEU 497 Cb -0.11 -3.57 -0.09 0.00 0.02 0.00 0.00 46.19 42.45 1aco s LEU 497 CO 0.07 -0.52 1.06 -0.70 0.02 0.00 0.00 176.35 176.28 1aco s GLU 498 N 1.70 4.68 0.29 1.70 -6.30 -1.26 -4.87 118.70 114.64 1aco s GLU 498 Ca 0.57 1.72 -0.30 0.00 -2.50 0.00 0.00 54.97 54.46 1aco s GLU 498 Cb -0.26 -3.22 -0.12 0.00 0.00 0.00 0.00 34.13 30.53 1aco s GLU 498 CO 0.25 0.26 1.55 0.00 0.02 0.00 0.00 175.26 177.35 1aco n ALA 499 N 1.42 2.28 -1.77 6.30 0.00 -1.26 -4.89 120.51 122.59 1aco n ALA 499 Ca -0.01 0.38 -0.37 0.00 0.00 0.00 0.00 53.44 53.44 1aco n ALA 499 Cb 0.45 -2.43 -0.01 0.00 0.00 0.00 0.00 19.45 17.47 1aco n ALA 499 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1aco s PRO 500 N -0.62 3.77 -0.01 0.00 0.04 -1.26 -4.98 135.00 131.94 1aco s PRO 500 Ca 0.64 1.72 -0.01 0.00 0.04 0.00 0.00 61.00 63.39 1aco s PRO 500 Cb -0.52 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1aco s PRO 500 CO 0.50 -0.53 0.03 0.34 0.04 0.00 0.00 177.00 177.38 1aco s ASP 501 N -1.43 -0.01 0.24 6.66 2.15 -1.26 -4.87 116.67 118.15 1aco s ASP 501 Ca 0.64 0.02 -0.21 0.00 0.43 0.00 0.00 52.55 53.42 1aco s ASP 501 Cb -0.27 0.07 0.03 0.00 -0.30 0.00 0.00 42.92 42.45 1aco s ASP 501 CO 0.33 -0.04 0.68 0.00 -0.17 0.00 0.00 175.17 175.97 1aco s ALA 502 N -0.12 -1.30 0.35 3.66 0.00 -1.26 -4.83 121.76 118.26 1aco s ALA 502 Ca -0.01 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.59 1aco s ALA 502 Cb -0.01 0.86 -0.09 0.00 0.00 0.00 0.00 23.12 23.88 1aco s ALA 502 CO -0.00 -0.95 1.14 -0.51 0.00 0.00 0.00 175.76 175.43 1aco s ASP 503 N -2.87 6.84 0.23 0.00 1.01 -1.26 -4.93 116.67 115.69 1aco s ASP 503 Ca 0.08 2.29 0.09 0.00 0.71 0.00 0.00 52.55 55.73 1aco s ASP 503 Cb -0.04 -2.62 0.21 0.00 1.01 0.00 0.00 42.92 41.48 1aco s ASP 503 CO 0.01 -0.45 1.53 1.05 0.21 0.00 0.00 175.17 177.52 1aco h GLU 504 N 3.07 0.02 -4.36 8.23 4.11 -1.94 -3.37 114.58 120.34 1aco h GLU 504 Ca -0.48 -0.02 -0.16 0.00 0.07 0.00 0.00 59.36 58.77 1aco h GLU 504 Cb 1.22 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.32 1aco h GLU 504 CO 0.64 0.72 -0.69 -0.51 0.07 0.00 0.00 179.01 179.25 1aco s LEU 505 N -7.43 2.47 0.36 3.06 1.43 -1.26 -3.61 118.68 113.70 1aco s LEU 505 Ca -0.01 -0.96 -0.28 0.00 -1.03 0.00 0.00 54.13 51.85 1aco s LEU 505 Cb 0.12 0.10 -0.10 0.00 0.03 0.00 0.00 46.19 46.34 1aco s LEU 505 CO 0.78 -0.53 1.33 -2.16 0.23 0.00 0.00 176.35 176.00 1aco s PRO 506 N -3.67 4.21 0.06 1.29 0.04 -1.26 -4.92 135.00 130.74 1aco s PRO 506 Ca 0.07 2.25 -0.21 0.00 0.04 0.00 0.00 61.00 63.14 1aco s PRO 506 Cb 0.06 -2.97 -0.12 0.00 0.04 0.00 0.00 34.50 31.51 1aco s PRO 506 CO -0.08 -0.32 1.49 0.00 0.04 0.00 0.00 177.00 178.14 1aco h ARG 507 N 3.13 0.27 0.00 4.56 3.08 -2.00 -3.42 114.38 120.00 1aco h ARG 507 Ca -0.49 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.30 1aco h ARG 507 Cb 1.23 -0.03 0.07 0.00 0.08 0.00 0.00 29.97 31.33 1aco h ARG 507 CO 0.64 0.49 0.14 0.00 -1.07 0.00 0.00 179.97 180.18 1aco n ALA 508 N -2.31 -0.80 -1.77 0.04 0.00 -1.26 -5.02 120.51 109.39 1aco n ALA 508 Ca -0.05 -0.70 -0.29 0.00 0.00 0.00 0.00 53.44 52.40 1aco n ALA 508 Cb 0.21 -0.04 0.12 0.00 0.00 0.00 0.00 19.45 19.74 1aco n ALA 508 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1aco s GLU 509 N -4.15 1.52 0.47 0.00 0.41 -1.26 -5.01 118.70 110.68 1aco s GLU 509 Ca 0.30 0.12 -0.22 0.00 -0.41 0.00 0.00 54.97 54.76 1aco s GLU 509 Cb -0.01 -1.90 -0.08 0.00 -1.78 0.00 0.00 34.13 30.36 1aco s GLU 509 CO 0.22 -1.90 1.09 -0.06 -0.49 0.00 0.00 175.26 174.12 1aco s PHE 510 N -3.50 2.97 -0.24 1.61 0.08 -1.26 -4.91 117.98 112.73 1aco s PHE 510 Ca 0.64 1.58 -0.14 0.00 0.12 0.00 0.00 56.93 59.12 1aco s PHE 510 Cb -0.12 -3.21 -0.04 0.00 -0.57 0.00 0.00 43.02 39.08 1aco s PHE 510 CO 0.51 -1.10 0.34 0.34 -0.10 0.00 0.00 175.22 175.20 1aco s ASP 511 N -1.66 6.30 0.54 1.36 -1.08 -1.26 -4.98 116.67 115.88 1aco s ASP 511 Ca 0.65 0.34 0.35 0.00 -0.52 0.00 0.00 52.55 53.36 1aco s ASP 511 Cb -0.23 -2.20 1.56 0.00 -1.46 0.00 0.00 42.92 40.60 1aco s ASP 511 CO 0.27 -0.09 2.03 1.55 0.52 0.00 0.00 175.17 179.46 1aco h PRO 512 N 7.72 0.00 0.00 4.34 0.13 -1.91 -3.37 132.00 138.92 1aco h PRO 512 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1aco h PRO 512 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1aco h PRO 512 CO 0.67 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.85 1aco n GLY 513 N -0.27 -0.95 3.83 1.56 0.00 -1.26 -3.47 105.19 104.63 1aco n GLY 513 Ca -0.00 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 1aco n GLY 513 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1aco s GLN 514 N 0.00 3.59 0.09 1.61 -2.07 -1.26 -5.00 119.66 116.62 1aco s GLN 514 Ca 0.00 0.98 -0.31 0.00 -1.82 0.00 0.00 55.36 54.21 1aco s GLN 514 Cb 0.00 -2.08 -0.10 0.00 -1.09 0.00 0.00 33.01 29.74 1aco s GLN 514 CO 0.00 -0.57 1.89 -0.40 -1.32 0.00 0.00 175.29 174.89 1aco n ASP 515 N -2.12 4.08 0.00 12.60 5.75 -1.26 -4.89 116.55 130.71 1aco n ASP 515 Ca 0.07 0.96 0.00 0.00 -0.01 0.00 0.00 54.79 55.81 1aco n ASP 515 Cb 0.54 -1.54 0.00 0.00 -1.03 0.00 0.00 41.12 39.09 1aco n ASP 515 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1aco n THR 516 N 5.01 0.00 -3.47 2.12 -2.24 -1.26 -5.03 114.28 109.41 1aco n THR 516 Ca 0.19 -0.09 -0.37 0.00 -2.27 0.00 0.00 64.05 61.50 1aco n THR 516 Cb 0.38 1.66 -0.06 0.00 -2.10 0.00 0.00 70.33 70.22 1aco n THR 516 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1aco s TYR 517 N -0.03 3.70 -0.24 4.78 5.04 -1.26 -1.04 117.35 128.29 1aco s TYR 517 Ca 0.00 1.00 0.02 0.00 -2.44 0.00 0.00 57.07 55.65 1aco s TYR 517 Cb 0.00 -2.30 0.06 0.00 0.35 0.00 0.00 41.96 40.06 1aco s TYR 517 CO 0.00 0.59 -0.08 -1.14 -1.34 0.00 0.00 175.55 173.58 1aco s GLN 518 N -1.34 1.94 0.35 4.97 0.74 0.93 -4.97 119.66 122.29 1aco s GLN 518 Ca 0.28 -1.09 -0.25 0.00 0.05 0.00 0.00 55.36 54.34 1aco s GLN 518 Cb -0.16 -2.67 -0.10 0.00 1.10 0.00 0.00 33.01 31.18 1aco s GLN 518 CO 0.16 -0.55 0.98 -1.58 -0.55 0.00 0.00 175.29 173.75 1aco s HIS 519 N 1.29 3.53 0.45 1.67 5.65 -1.26 -1.76 115.29 124.85 1aco s HIS 519 Ca -0.06 1.72 -0.25 0.00 0.25 0.00 0.00 55.06 56.73 1aco s HIS 519 Cb -0.19 -3.00 -0.08 0.00 -1.18 0.00 0.00 32.58 28.14 1aco s HIS 519 CO -0.06 -0.11 1.32 -1.25 -0.65 0.00 0.00 174.74 173.98 1aco s PRO 520 N -2.25 3.72 -0.06 2.88 0.04 -1.26 -4.96 135.00 133.12 1aco s PRO 520 Ca 0.53 2.16 -0.30 0.00 0.04 0.00 0.00 61.00 63.44 1aco s PRO 520 Cb -0.20 -2.59 -0.06 0.00 0.04 0.00 0.00 34.50 31.70 1aco s PRO 520 CO 0.25 -0.70 1.70 -1.25 0.04 0.00 0.00 177.00 177.04 1aco s PRO 521 N -2.48 4.13 -0.53 0.56 0.04 -1.26 -4.86 135.00 130.60 1aco s PRO 521 Ca 0.61 2.19 0.06 0.00 0.04 0.00 0.00 61.00 63.90 1aco s PRO 521 Cb -0.38 -4.02 0.36 0.00 0.04 0.00 0.00 34.50 30.51 1aco s PRO 521 CO 0.48 -0.92 0.98 1.63 0.04 0.00 0.00 177.00 179.21 1aco n LYS 522 N 7.25 3.12 0.00 4.56 4.76 -1.26 -3.99 118.16 132.60 1aco n LYS 522 Ca 0.18 -4.65 0.00 0.00 -2.87 0.00 0.00 58.31 50.97 1aco n LYS 522 Cb 0.43 -2.19 0.00 0.00 -1.84 0.00 0.00 35.03 31.43 1aco n LYS 522 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1aco n ASP 523 N -0.27 0.00 0.00 4.39 5.75 -1.26 -5.05 116.55 120.11 1aco n ASP 523 Ca 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.10 1aco n ASP 523 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1aco n ASP 523 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1aco n SER 524 N 0.00 0.00 -0.51 -1.12 7.64 -1.26 -4.81 113.62 113.56 1aco n SER 524 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 1aco n SER 524 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1aco n SER 524 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1aco n SER 525 N -1.13 -0.68 -1.12 6.43 7.64 -1.26 -4.77 113.62 118.74 1aco n SER 525 Ca 0.00 0.03 -0.01 0.00 1.01 0.00 0.00 58.87 59.90 1aco n SER 525 Cb 0.00 -0.93 0.01 0.00 -1.01 0.00 0.00 64.21 62.28 1aco n SER 525 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aco n GLY 526 N 0.04 2.17 3.74 0.23 0.00 -1.26 -4.68 105.19 105.43 1aco n GLY 526 Ca -0.01 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1aco n GLY 526 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aco s GLN 527 N -0.12 4.63 -0.17 1.61 1.11 -1.26 -5.03 119.66 120.43 1aco s GLN 527 Ca 0.02 1.63 -0.14 0.00 0.01 0.00 0.00 55.36 56.89 1aco s GLN 527 Cb 0.02 -3.31 -0.05 0.00 -1.01 0.00 0.00 33.01 28.67 1aco s GLN 527 CO 0.00 0.13 0.29 1.03 0.01 0.00 0.00 175.29 176.76 1aco s ARG 528 N -0.29 4.23 -0.19 2.91 0.52 -1.26 -4.88 118.95 119.99 1aco s ARG 528 Ca 0.48 0.07 -0.22 0.00 -0.52 0.00 0.00 55.73 55.54 1aco s ARG 528 Cb -0.27 -3.45 -0.02 0.00 0.52 0.00 0.00 34.95 31.73 1aco s ARG 528 CO 0.33 0.19 0.69 0.08 0.02 0.00 0.00 175.30 176.61 1aco s VAL 529 N 0.62 4.98 -0.16 3.52 1.01 -1.26 -4.95 120.40 124.15 1aco s VAL 529 Ca 0.16 1.31 -0.05 0.00 0.00 0.00 0.00 61.98 63.40 1aco s VAL 529 Cb -0.13 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1aco s VAL 529 CO 0.04 0.08 -0.01 -0.62 0.00 0.00 0.00 175.10 174.59 1aco s ASP 530 N 1.20 5.05 -0.23 3.32 2.15 -1.26 -5.06 116.67 121.84 1aco s ASP 530 Ca 0.31 -0.06 0.00 0.00 0.43 0.00 0.00 52.55 53.24 1aco s ASP 530 Cb -0.16 -1.83 0.06 0.00 -0.30 0.00 0.00 42.92 40.69 1aco s ASP 530 CO 0.11 0.18 -0.05 -0.69 -0.17 0.00 0.00 175.17 174.54 1aco s VAL 531 N 0.33 1.45 0.30 1.11 1.01 -1.26 -4.91 120.40 118.42 1aco s VAL 531 Ca -0.02 -1.14 -0.29 0.00 0.00 0.00 0.00 61.98 60.53 1aco s VAL 531 Cb -0.14 -1.72 -0.10 0.00 0.00 0.00 0.00 36.38 34.42 1aco s VAL 531 CO 0.02 -0.09 1.42 -0.55 0.00 0.00 0.00 175.10 175.90 1aco s SER 532 N 1.44 6.62 0.13 3.32 0.15 -1.26 -4.89 113.70 119.21 1aco s SER 532 Ca -0.05 2.75 0.19 0.00 0.70 0.00 0.00 55.95 59.54 1aco s SER 532 Cb -0.18 -2.64 0.79 0.00 -1.71 0.00 0.00 66.02 62.28 1aco s SER 532 CO -0.06 -0.69 1.58 -0.81 1.20 0.00 0.00 173.24 174.45 1aco n PRO 533 N 1.55 0.10 -0.36 5.44 -0.04 -1.26 -1.99 135.00 138.44 1aco n PRO 533 Ca 0.04 0.35 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 1aco n PRO 533 Cb 0.40 -1.69 0.28 0.00 -0.04 0.00 0.00 33.50 32.45 1aco n PRO 533 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1aco n THR 534 N -1.87 1.16 -2.13 0.52 -2.24 -1.26 -5.00 114.28 103.45 1aco n THR 534 Ca 0.03 -1.05 -0.40 0.00 -2.27 0.00 0.00 64.05 60.35 1aco n THR 534 Cb 0.19 0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 68.83 1aco n THR 534 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1aco s SER 535 N -1.01 6.63 0.04 3.42 0.15 -0.84 -4.91 113.70 117.18 1aco s SER 535 Ca 0.42 2.62 0.24 0.00 0.70 0.00 0.00 55.95 59.93 1aco s SER 535 Cb 0.23 -2.64 0.22 0.00 -1.71 0.00 0.00 66.02 62.12 1aco s SER 535 CO 0.27 -0.63 1.19 0.00 1.20 0.00 0.00 173.24 175.27 1aco n GLN 536 N 0.53 0.18 -0.03 5.44 1.13 -1.26 -4.39 117.38 118.99 1aco n GLN 536 Ca 0.02 0.02 0.03 0.00 -1.94 0.00 0.00 57.00 55.12 1aco n GLN 536 Cb 0.43 -1.58 -0.11 0.00 0.11 0.00 0.00 30.24 29.09 1aco n GLN 536 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1aco n ARG 537 N -1.82 0.90 -4.35 -1.09 1.74 -1.26 -4.82 116.66 105.96 1aco n ARG 537 Ca 0.03 -0.09 -0.18 0.00 -0.77 0.00 0.00 57.85 56.84 1aco n ARG 537 Cb 0.40 -1.35 -0.15 0.00 -1.02 0.00 0.00 32.46 30.34 1aco n ARG 537 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1aco s LEU 538 N -4.36 2.03 -0.19 0.55 1.43 -1.26 -2.75 118.68 114.12 1aco s LEU 538 Ca -0.06 -0.18 -0.09 0.00 -1.03 0.00 0.00 54.13 52.77 1aco s LEU 538 Cb 0.08 -0.45 0.07 0.00 0.03 0.00 0.00 46.19 45.92 1aco s LEU 538 CO 0.60 0.10 0.44 -1.58 0.23 0.00 0.00 176.35 176.14 1aco s GLN 539 N -0.27 0.40 0.57 1.70 0.74 -0.43 -4.48 119.66 117.90 1aco s GLN 539 Ca 0.03 0.92 -0.20 0.00 0.05 0.00 0.00 55.36 56.16 1aco s GLN 539 Cb -0.04 0.12 -0.04 0.00 1.10 0.00 0.00 33.01 34.15 1aco s GLN 539 CO -0.00 -0.19 1.29 -0.51 -0.55 0.00 0.00 175.29 175.33 1aco s LEU 540 N 1.83 3.76 0.28 3.68 1.43 -1.26 -4.72 118.68 123.68 1aco s LEU 540 Ca -0.07 2.60 -0.20 0.00 -1.03 0.00 0.00 54.13 55.43 1aco s LEU 540 Cb -0.09 -4.43 -0.09 0.00 0.03 0.00 0.00 46.19 41.61 1aco s LEU 540 CO -0.14 -1.61 0.79 -0.76 0.23 0.00 0.00 176.35 174.86 1aco s LEU 541 N -3.79 4.25 -0.15 1.79 1.43 -1.26 -5.02 118.68 115.93 1aco s LEU 541 Ca 0.75 1.49 -0.03 0.00 -1.03 0.00 0.00 54.13 55.31 1aco s LEU 541 Cb -0.36 -3.86 -0.03 0.00 0.03 0.00 0.00 46.19 41.98 1aco s LEU 541 CO 0.41 -0.07 -0.04 -0.70 0.23 0.00 0.00 176.35 176.18 1aco s GLU 542 N -2.30 3.61 0.41 1.70 2.12 -1.26 -5.03 118.70 117.94 1aco s GLU 542 Ca 0.48 -0.52 -0.27 0.00 0.36 0.00 0.00 54.97 55.03 1aco s GLU 542 Cb -0.15 -2.90 -0.10 0.00 0.26 0.00 0.00 34.13 31.24 1aco s GLU 542 CO 0.20 0.28 1.47 -1.25 -0.54 0.00 0.00 175.26 175.42 1aco s PRO 543 N 0.26 3.95 0.84 4.30 0.04 -1.26 -5.00 135.00 138.13 1aco s PRO 543 Ca -0.03 2.52 -0.11 0.00 0.04 0.00 0.00 61.00 63.43 1aco s PRO 543 Cb -0.14 -2.85 0.10 0.00 0.04 0.00 0.00 34.50 31.65 1aco s PRO 543 CO 0.03 -0.65 1.09 -0.06 0.04 0.00 0.00 177.00 177.46 1aco s PHE 544 N -1.15 2.37 0.42 0.56 0.08 -1.26 -5.01 117.98 113.98 1aco s PHE 544 Ca 0.56 1.44 -0.24 0.00 0.12 0.00 0.00 56.93 58.80 1aco s PHE 544 Cb -0.46 -3.12 -0.08 0.00 -0.57 0.00 0.00 43.02 38.79 1aco s PHE 544 CO 0.61 -2.17 1.15 0.16 -0.10 0.00 0.00 175.22 174.87 1aco s ASP 545 N -3.33 6.47 0.68 1.36 -4.77 -1.26 -4.87 116.67 110.94 1aco s ASP 545 Ca 0.63 2.29 -0.14 0.00 -3.30 0.00 0.00 52.55 52.02 1aco s ASP 545 Cb -0.18 -2.61 0.01 0.00 -1.09 0.00 0.00 42.92 39.05 1aco s ASP 545 CO 0.57 -0.71 1.10 -0.54 0.70 0.00 0.00 175.17 176.29 1aco s LYS 546 N -2.43 2.74 0.34 2.11 -0.14 -1.26 -4.08 119.74 117.02 1aco s LYS 546 Ca 0.59 1.32 -0.29 0.00 -1.36 0.00 0.00 55.97 56.24 1aco s LYS 546 Cb -0.29 -1.95 -0.11 0.00 -1.68 0.00 0.00 37.83 33.81 1aco s LYS 546 CO 0.36 -1.29 1.40 -0.46 -0.76 0.00 0.00 175.35 174.60 1aco s TRP 547 N -2.47 2.84 -1.60 3.18 -0.00 -0.65 -4.81 118.94 115.43 1aco s TRP 547 Ca 0.65 1.27 0.26 0.00 -0.00 0.00 0.00 56.10 58.28 1aco s TRP 547 Cb -0.19 -3.85 1.40 0.00 -0.00 0.00 0.00 33.47 30.83 1aco s TRP 547 CO 0.44 -2.45 1.91 -0.40 -0.00 0.00 0.00 176.95 176.45 1aco n ASP 548 N 0.78 0.00 0.00 5.86 5.68 -1.26 -4.87 116.55 122.74 1aco n ASP 548 Ca 0.01 -0.31 0.00 0.00 -0.50 0.00 0.00 54.79 53.99 1aco n ASP 548 Cb 0.40 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 1aco n ASP 548 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1aco n GLY 549 N 0.85 0.75 3.59 6.12 0.00 -1.26 -5.04 105.19 110.20 1aco n GLY 549 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1aco n GLY 549 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aco s LYS 550 N -0.50 2.10 0.91 1.61 1.02 -1.26 -4.84 119.74 118.77 1aco s LYS 550 Ca 0.00 -1.50 -0.11 0.00 0.02 0.00 0.00 55.97 54.38 1aco s LYS 550 Cb 0.00 -2.05 0.14 0.00 -0.52 0.00 0.00 37.83 35.39 1aco s LYS 550 CO 0.00 0.36 1.09 -0.51 -0.92 0.00 0.00 175.35 175.38 1aco s ASP 551 N -3.53 3.30 -0.53 2.83 1.01 -1.26 -4.95 116.67 113.53 1aco s ASP 551 Ca 0.30 1.64 -0.16 0.00 0.71 0.00 0.00 52.55 55.04 1aco s ASP 551 Cb -0.06 -2.29 0.12 0.00 1.01 0.00 0.00 42.92 41.70 1aco s ASP 551 CO 0.18 -2.77 0.49 -0.76 0.21 0.00 0.00 175.17 172.53 1aco s LEU 552 N -6.33 6.11 0.06 1.23 1.43 -0.95 -5.00 118.68 115.25 1aco s LEU 552 Ca 0.64 -1.73 0.03 0.00 -1.03 0.00 0.00 54.13 52.04 1aco s LEU 552 Cb -0.19 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 1aco s LEU 552 CO 0.58 -0.84 0.04 -1.83 0.23 0.00 0.00 176.35 174.52 1aco s GLU 553 N 1.63 2.76 -1.18 1.70 -1.05 -1.26 -0.72 118.70 120.57 1aco s GLU 553 Ca 0.03 -0.71 -0.13 0.00 -0.15 0.00 0.00 54.97 54.01 1aco s GLU 553 Cb -0.29 -2.66 -0.01 0.00 -0.44 0.00 0.00 34.13 30.72 1aco s GLU 553 CO 0.03 0.57 0.76 -0.25 0.95 0.00 0.00 175.26 177.32 1aco n ASP 554 N 0.72 -4.23 -4.75 0.83 8.00 -0.84 -4.93 116.55 111.35 1aco n ASP 554 Ca -0.11 -0.94 -0.40 0.00 0.71 0.00 0.00 54.79 54.05 1aco n ASP 554 Cb 0.52 -3.71 -0.06 0.00 -0.02 0.00 0.00 41.12 37.85 1aco n ASP 554 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1aco s LEU 555 N -6.41 4.60 0.15 0.64 1.43 0.16 -4.79 118.68 114.45 1aco s LEU 555 Ca 0.34 1.86 -0.18 0.00 -1.03 0.00 0.00 54.13 55.12 1aco s LEU 555 Cb -0.11 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1aco s LEU 555 CO 0.84 0.11 0.63 -1.58 0.23 0.00 0.00 176.35 176.57 1aco s GLN 556 N -0.85 4.18 -0.33 1.70 2.00 -0.34 -1.87 119.66 124.15 1aco s GLN 556 Ca 0.42 0.74 -0.26 0.00 -2.00 0.00 0.00 55.36 54.25 1aco s GLN 556 Cb -0.25 -3.04 0.01 0.00 0.80 0.00 0.00 33.01 30.53 1aco s GLN 556 CO 0.30 0.51 0.93 0.42 -0.50 0.00 0.00 175.29 176.96 1aco s ILE 557 N -1.35 4.64 0.06 -2.34 1.01 -1.26 -1.28 121.20 120.68 1aco s ILE 557 Ca 0.36 1.39 -0.20 0.00 0.00 0.00 0.00 60.65 62.21 1aco s ILE 557 Cb -0.18 -4.29 -0.12 0.00 0.01 0.00 0.00 42.46 37.88 1aco s ILE 557 CO 0.20 -0.41 1.43 0.25 0.00 0.00 0.00 174.94 176.41 1aco h LEU 558 N 9.84 0.36 -7.00 2.97 5.85 -1.20 -3.47 115.31 122.66 1aco h LEU 558 Ca -0.23 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.08 1aco h LEU 558 Cb 1.08 -0.10 -0.21 0.00 0.37 0.00 0.00 40.66 41.80 1aco h LEU 558 CO 0.96 0.67 0.11 -0.51 -0.34 0.00 0.00 178.44 179.33 1aco s ILE 559 N -4.66 0.00 -0.34 4.05 2.07 -1.25 -4.86 121.20 116.21 1aco s ILE 559 Ca -0.14 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.01 1aco s ILE 559 Cb 0.06 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.67 1aco s ILE 559 CO 0.74 0.00 0.16 -0.75 -1.91 0.00 0.00 174.94 173.18 1aco s LYS 560 N 0.68 2.95 0.19 3.50 2.20 -1.26 -1.58 119.74 126.42 1aco s LYS 560 Ca -0.02 -0.98 -0.22 0.00 -0.36 0.00 0.00 55.97 54.39 1aco s LYS 560 Cb -0.05 -3.60 -0.08 0.00 -1.51 0.00 0.00 37.83 32.59 1aco s LYS 560 CO -0.04 -0.59 0.73 0.08 -0.36 0.00 0.00 175.35 175.16 1aco s VAL 561 N 1.54 4.52 -0.15 4.02 1.01 -0.13 -1.58 120.40 129.63 1aco s VAL 561 Ca 0.02 1.42 -0.04 0.00 0.00 0.00 0.00 61.98 63.38 1aco s VAL 561 Cb -0.18 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1aco s VAL 561 CO 0.05 0.35 -0.03 -0.75 0.00 0.00 0.00 175.10 174.73 1aco s LYS 562 N -1.61 3.64 3.10 2.72 2.20 -0.52 -4.08 119.74 125.19 1aco s LYS 562 Ca 0.39 -0.49 0.00 0.00 -0.36 0.00 0.00 55.97 55.51 1aco s LYS 562 Cb -0.19 -2.93 0.00 0.00 -1.51 0.00 0.00 37.83 33.20 1aco s LYS 562 CO 0.22 0.29 0.00 0.41 -0.36 0.00 0.00 175.35 175.91 1aco n GLY 563 N 3.40 -0.20 3.69 5.54 0.00 -1.26 -4.56 105.19 111.81 1aco n GLY 563 Ca -0.17 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 1aco n GLY 563 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1aco s LYS 564 N 0.00 4.23 -0.36 1.61 2.20 -1.26 -4.52 119.74 121.63 1aco s LYS 564 Ca 0.00 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 1aco s LYS 564 Cb 0.00 -3.60 0.14 0.00 -1.51 0.00 0.00 37.83 32.86 1aco s LYS 564 CO 0.00 -0.68 0.21 0.00 -0.36 0.00 0.00 175.35 174.51 1aco s THR 566 N 1.01 3.22 0.23 0.00 2.01 -1.26 -0.55 115.64 120.29 1aco s THR 566 Ca 0.17 0.39 0.36 0.00 0.31 0.00 0.00 61.69 62.93 1aco s THR 566 Cb -0.23 -2.94 0.40 0.00 0.01 0.00 0.00 72.50 69.75 1aco s THR 566 CO -0.01 -0.52 2.08 0.71 -0.69 0.00 0.00 174.62 176.19 1aco h THR 567 N -1.19 0.00 0.00 -0.82 1.35 -1.28 -0.40 112.91 110.57 1aco h THR 567 Ca -0.45 -0.34 -0.03 0.00 -0.55 0.00 0.00 66.41 65.03 1aco h THR 567 Cb 1.25 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1aco h THR 567 CO 0.54 0.00 -0.16 0.44 -0.25 0.00 0.00 175.52 176.08 1aco h ASP 568 N 0.00 0.00 0.51 5.36 3.32 -1.82 0.34 116.42 124.12 1aco h ASP 568 Ca 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1aco h ASP 568 Cb 0.35 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.90 1aco h ASP 568 CO 0.00 0.16 -1.15 0.45 -1.72 0.00 0.00 179.24 176.98 1aco h HIS 569 N 0.00 0.56 0.20 4.55 3.86 -1.45 -2.94 115.15 119.94 1aco h HIS 569 Ca -0.00 -0.37 -0.29 0.00 -1.16 0.00 0.00 60.37 58.55 1aco h HIS 569 Cb 0.60 -0.04 0.03 0.00 1.06 0.00 0.00 27.41 29.07 1aco h HIS 569 CO 0.00 1.25 -1.25 0.82 0.86 0.00 0.00 177.93 179.61 1aco h ILE 570 N 0.13 1.35 -2.00 2.45 2.04 -1.33 -2.67 117.51 117.47 1aco h ILE 570 Ca -0.12 -2.61 -0.37 0.00 1.00 0.00 0.00 64.86 62.76 1aco h ILE 570 Cb 1.84 3.04 -0.32 0.00 -0.74 0.00 0.00 36.82 40.64 1aco h ILE 570 CO 0.19 0.77 -0.69 -0.55 0.00 0.00 0.00 178.15 177.88 1aco s SER 571 N -7.38 1.31 0.71 1.72 0.15 0.10 -1.05 113.70 109.27 1aco s SER 571 Ca -0.10 -1.51 -0.16 0.00 0.70 0.00 0.00 55.95 54.87 1aco s SER 571 Cb 0.03 0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 64.82 1aco s SER 571 CO 0.91 -0.28 0.63 0.00 1.20 0.00 0.00 173.24 175.70 1aco n ALA 572 N 4.36 -1.21 -2.24 5.45 0.00 -1.11 -4.42 120.51 121.34 1aco n ALA 572 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1aco n ALA 572 Cb 0.45 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 17.99 1aco n ALA 572 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aco n ALA 573 N -2.38 0.00 -0.83 0.00 0.00 -1.26 -4.65 120.51 111.38 1aco n ALA 573 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1aco n ALA 573 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1aco n ALA 573 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aco n GLY 574 N 5.00 3.95 0.26 0.00 0.00 -0.94 -2.04 105.19 111.42 1aco n GLY 574 Ca 0.00 0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.34 1aco n GLY 574 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aco h PRO 575 N 0.00 0.00 0.00 1.61 0.13 -1.90 -2.53 132.00 129.31 1aco h PRO 575 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1aco h PRO 575 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1aco h PRO 575 CO 0.00 0.13 0.00 0.91 -0.23 0.00 0.00 178.00 178.81 1aco n TRP 576 N -3.58 0.24 0.31 1.56 7.02 -0.87 -3.17 117.44 118.95 1aco n TRP 576 Ca -0.01 0.09 0.19 0.00 -1.02 0.00 0.00 57.50 56.75 1aco n TRP 576 Cb 0.27 -0.65 1.00 0.00 -2.42 0.00 0.00 31.31 29.51 1aco n TRP 576 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1aco h LEU 577 N 0.00 0.00 -2.23 -0.99 3.38 -1.61 -1.38 115.31 112.48 1aco h LEU 577 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1aco h LEU 577 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1aco h LEU 577 CO 0.00 0.02 -0.04 0.50 0.09 0.00 0.00 178.44 179.01 1aco h LYS 578 N 0.00 0.00 -0.49 1.13 3.64 -1.80 -2.41 116.57 116.64 1aco h LYS 578 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1aco h LYS 578 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1aco h LYS 578 CO 0.00 0.04 0.00 1.19 -2.27 0.00 0.00 179.45 178.41 1aco n PHE 579 N -3.93 1.22 0.28 1.91 3.72 -0.52 -4.66 117.46 115.48 1aco n PHE 579 Ca -0.03 -0.67 0.11 0.00 -0.05 0.00 0.00 57.45 56.81 1aco n PHE 579 Cb 0.13 -0.25 0.50 0.00 -0.94 0.00 0.00 39.48 38.92 1aco n PHE 579 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1aco n ARG 580 N 0.57 0.15 -0.32 -1.08 5.12 -0.91 -0.95 116.66 119.24 1aco n ARG 580 Ca 0.22 0.51 0.09 0.00 -1.93 0.00 0.00 57.85 56.75 1aco n ARG 580 Cb 0.84 -1.87 0.26 0.00 -1.16 0.00 0.00 32.46 30.53 1aco n ARG 580 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1aco n GLY 581 N -0.66 2.68 2.83 -0.13 0.00 -1.20 -4.27 105.19 104.44 1aco n GLY 581 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 1aco n GLY 581 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1aco s HIS 582 N -1.13 2.52 0.25 1.61 5.65 -0.12 -1.31 115.29 122.75 1aco s HIS 582 Ca 0.39 -2.51 -0.05 0.00 0.25 0.00 0.00 55.06 53.14 1aco s HIS 582 Cb 0.21 -2.24 0.30 0.00 -1.18 0.00 0.00 32.58 29.68 1aco s HIS 582 CO 0.25 -0.84 1.90 1.25 -0.65 0.00 0.00 174.74 176.65 1aco h LEU 583 N 7.24 1.04 -0.63 8.88 5.85 -1.84 -1.75 115.31 134.10 1aco h LEU 583 Ca -0.06 -0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.50 1aco h LEU 583 Cb 0.96 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1aco h LEU 583 CO 0.52 0.72 -0.54 -0.78 -0.34 0.00 0.00 178.44 178.02 1aco h ASP 584 N 1.21 0.44 0.03 1.25 3.58 -1.95 -2.25 116.42 118.73 1aco h ASP 584 Ca 0.38 -0.23 -0.23 0.00 0.42 0.00 0.00 57.03 57.37 1aco h ASP 584 Cb -0.01 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 40.92 1aco h ASP 584 CO -0.12 0.90 -0.86 0.78 -2.88 0.00 0.00 179.24 177.06 1aco h ASN 585 N 0.31 0.80 1.29 2.28 -0.26 -1.81 -3.05 115.58 115.13 1aco h ASN 585 Ca 0.01 -0.57 -0.05 0.00 -0.56 0.00 0.00 56.30 55.13 1aco h ASN 585 Cb 1.05 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 38.06 1aco h ASN 585 CO 0.09 1.36 -0.24 -0.29 -1.06 0.00 0.00 177.43 177.28 1aco h ILE 586 N 0.42 0.50 0.00 2.81 2.10 -1.31 -3.02 117.51 119.00 1aco h ILE 586 Ca -0.07 -1.36 0.00 0.00 1.08 0.00 0.00 64.86 64.51 1aco h ILE 586 Cb 1.48 1.98 0.00 0.00 -1.09 0.00 0.00 36.82 39.19 1aco h ILE 586 CO 0.17 0.24 0.00 -1.20 -1.08 0.00 0.00 178.15 176.28 1aco n SER 587 N -3.26 0.08 0.00 2.19 7.64 -0.85 -1.32 113.62 118.09 1aco n SER 587 Ca 0.01 0.54 0.11 0.00 1.01 0.00 0.00 58.87 60.54 1aco n SER 587 Cb 0.53 -0.55 0.63 0.00 -1.01 0.00 0.00 64.21 63.81 1aco n SER 587 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1aco n ASN 588 N -1.61 0.00 -0.79 6.43 3.02 -1.14 -2.43 115.26 118.74 1aco n ASN 588 Ca -0.00 -0.53 0.09 0.00 -0.03 0.00 0.00 54.58 54.11 1aco n ASN 588 Cb 0.01 -0.07 0.10 0.00 -0.61 0.00 0.00 39.78 39.21 1aco n ASN 588 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1aco n ASN 589 N -1.07 2.69 -4.46 6.41 2.04 -0.44 -4.80 115.26 115.65 1aco n ASN 589 Ca 0.15 -1.81 -0.54 0.00 -0.44 0.00 0.00 54.58 51.94 1aco n ASN 589 Cb 0.10 -0.05 -0.08 0.00 -2.53 0.00 0.00 39.78 37.21 1aco n ASN 589 CO 0.00 0.00 0.00 -0.11 -0.44 0.00 0.00 177.26 176.71 1aco n LEU 590 N 1.08 1.86 -1.99 -4.53 7.94 -1.02 -1.73 117.00 118.61 1aco n LEU 590 Ca 0.12 0.61 -0.21 0.00 -1.11 0.00 0.00 56.01 55.43 1aco n LEU 590 Cb 0.48 -1.15 -0.05 0.00 0.53 0.00 0.00 43.42 43.23 1aco n LEU 590 CO 0.12 -0.68 -0.23 0.18 -1.11 0.00 0.00 177.39 175.67 1aco n LEU 591 N 8.37 -1.73 0.07 -1.96 4.77 -0.21 -3.80 117.00 122.51 1aco n LEU 591 Ca 0.41 0.25 0.10 0.00 -0.03 0.00 0.00 56.01 56.75 1aco n LEU 591 Cb 0.14 -2.90 0.43 0.00 -2.33 0.00 0.00 43.42 38.76 1aco n LEU 591 CO 0.80 -0.66 0.82 2.30 -1.33 0.00 0.00 177.39 179.32 1aco n ILE 592 N -3.20 0.80 0.65 -0.08 -5.35 -0.70 -2.33 119.36 109.14 1aco n ILE 592 Ca -0.23 0.17 0.11 0.00 -0.27 0.00 0.00 62.75 62.53 1aco n ILE 592 Cb 0.69 -1.00 -0.04 0.00 -1.74 0.00 0.00 39.64 37.55 1aco n ILE 592 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1aco n GLY 593 N 0.24 -1.11 3.77 3.28 0.00 -1.01 -3.05 105.19 107.31 1aco n GLY 593 Ca 0.03 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 1aco n GLY 593 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aco s ALA 594 N -3.17 2.99 -0.20 4.61 0.00 -0.98 -4.83 121.76 120.17 1aco s ALA 594 Ca 0.04 0.98 -0.19 0.00 0.00 0.00 0.00 51.96 52.79 1aco s ALA 594 Cb 0.15 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 1aco s ALA 594 CO 0.83 -0.71 0.55 0.42 0.00 0.00 0.00 175.76 176.85 1aco s ILE 595 N -1.50 5.08 -0.01 0.00 -1.09 -1.26 -3.89 121.20 118.52 1aco s ILE 595 Ca 0.63 1.02 -0.30 0.00 -2.23 0.00 0.00 60.65 59.77 1aco s ILE 595 Cb -0.30 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.67 1aco s ILE 595 CO 0.37 0.16 1.15 0.21 -1.23 0.00 0.00 174.94 175.59 1aco s ASN 596 N 1.16 7.13 0.40 3.58 2.47 -0.17 -1.44 114.94 128.07 1aco s ASN 596 Ca 0.25 1.83 0.17 0.00 0.42 0.00 0.00 52.86 55.53 1aco s ASN 596 Cb -0.16 -2.57 0.84 0.00 -1.45 0.00 0.00 41.25 37.91 1aco s ASN 596 CO 0.10 -0.48 1.84 0.77 -3.72 0.00 0.00 177.10 175.61 1aco h SER 597 N 7.10 0.00 -0.48 -4.21 4.64 -1.61 0.22 113.55 119.21 1aco h SER 597 Ca -0.37 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.97 1aco h SER 597 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 1aco h SER 597 CO 0.83 0.33 0.28 -0.08 -0.87 0.00 0.00 176.83 177.33 1aco h GLU 598 N 0.00 0.54 0.00 4.77 4.81 -1.93 -3.33 114.58 119.45 1aco h GLU 598 Ca -0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1aco h GLU 598 Cb 0.68 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1aco h GLU 598 CO 0.04 0.36 0.00 0.27 -0.73 0.00 0.00 179.01 178.95 1aco n ASN 599 N -4.83 0.83 -0.84 1.04 0.23 -1.20 -4.99 115.26 105.50 1aco n ASN 599 Ca 0.03 -1.13 -0.11 0.00 -0.53 0.00 0.00 54.58 52.84 1aco n ASN 599 Cb 0.08 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.73 1aco n ASN 599 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1aco n ARG 600 N -0.07 -0.93 -4.14 -3.83 3.00 0.77 -5.01 116.66 106.46 1aco n ARG 600 Ca 0.00 0.86 -0.27 0.00 -0.01 0.00 0.00 57.85 58.43 1aco n ARG 600 Cb 0.12 -4.88 -0.07 0.00 0.00 0.00 0.00 32.46 27.63 1aco n ARG 600 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1aco s LYS 601 N -2.82 2.64 0.06 5.56 3.01 -1.24 -4.74 119.74 122.21 1aco s LYS 601 Ca 0.00 -0.98 -0.19 0.00 -1.01 0.00 0.00 55.97 53.79 1aco s LYS 601 Cb 0.00 -2.50 -0.06 0.00 -1.01 0.00 0.00 37.83 34.25 1aco s LYS 601 CO 0.00 0.47 0.57 0.00 0.51 0.00 0.00 175.35 176.90 1aco s ALA 602 N -1.71 3.57 -1.48 5.17 0.00 -1.26 -1.00 121.76 125.06 1aco s ALA 602 Ca 0.29 0.02 -0.11 0.00 0.00 0.00 0.00 51.96 52.16 1aco s ALA 602 Cb -0.10 -2.65 0.07 0.00 0.00 0.00 0.00 23.12 20.44 1aco s ALA 602 CO 0.21 0.36 0.84 -1.71 0.00 0.00 0.00 175.76 175.46 1aco n ASN 603 N 1.92 -4.91 -3.49 0.00 5.15 -1.17 -4.99 115.26 107.76 1aco n ASN 603 Ca -0.10 -0.61 -0.26 0.00 -0.60 0.00 0.00 54.58 53.02 1aco n ASN 603 Cb 0.51 -3.95 -0.13 0.00 -0.53 0.00 0.00 39.78 35.68 1aco n ASN 603 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1aco s SER 604 N -3.09 2.95 0.10 1.20 0.15 -1.25 -3.64 113.70 110.13 1aco s SER 604 Ca 0.56 -1.21 0.09 0.00 0.70 0.00 0.00 55.95 56.08 1aco s SER 604 Cb -0.28 -0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 63.90 1aco s SER 604 CO 0.68 -0.41 -0.22 0.68 1.20 0.00 0.00 173.24 175.17 1aco s VAL 605 N 2.09 1.82 -0.12 4.45 -7.23 0.07 -4.81 120.40 116.68 1aco s VAL 605 Ca 0.10 -1.53 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 1aco s VAL 605 Cb -0.16 -1.63 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 1aco s VAL 605 CO -0.33 0.02 1.40 -0.60 -0.31 0.00 0.00 175.10 175.28 1aco s ARG 606 N -1.81 4.22 -0.15 4.82 3.52 -1.26 -0.72 118.95 127.57 1aco s ARG 606 Ca 0.08 1.86 -0.29 0.00 -0.13 0.00 0.00 55.73 57.25 1aco s ARG 606 Cb -0.10 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.44 1aco s ARG 606 CO 0.04 -0.74 1.45 1.21 -0.81 0.00 0.00 175.30 176.45 1aco s ASN 607 N 2.42 6.75 0.57 -2.12 3.84 0.05 -4.92 114.94 121.53 1aco s ASN 607 Ca 0.62 1.82 0.32 0.00 0.21 0.00 0.00 52.86 55.83 1aco s ASN 607 Cb -0.26 -2.54 1.72 0.00 -0.55 0.00 0.00 41.25 39.63 1aco s ASN 607 CO 0.21 -0.91 2.16 0.00 -2.79 0.00 0.00 177.10 175.76 1aco h ALA 608 N 9.09 1.22 0.01 1.71 0.00 -1.94 0.32 119.26 129.67 1aco h ALA 608 Ca -0.32 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.31 1aco h ALA 608 Cb 1.13 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1aco h ALA 608 CO 0.97 0.07 -1.25 0.28 0.00 0.00 0.00 179.25 179.33 1aco h VAL 609 N 0.00 0.94 0.00 0.00 2.07 -1.97 -3.41 116.25 113.88 1aco h VAL 609 Ca -0.00 -2.19 -0.07 0.00 0.82 0.00 0.00 66.70 65.25 1aco h VAL 609 Cb 0.23 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1aco h VAL 609 CO 0.01 0.35 -0.90 0.71 0.02 0.00 0.00 177.57 177.76 1aco h THR 610 N -0.94 0.32 -2.18 2.57 1.35 -1.98 -3.47 112.91 108.58 1aco h THR 610 Ca -0.34 -1.55 -0.33 0.00 -0.55 0.00 0.00 66.41 63.64 1aco h THR 610 Cb 1.33 1.92 -0.03 0.00 -1.73 0.00 0.00 68.15 69.64 1aco h THR 610 CO -0.19 0.18 -0.41 0.00 -0.25 0.00 0.00 175.52 174.86 1aco n GLN 611 N -2.91 -1.29 -4.09 4.72 1.13 0.10 -5.01 117.38 110.03 1aco n GLN 611 Ca -0.02 0.82 -0.33 0.00 -1.94 0.00 0.00 57.00 55.52 1aco n GLN 611 Cb 0.68 -5.21 -0.07 0.00 0.11 0.00 0.00 30.24 25.75 1aco n GLN 611 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1aco s GLU 612 N -4.68 3.12 -0.00 -1.09 0.41 -1.25 -4.88 118.70 110.32 1aco s GLU 612 Ca 0.00 -0.44 -0.19 0.00 -0.41 0.00 0.00 54.97 53.93 1aco s GLU 612 Cb 0.00 -2.90 -0.06 0.00 -1.78 0.00 0.00 34.13 29.40 1aco s GLU 612 CO 0.00 0.67 0.55 -0.06 -0.49 0.00 0.00 175.26 175.92 1aco s PHE 613 N -1.16 3.69 0.27 1.61 0.40 -1.26 -0.77 117.98 120.76 1aco s PHE 613 Ca 0.22 1.14 -0.09 0.00 -0.60 0.00 0.00 56.93 57.60 1aco s PHE 613 Cb -0.12 -2.53 0.04 0.00 0.51 0.00 0.00 43.02 40.91 1aco s PHE 613 CO 0.12 0.42 0.52 0.41 0.70 0.00 0.00 175.22 177.39 1aco n GLY 614 N 2.31 1.46 3.69 4.36 0.00 0.10 -4.87 105.19 112.25 1aco n GLY 614 Ca -0.09 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1aco n GLY 614 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1aco n PRO 615 N -0.38 1.92 -0.01 1.61 -0.02 -1.24 -0.75 135.00 136.13 1aco n PRO 615 Ca -0.05 0.68 -0.12 0.00 -2.02 0.00 0.00 63.50 61.99 1aco n PRO 615 Cb 0.42 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.51 1aco n PRO 615 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1aco h VAL 616 N 2.17 1.14 -0.50 -1.45 2.07 -1.84 -1.50 116.25 116.34 1aco h VAL 616 Ca -0.47 -0.41 0.09 0.00 0.82 0.00 0.00 66.70 66.74 1aco h VAL 616 Cb 1.30 1.27 -0.07 0.00 -1.52 0.00 0.00 31.29 32.27 1aco h VAL 616 CO 0.60 0.12 0.07 -0.65 0.02 0.00 0.00 177.57 177.73 1aco h PRO 617 N -0.03 0.19 -0.76 1.57 0.11 -1.87 -1.35 132.00 129.86 1aco h PRO 617 Ca 0.02 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.06 1aco h PRO 617 Cb 0.16 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.19 1aco h PRO 617 CO -0.00 0.13 0.24 -0.44 -0.21 0.00 0.00 178.00 177.71 1aco h ASP 618 N 0.20 1.10 -0.57 -2.05 5.19 -1.91 0.07 116.42 118.45 1aco h ASP 618 Ca 0.25 -0.21 -0.07 0.00 -0.62 0.00 0.00 57.03 56.39 1aco h ASP 618 Cb 0.36 -0.29 -0.02 0.00 0.18 0.00 0.00 39.33 39.56 1aco h ASP 618 CO -0.36 1.01 0.08 0.74 -3.12 0.00 0.00 179.24 177.60 1aco h THR 619 N 1.13 1.26 -0.56 0.35 2.02 -0.76 -0.72 112.91 115.62 1aco h THR 619 Ca 0.24 -1.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.36 1aco h THR 619 Cb 0.30 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1aco h THR 619 CO -0.01 0.36 0.09 0.00 0.37 0.00 0.00 175.52 176.33 1aco h ALA 620 N 1.00 0.75 -0.42 6.16 0.00 -0.99 -0.30 119.26 125.46 1aco h ALA 620 Ca 0.17 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1aco h ALA 620 Cb 0.43 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1aco h ALA 620 CO 0.01 0.49 -0.08 0.00 0.00 0.00 0.00 179.25 179.68 1aco h ARG 621 N 0.83 0.73 -0.28 0.00 3.08 -0.84 -0.87 114.38 117.02 1aco h ARG 621 Ca 0.17 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1aco h ARG 621 Cb 0.42 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1aco h ARG 621 CO 0.01 0.79 0.13 -0.92 -1.07 0.00 0.00 179.97 178.92 1aco h TYR 622 N 0.67 0.41 -0.61 3.04 5.03 -0.68 -0.22 116.97 124.62 1aco h TYR 622 Ca 0.12 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 1aco h TYR 622 Cb 0.53 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 1aco h TYR 622 CO 0.03 0.38 0.33 1.88 -1.32 0.00 0.00 178.16 179.46 1aco h TYR 623 N 0.32 0.83 -0.61 -3.82 0.05 -0.76 -2.15 116.97 110.83 1aco h TYR 623 Ca 0.10 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.83 1aco h TYR 623 Cb 0.13 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.58 1aco h TYR 623 CO -0.02 0.60 0.26 -0.22 -1.05 0.00 0.00 178.16 177.73 1aco h LYS 624 N 0.82 0.89 -0.87 4.88 3.64 -0.94 0.18 116.57 125.18 1aco h LYS 624 Ca 0.21 -0.15 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 1aco h LYS 624 Cb 0.04 -0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 31.65 1aco h LYS 624 CO -0.03 0.75 0.57 0.37 -2.27 0.00 0.00 179.45 178.83 1aco h GLN 625 N 0.84 0.91 -0.68 1.90 4.15 -0.73 -2.42 115.11 119.09 1aco h GLN 625 Ca 0.20 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1aco h GLN 625 Cb 0.17 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.65 1aco h GLN 625 CO -0.02 0.60 0.00 0.72 -1.93 0.00 0.00 178.83 178.20 1aco n HIS 626 N -4.50 1.19 -2.13 3.99 8.25 -0.79 -4.94 115.22 116.30 1aco n HIS 626 Ca 0.14 -0.52 -0.13 0.00 -0.26 0.00 0.00 57.72 56.95 1aco n HIS 626 Cb 0.24 -0.12 -0.01 0.00 1.12 0.00 0.00 29.99 31.21 1aco n HIS 626 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1aco n GLY 627 N 1.35 0.05 3.55 -1.41 0.00 -0.50 -5.00 105.19 103.24 1aco n GLY 627 Ca 0.24 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1aco n GLY 627 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aco s ILE 628 N -2.64 5.15 0.10 -0.61 1.01 0.52 -5.00 121.20 119.74 1aco s ILE 628 Ca 0.00 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.54 1aco s ILE 628 Cb 0.00 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.59 1aco s ILE 628 CO 0.00 -0.07 0.82 -0.13 0.00 0.00 0.00 174.94 175.56 1aco s ARG 629 N 2.07 4.58 0.28 2.79 0.52 -1.26 -4.08 118.95 123.84 1aco s ARG 629 Ca 0.13 1.19 0.03 0.00 -0.52 0.00 0.00 55.73 56.56 1aco s ARG 629 Cb -0.16 -3.33 -0.06 0.00 0.52 0.00 0.00 34.95 31.92 1aco s ARG 629 CO 0.12 0.36 0.06 1.67 0.02 0.00 0.00 175.30 177.53 1aco s TRP 630 N -0.41 1.71 0.07 -0.53 1.48 -1.23 -1.20 118.94 118.83 1aco s TRP 630 Ca 0.40 -1.03 0.03 0.00 -1.06 0.00 0.00 56.10 54.43 1aco s TRP 630 Cb -0.22 -1.05 -0.03 0.00 -1.16 0.00 0.00 33.47 31.01 1aco s TRP 630 CO 0.26 -0.13 -0.09 0.08 -4.06 0.00 0.00 176.95 173.00 1aco s VAL 631 N -3.50 0.77 -0.06 -0.66 1.01 -0.40 -0.71 120.40 116.85 1aco s VAL 631 Ca 0.35 -1.46 0.03 0.00 0.00 0.00 0.00 61.98 60.91 1aco s VAL 631 Cb 0.08 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 1aco s VAL 631 CO 0.13 -0.52 -0.14 -0.69 0.00 0.00 0.00 175.10 173.88 1aco s VAL 632 N -2.15 3.08 -0.17 2.92 1.01 -0.99 -0.57 120.40 123.51 1aco s VAL 632 Ca 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 1aco s VAL 632 Cb -0.05 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 1aco s VAL 632 CO -0.00 0.58 -0.08 -0.63 0.00 0.00 0.00 175.10 174.97 1aco s ILE 633 N -0.61 3.34 0.41 2.22 -1.09 -0.61 -1.32 121.20 123.54 1aco s ILE 633 Ca 0.09 -0.53 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 1aco s ILE 633 Cb -0.11 -2.47 -0.04 0.00 -1.58 0.00 0.00 42.46 38.26 1aco s ILE 633 CO 0.01 0.48 0.07 -0.83 -1.23 0.00 0.00 174.94 173.44 1aco s GLY 634 N 0.85 2.54 0.00 6.18 0.00 0.84 -0.95 107.32 116.77 1aco s GLY 634 Ca -0.02 -1.38 0.00 0.00 0.00 0.00 0.00 44.72 43.32 1aco s GLY 634 CO 0.01 -1.92 0.00 1.34 0.00 0.00 0.00 173.10 172.53 1aco n ASP 635 N -1.10 0.00 -4.83 1.64 -0.08 -1.26 -2.98 116.55 107.95 1aco n ASP 635 Ca -0.08 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.87 1aco n ASP 635 Cb 0.66 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 44.05 1aco n ASP 635 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1aco s GLU 636 N 4.99 4.18 -1.52 -0.67 0.41 -1.26 -1.61 118.70 123.22 1aco s GLU 636 Ca 0.00 0.97 -0.05 0.00 -0.41 0.00 0.00 54.97 55.47 1aco s GLU 636 Cb 0.00 -2.36 0.05 0.00 -1.78 0.00 0.00 34.13 30.04 1aco s GLU 636 CO 0.00 0.08 0.44 -1.71 -0.49 0.00 0.00 175.26 173.58 1aco n ASN 637 N -0.37 -0.86 -4.73 -0.19 4.05 -1.00 -4.69 115.26 107.47 1aco n ASN 637 Ca 0.05 -1.07 -0.42 0.00 0.45 0.00 0.00 54.58 53.59 1aco n ASN 637 Cb 0.53 -2.66 -0.03 0.00 1.23 0.00 0.00 39.78 38.86 1aco n ASN 637 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1aco s TYR 638 N -3.85 3.08 0.00 1.20 6.14 0.05 -2.60 117.35 121.36 1aco s TYR 638 Ca 0.21 0.89 0.00 0.00 0.64 0.00 0.00 57.07 58.82 1aco s TYR 638 Cb -0.12 -3.82 0.00 0.00 0.42 0.00 0.00 41.96 38.44 1aco s TYR 638 CO 0.92 -2.83 0.00 0.41 0.64 0.00 0.00 175.55 174.69 1aco n GLY 639 N 2.90 0.76 3.55 8.97 0.00 0.29 -1.53 105.19 120.13 1aco n GLY 639 Ca 0.10 -0.10 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1aco n GLY 639 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1aco n GLU 640 N -2.46 1.07 0.00 1.61 2.13 -1.07 -4.17 120.64 117.75 1aco n GLU 640 Ca 0.00 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.20 1aco n GLU 640 Cb 0.00 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.03 1aco n GLU 640 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1aco n GLY 641 N 1.40 0.43 3.43 8.31 0.00 -1.26 -1.11 105.19 116.39 1aco n GLY 641 Ca 0.11 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.96 1aco n GLY 641 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aco n SER 642 N 0.00 -1.41 -0.05 1.61 2.88 -1.26 -4.88 113.62 110.51 1aco n SER 642 Ca 0.00 0.78 0.14 0.00 -1.33 0.00 0.00 58.87 58.45 1aco n SER 642 Cb 0.00 -1.10 0.56 0.00 -0.75 0.00 0.00 64.21 62.92 1aco n SER 642 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1aco n SER 643 N 1.06 0.31 -4.40 -3.46 3.41 -1.26 -4.73 113.62 104.54 1aco n SER 643 Ca 0.11 -0.19 -0.57 0.00 -0.26 0.00 0.00 58.87 57.95 1aco n SER 643 Cb 0.45 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.16 1aco n SER 643 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1aco n ARG 644 N -1.23 0.46 0.00 4.33 1.85 -1.26 -4.45 116.66 116.36 1aco n ARG 644 Ca 0.11 0.14 0.04 0.00 -1.00 0.00 0.00 57.85 57.14 1aco n ARG 644 Cb 0.30 -1.87 0.19 0.00 -1.05 0.00 0.00 32.46 30.03 1aco n ARG 644 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 1aco n GLU 645 N 7.21 0.06 0.26 2.89 0.28 -1.26 -2.47 120.64 127.61 1aco n GLU 645 Ca 0.46 0.28 0.11 0.00 -0.16 0.00 0.00 57.16 57.85 1aco n GLU 645 Cb 0.06 -1.50 0.72 0.00 1.43 0.00 0.00 31.44 32.16 1aco n GLU 645 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1aco h HIS 646 N 0.00 0.00 0.00 -1.84 3.86 -1.98 0.10 115.15 115.29 1aco h HIS 646 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1aco h HIS 646 Cb 0.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1aco h HIS 646 CO 0.00 0.10 0.00 0.43 0.86 0.00 0.00 177.93 179.32 1aco n SER 647 N -3.89 0.39 -0.09 2.45 7.64 -1.03 -1.12 113.62 117.96 1aco n SER 647 Ca -0.02 0.58 -0.12 0.00 1.01 0.00 0.00 58.87 60.31 1aco n SER 647 Cb 0.19 -0.67 -0.10 0.00 -1.01 0.00 0.00 64.21 62.62 1aco n SER 647 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aco n ALA 648 N -1.65 1.58 -0.25 -0.43 0.00 0.21 -4.50 120.51 115.46 1aco n ALA 648 Ca 0.04 -0.89 -0.07 0.00 0.00 0.00 0.00 53.44 52.51 1aco n ALA 648 Cb 0.25 0.01 0.04 0.00 0.00 0.00 0.00 19.45 19.76 1aco n ALA 648 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1aco h LEU 649 N 0.00 1.08 -0.17 0.00 3.38 -0.90 -3.02 115.31 115.69 1aco h LEU 649 Ca -0.44 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.28 1aco h LEU 649 Cb 1.75 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1aco h LEU 649 CO -0.05 1.04 0.04 -0.33 0.09 0.00 0.00 178.44 179.23 1aco h GLU 650 N 1.07 0.26 -0.17 1.13 5.08 -1.38 -1.25 114.58 119.32 1aco h GLU 650 Ca 0.22 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1aco h GLU 650 Cb 0.39 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1aco h GLU 650 CO 0.00 0.40 -0.08 -1.00 -1.00 0.00 0.00 179.01 177.34 1aco h PRO 651 N 0.08 0.25 -0.25 2.33 0.13 -1.79 -2.08 132.00 130.67 1aco h PRO 651 Ca 0.05 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.08 1aco h PRO 651 Cb 0.26 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.34 1aco h PRO 651 CO 0.00 0.35 -0.04 -0.09 -0.23 0.00 0.00 178.00 177.98 1aco h ARG 652 N 0.24 0.47 -0.72 0.86 9.65 -1.35 0.14 114.38 123.68 1aco h ARG 652 Ca 0.05 -0.17 -0.03 0.00 -1.10 0.00 0.00 59.98 58.73 1aco h ARG 652 Cb 0.30 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.82 1aco h ARG 652 CO 0.01 0.68 0.33 0.35 2.80 0.00 0.00 179.97 184.14 1aco h PHE 653 N 0.23 1.04 -0.33 2.20 3.57 -1.00 -2.69 116.94 119.95 1aco h PHE 653 Ca 0.07 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1aco h PHE 653 Cb 0.50 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1aco h PHE 653 CO 0.05 0.77 0.00 1.28 -2.23 0.00 0.00 178.31 178.17 1aco n LEU 654 N -4.32 3.30 0.00 0.59 4.77 -0.80 -4.89 117.00 115.64 1aco n LEU 654 Ca 0.07 -1.67 0.00 0.00 -0.03 0.00 0.00 56.01 54.38 1aco n LEU 654 Cb 0.15 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1aco n LEU 654 CO 0.39 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1aco n GLY 655 N 0.51 0.86 3.78 -0.72 0.00 -1.01 -4.48 105.19 104.14 1aco n GLY 655 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1aco n GLY 655 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aco s GLY 656 N -1.93 2.24 0.00 -0.02 0.00 0.46 -3.54 107.32 104.54 1aco s GLY 656 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.29 1aco s GLY 656 CO 0.00 0.92 0.00 0.54 0.00 0.00 0.00 173.10 174.56 1aco n ARG 657 N -2.12 1.44 -3.61 2.90 3.00 0.11 -4.55 116.66 113.83 1aco n ARG 657 Ca 0.10 0.00 -0.12 0.00 -0.01 0.00 0.00 57.85 57.82 1aco n ARG 657 Cb 0.52 -0.92 -0.05 0.00 0.00 0.00 0.00 32.46 32.01 1aco n ARG 657 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1aco s ALA 658 N -1.83 -1.09 -0.08 7.54 0.00 -1.25 -2.26 121.76 122.79 1aco s ALA 658 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 51.96 52.17 1aco s ALA 658 Cb 0.00 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.70 1aco s ALA 658 CO 0.00 -0.58 -0.03 0.42 0.00 0.00 0.00 175.76 175.58 1aco s ILE 659 N -3.17 0.60 -0.18 0.00 -1.09 -0.76 -2.36 121.20 114.24 1aco s ILE 659 Ca -0.01 -0.02 0.01 0.00 -2.23 0.00 0.00 60.65 58.40 1aco s ILE 659 Cb 0.00 -0.70 0.02 0.00 -1.58 0.00 0.00 42.46 40.20 1aco s ILE 659 CO -0.07 0.30 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.11 1aco s ILE 660 N 1.86 2.19 0.26 2.92 1.01 -0.43 -1.39 121.20 127.63 1aco s ILE 660 Ca 0.05 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.81 1aco s ILE 660 Cb -0.12 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1aco s ILE 660 CO -0.06 0.53 0.17 0.42 0.00 0.00 0.00 174.94 176.00 1aco s THR 661 N 1.21 0.15 0.11 2.92 -4.23 -0.58 -0.11 115.64 115.10 1aco s THR 661 Ca 0.03 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.48 1aco s THR 661 Cb -0.14 -2.52 -0.22 0.00 1.34 0.00 0.00 72.50 70.97 1aco s THR 661 CO -0.10 0.00 1.24 0.11 -0.54 0.00 0.00 174.62 175.33 1aco h LYS 662 N 2.38 0.41 -2.74 3.99 1.57 -1.19 -1.74 116.57 119.25 1aco h LYS 662 Ca -0.33 -0.50 0.05 0.00 -1.87 0.00 0.00 60.65 57.99 1aco h LYS 662 Cb 1.25 0.16 -0.11 0.00 0.08 0.00 0.00 32.23 33.60 1aco h LYS 662 CO 0.50 1.17 0.32 -1.54 -0.57 0.00 0.00 179.45 179.33 1aco s SER 663 N -7.15 -0.43 0.16 0.86 1.04 -1.15 -4.60 113.70 102.43 1aco s SER 663 Ca -0.06 -0.13 0.11 0.00 0.48 0.00 0.00 55.95 56.35 1aco s SER 663 Cb 0.08 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1aco s SER 663 CO 0.88 -0.92 -0.25 -0.36 0.98 0.00 0.00 173.24 173.57 1aco s PHE 664 N -3.56 2.26 0.40 5.02 0.08 -1.26 -0.77 117.98 120.15 1aco s PHE 664 Ca 0.05 -0.38 -0.23 0.00 0.12 0.00 0.00 56.93 56.50 1aco s PHE 664 Cb -0.02 -1.18 -0.11 0.00 -0.57 0.00 0.00 43.02 41.15 1aco s PHE 664 CO -0.07 0.40 0.95 0.00 -0.10 0.00 0.00 175.22 176.40 1aco s ALA 665 N -1.36 3.08 0.12 5.36 0.00 -0.59 -4.75 121.76 123.63 1aco s ALA 665 Ca 0.17 0.45 -0.23 0.00 0.00 0.00 0.00 51.96 52.34 1aco s ALA 665 Cb -0.09 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 1aco s ALA 665 CO 0.08 0.12 1.67 -0.09 0.00 0.00 0.00 175.76 177.54 1aco h ARG 666 N 2.28 -0.22 -0.46 0.00 2.43 -1.91 -2.12 114.38 114.37 1aco h ARG 666 Ca -0.48 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 58.56 1aco h ARG 666 Cb 1.19 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1aco h ARG 666 CO 0.62 -0.15 -0.26 0.82 -1.51 0.00 0.00 179.97 179.50 1aco h ILE 667 N -0.23 1.27 -0.63 1.20 2.04 -1.92 -2.26 117.51 116.97 1aco h ILE 667 Ca 0.07 -1.43 -0.08 0.00 1.00 0.00 0.00 64.86 64.42 1aco h ILE 667 Cb 0.32 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1aco h ILE 667 CO -0.19 0.49 0.07 -0.74 0.00 0.00 0.00 178.15 177.78 1aco h HIS 668 N 0.84 1.14 -0.94 1.37 2.76 -1.78 -0.61 115.15 117.93 1aco h HIS 668 Ca 0.10 -0.17 0.02 0.00 -2.20 0.00 0.00 60.37 58.12 1aco h HIS 668 Cb 0.84 -0.31 -0.05 0.00 1.55 0.00 0.00 27.41 29.45 1aco h HIS 668 CO 0.06 0.98 0.62 1.49 -1.30 0.00 0.00 177.93 179.77 1aco h GLU 669 N 0.97 1.20 -0.32 5.26 4.81 -1.22 -0.25 114.58 125.04 1aco h GLU 669 Ca 0.19 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1aco h GLU 669 Cb 0.48 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1aco h GLU 669 CO 0.02 0.80 0.00 1.15 -0.73 0.00 0.00 179.01 180.25 1aco h THR 670 N 1.24 1.26 -0.67 0.32 2.02 -0.99 -2.61 112.91 113.47 1aco h THR 670 Ca 0.35 -0.95 0.01 0.00 0.77 0.00 0.00 66.41 66.59 1aco h THR 670 Cb -0.09 1.25 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1aco h THR 670 CO -0.09 0.31 0.45 0.78 0.37 0.00 0.00 175.52 177.33 1aco h ASN 671 N 0.36 0.77 -0.21 4.18 -0.26 -0.58 -0.57 115.58 119.26 1aco h ASN 671 Ca 0.09 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.80 1aco h ASN 671 Cb 0.44 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.50 1aco h ASN 671 CO 0.02 0.55 0.11 -0.07 -1.06 0.00 0.00 177.43 176.98 1aco h LEU 672 N 0.90 0.27 -0.74 1.61 3.38 -0.88 -2.46 115.31 117.40 1aco h LEU 672 Ca 0.25 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1aco h LEU 672 Cb -0.10 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1aco h LEU 672 CO -0.05 0.31 0.37 0.11 0.09 0.00 0.00 178.44 179.26 1aco h LYS 673 N 0.22 1.05 -0.52 1.13 1.57 -1.17 -1.49 116.57 117.37 1aco h LYS 673 Ca 0.07 -0.15 0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1aco h LYS 673 Cb 0.10 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1aco h LYS 673 CO -0.01 0.81 0.35 0.87 -0.57 0.00 0.00 179.45 180.90 1aco h LYS 674 N 1.03 0.36 -0.65 3.15 1.79 -0.78 -2.37 116.57 119.09 1aco h LYS 674 Ca 0.25 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1aco h LYS 674 Cb 0.10 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1aco h LYS 674 CO -0.03 0.24 0.00 1.04 -1.08 0.00 0.00 179.45 179.61 1aco n GLN 675 N -4.47 3.14 -0.86 3.15 1.13 -0.96 -0.49 117.38 118.02 1aco n GLN 675 Ca 0.08 -2.51 0.00 0.00 -1.94 0.00 0.00 57.00 52.63 1aco n GLN 675 Cb 0.32 -1.72 0.00 0.00 0.11 0.00 0.00 30.24 28.95 1aco n GLN 675 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aco n GLY 676 N 1.24 0.53 3.96 1.08 0.00 -0.89 -4.68 105.19 106.43 1aco n GLY 676 Ca 0.23 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 1aco n GLY 676 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aco s LEU 677 N 0.00 3.73 -0.48 0.99 1.43 -0.59 -4.88 118.68 118.88 1aco s LEU 677 Ca 0.00 0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 53.18 1aco s LEU 677 Cb 0.00 -3.08 0.11 0.00 0.03 0.00 0.00 46.19 43.25 1aco s LEU 677 CO 0.00 -0.63 0.37 -0.76 0.23 0.00 0.00 176.35 175.56 1aco s LEU 678 N -4.47 5.73 -0.26 1.79 1.43 -0.96 -4.08 118.68 117.86 1aco s LEU 678 Ca 0.47 -1.77 -0.29 0.00 -1.03 0.00 0.00 54.13 51.52 1aco s LEU 678 Cb -0.10 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.06 1aco s LEU 678 CO 0.36 -0.71 1.04 -2.16 0.23 0.00 0.00 176.35 175.11 1aco s PRO 679 N 1.45 4.19 0.04 1.29 0.04 -1.26 -1.83 135.00 138.92 1aco s PRO 679 Ca 0.04 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.37 1aco s PRO 679 Cb -0.27 -3.67 -0.02 0.00 0.04 0.00 0.00 34.50 30.58 1aco s PRO 679 CO 0.01 -0.72 -0.15 -0.51 0.04 0.00 0.00 177.00 175.67 1aco s LEU 680 N 3.33 2.18 0.18 -3.56 1.43 -0.49 -4.71 118.68 117.04 1aco s LEU 680 Ca 0.44 -0.48 0.10 0.00 -1.03 0.00 0.00 54.13 53.15 1aco s LEU 680 Cb -0.14 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 1aco s LEU 680 CO 0.09 0.05 -0.15 0.42 0.23 0.00 0.00 176.35 176.99 1aco s THR 681 N -0.87 2.87 0.24 5.49 -4.23 -0.17 -1.52 115.64 117.44 1aco s THR 681 Ca 0.03 -1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 58.46 1aco s THR 681 Cb -0.08 -2.40 -0.10 0.00 1.34 0.00 0.00 72.50 71.26 1aco s THR 681 CO 0.01 -0.10 1.43 -0.36 -0.54 0.00 0.00 174.62 175.07 1aco s PHE 682 N -1.65 3.03 0.28 3.99 0.08 -0.65 -0.62 117.98 122.45 1aco s PHE 682 Ca 0.23 1.03 0.08 0.00 0.12 0.00 0.00 56.93 58.39 1aco s PHE 682 Cb -0.09 -3.81 0.39 0.00 -0.57 0.00 0.00 43.02 38.94 1aco s PHE 682 CO 0.13 -2.63 1.64 0.00 -0.10 0.00 0.00 175.22 174.26 1aco h ALA 683 N 5.08 1.02 -3.71 5.36 0.00 -1.68 -3.37 119.26 121.97 1aco h ALA 683 Ca -0.46 -0.50 -0.64 0.00 0.00 0.00 0.00 54.91 53.32 1aco h ALA 683 Cb 1.22 -0.09 -0.38 0.00 0.00 0.00 0.00 17.79 18.54 1aco h ALA 683 CO 0.78 0.68 -0.78 0.34 0.00 0.00 0.00 179.25 180.27 1aco s ASP 684 N -6.88 4.17 0.39 0.00 -1.08 -1.26 -5.00 116.67 107.00 1aco s ASP 684 Ca -0.03 -1.38 0.20 0.00 -0.52 0.00 0.00 52.55 50.82 1aco s ASP 684 Cb 0.13 -1.35 1.10 0.00 -1.46 0.00 0.00 42.92 41.35 1aco s ASP 684 CO 0.77 -0.24 1.57 1.55 0.52 0.00 0.00 175.17 179.34 1aco h PRO 685 N 7.86 0.00 0.00 4.34 0.13 -1.95 -0.71 132.00 141.67 1aco h PRO 685 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1aco h PRO 685 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1aco h PRO 685 CO 0.44 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.21 1aco h ALA 686 N 1.54 1.00 0.00 -0.56 0.00 -1.95 -2.79 119.26 116.51 1aco h ALA 686 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aco h ALA 686 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1aco h ALA 686 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 1aco n ASP 687 N -2.69 0.41 0.08 0.00 8.00 -0.27 -1.30 116.55 120.78 1aco n ASP 687 Ca 0.02 0.66 0.07 0.00 0.71 0.00 0.00 54.79 56.25 1aco n ASP 687 Cb 0.34 -0.72 0.53 0.00 -0.02 0.00 0.00 41.12 41.25 1aco n ASP 687 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1aco h TYR 688 N 0.00 0.29 -0.00 1.24 3.20 -1.71 -1.38 116.97 118.61 1aco h TYR 688 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1aco h TYR 688 Cb 0.12 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1aco h TYR 688 CO 0.00 0.17 -0.07 0.09 -1.64 0.00 0.00 178.16 176.72 1aco n ASN 689 N -4.49 0.08 0.14 -2.11 3.02 -0.42 -3.24 115.26 108.24 1aco n ASN 689 Ca 0.02 0.28 0.12 0.00 -0.03 0.00 0.00 54.58 54.98 1aco n ASN 689 Cb 0.14 -0.36 0.20 0.00 -0.61 0.00 0.00 39.78 39.15 1aco n ASN 689 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1aco h LYS 690 N 0.03 0.00 -5.24 3.52 1.57 -1.38 -3.45 116.57 111.62 1aco h LYS 690 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1aco h LYS 690 Cb 0.47 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.64 1aco h LYS 690 CO 0.00 0.00 -0.51 0.42 -0.57 0.00 0.00 179.45 178.79 1aco s ILE 691 N -3.20 5.23 0.14 1.86 1.01 -1.20 -5.08 121.20 119.95 1aco s ILE 691 Ca 0.06 0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.92 1aco s ILE 691 Cb 0.09 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1aco s ILE 691 CO 0.69 0.43 -0.12 -1.00 0.00 0.00 0.00 174.94 174.94 1aco s HIS 692 N 0.49 2.65 0.57 3.97 3.76 -1.26 -5.01 115.29 120.47 1aco s HIS 692 Ca 0.07 -0.21 0.31 0.00 -0.15 0.00 0.00 55.06 55.08 1aco s HIS 692 Cb -0.12 -1.35 1.45 0.00 1.11 0.00 0.00 32.58 33.67 1aco s HIS 692 CO -0.00 0.45 1.83 -1.35 -0.85 0.00 0.00 174.74 174.82 1aco h PRO 693 N 3.34 0.00 0.00 8.40 0.11 -1.97 -1.31 132.00 140.57 1aco h PRO 693 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1aco h PRO 693 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1aco h PRO 693 CO 0.52 0.00 -0.04 1.55 -0.21 0.00 0.00 178.00 179.81 1aco n VAL 694 N -3.90 0.35 -1.64 3.15 3.14 -1.26 -4.53 118.33 113.64 1aco n VAL 694 Ca 0.15 -0.17 -0.33 0.00 -2.96 0.00 0.00 64.34 61.03 1aco n VAL 694 Cb 0.92 -0.51 0.06 0.00 -1.06 0.00 0.00 33.84 33.24 1aco n VAL 694 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1aco s ASP 695 N -3.91 4.96 0.07 6.55 1.01 -0.50 -4.80 116.67 120.05 1aco s ASP 695 Ca 0.12 1.96 0.07 0.00 0.71 0.00 0.00 52.55 55.40 1aco s ASP 695 Cb 0.15 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.50 1aco s ASP 695 CO 0.58 -1.73 -0.13 -0.54 0.21 0.00 0.00 175.17 173.57 1aco s LYS 696 N -4.28 2.14 -0.01 8.23 -0.14 -0.92 -4.16 119.74 120.60 1aco s LYS 696 Ca 0.66 -0.98 0.07 0.00 -1.36 0.00 0.00 55.97 54.35 1aco s LYS 696 Cb -0.20 -2.28 -0.02 0.00 -1.68 0.00 0.00 37.83 33.65 1aco s LYS 696 CO 0.45 0.53 -0.21 -0.51 -0.76 0.00 0.00 175.35 174.85 1aco s LEU 697 N -1.86 2.05 -0.14 3.17 1.43 -0.78 -0.39 118.68 122.15 1aco s LEU 697 Ca 0.18 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1aco s LEU 697 Cb -0.11 -1.08 -0.00 0.00 0.03 0.00 0.00 46.19 45.03 1aco s LEU 697 CO 0.10 0.25 -0.15 -0.89 0.23 0.00 0.00 176.35 175.89 1aco s THR 698 N -0.51 2.70 -0.27 5.49 2.01 -0.73 -0.66 115.64 123.67 1aco s THR 698 Ca 0.08 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.21 1aco s THR 698 Cb -0.08 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 1aco s THR 698 CO -0.01 0.52 0.15 -0.63 -0.69 0.00 0.00 174.62 173.97 1aco s ILE 699 N 0.66 5.01 0.23 1.82 -1.09 0.10 -0.77 121.20 127.16 1aco s ILE 699 Ca -0.08 0.07 0.10 0.00 -2.23 0.00 0.00 60.65 58.51 1aco s ILE 699 Cb -0.16 -3.38 -0.04 0.00 -1.58 0.00 0.00 42.46 37.30 1aco s ILE 699 CO 0.02 0.28 -0.09 -1.10 -1.23 0.00 0.00 174.94 172.82 1aco s GLN 700 N 1.68 2.03 0.00 2.79 -0.21 0.05 -2.23 119.66 123.77 1aco s GLN 700 Ca 0.07 -1.43 0.00 0.00 0.02 0.00 0.00 55.36 54.02 1aco s GLN 700 Cb -0.16 -2.07 0.00 0.00 1.00 0.00 0.00 33.01 31.79 1aco s GLN 700 CO 0.09 0.39 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 1aco n GLY 701 N -0.37 0.87 0.27 3.09 0.00 -1.26 -2.85 105.19 104.93 1aco n GLY 701 Ca -0.08 -0.13 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1aco n GLY 701 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1aco h LEU 702 N 0.00 0.00 -0.81 0.99 -0.00 -1.92 -2.71 115.31 110.86 1aco h LEU 702 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.76 1aco h LEU 702 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.65 1aco h LEU 702 CO 0.00 0.07 -0.37 0.11 -0.00 0.00 0.00 178.44 178.25 1aco h LYS 703 N 0.00 0.45 -0.99 1.13 1.57 -1.93 -2.93 116.57 113.87 1aco h LYS 703 Ca -0.00 -0.21 -0.60 0.00 -1.87 0.00 0.00 60.65 57.97 1aco h LYS 703 Cb 0.48 -0.01 -0.39 0.00 0.08 0.00 0.00 32.23 32.40 1aco h LYS 703 CO 0.01 0.76 -0.33 -0.40 -0.57 0.00 0.00 179.45 178.92 1aco n ASP 704 N -4.05 5.65 -4.68 0.86 5.68 -1.04 -5.02 116.55 113.95 1aco n ASP 704 Ca -0.01 -3.76 -0.45 0.00 -0.50 0.00 0.00 54.79 50.07 1aco n ASP 704 Cb 0.48 -0.54 -0.04 0.00 -1.14 0.00 0.00 41.12 39.88 1aco n ASP 704 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1aco n PHE 705 N -0.71 2.45 -3.79 2.11 7.35 -1.10 -4.98 117.46 118.79 1aco n PHE 705 Ca 0.48 -0.02 -0.13 0.00 -0.76 0.00 0.00 57.45 57.03 1aco n PHE 705 Cb 0.81 -2.67 -0.09 0.00 0.35 0.00 0.00 39.48 37.88 1aco n PHE 705 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1aco s ALA 706 N 2.71 -0.67 0.04 3.13 0.00 -1.26 -5.08 121.76 120.63 1aco s ALA 706 Ca 0.84 0.30 -0.36 0.00 0.00 0.00 0.00 51.96 52.75 1aco s ALA 706 Cb -0.59 -0.01 -0.15 0.00 0.00 0.00 0.00 23.12 22.38 1aco s ALA 706 CO 0.42 -0.23 1.57 -2.30 0.00 0.00 0.00 175.76 175.21 1aco n PRO 707 N 1.58 1.69 0.00 0.00 -0.02 -1.26 -1.83 135.00 135.16 1aco n PRO 707 Ca -0.20 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1aco n PRO 707 Cb 0.56 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1aco n PRO 707 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aco n GLY 708 N 3.36 2.47 3.63 -1.23 0.00 -1.26 -4.99 105.19 107.17 1aco n GLY 708 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1aco n GLY 708 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1aco s LYS 709 N -0.19 4.04 0.76 1.61 2.20 -0.76 -5.06 119.74 122.34 1aco s LYS 709 Ca 0.00 -0.12 -0.13 0.00 -0.36 0.00 0.00 55.97 55.36 1aco s LYS 709 Cb 0.00 -3.60 0.06 0.00 -1.51 0.00 0.00 37.83 32.78 1aco s LYS 709 CO 0.00 -0.10 1.15 -1.25 -0.36 0.00 0.00 175.35 174.79 1aco s PRO 710 N 1.54 2.07 0.11 4.03 0.04 -1.26 -4.60 135.00 136.93 1aco s PRO 710 Ca 0.11 1.54 0.02 0.00 0.04 0.00 0.00 61.00 62.72 1aco s PRO 710 Cb -0.15 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 1aco s PRO 710 CO 0.08 -1.84 0.19 -0.51 0.04 0.00 0.00 177.00 174.96 1aco s LEU 711 N -5.51 4.14 -0.12 -3.56 1.43 0.29 -4.89 118.68 110.45 1aco s LEU 711 Ca 0.69 0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 53.83 1aco s LEU 711 Cb -0.24 -2.74 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 1aco s LEU 711 CO 0.49 0.11 0.13 0.42 0.23 0.00 0.00 176.35 177.73 1aco s THR 712 N -1.61 5.42 -0.13 5.49 -4.23 -1.13 -0.44 115.64 119.00 1aco s THR 712 Ca 0.33 0.18 0.02 0.00 -1.18 0.00 0.00 61.69 61.04 1aco s THR 712 Cb -0.12 -3.36 0.01 0.00 1.34 0.00 0.00 72.50 70.37 1aco s THR 712 CO 0.26 0.61 -0.20 0.00 -0.54 0.00 0.00 174.62 174.74 1aco s ILE 714 N 0.87 5.17 -0.27 0.00 1.09 0.05 -0.45 121.20 127.66 1aco s ILE 714 Ca -0.06 0.13 -0.22 0.00 -1.10 0.00 0.00 60.65 59.40 1aco s ILE 714 Cb -0.15 -3.80 -0.01 0.00 -1.06 0.00 0.00 42.46 37.44 1aco s ILE 714 CO -0.02 -0.05 0.71 -0.63 -0.10 0.00 0.00 174.94 174.84 1aco s ILE 715 N 2.03 4.90 -0.46 2.92 1.01 0.11 -1.77 121.20 129.94 1aco s ILE 715 Ca 0.12 1.21 -0.14 0.00 0.00 0.00 0.00 60.65 61.85 1aco s ILE 715 Cb -0.16 -4.03 0.08 0.00 0.01 0.00 0.00 42.46 38.36 1aco s ILE 715 CO 0.11 -0.08 0.37 -0.54 0.00 0.00 0.00 174.94 174.80 1aco s LYS 716 N 2.69 2.87 0.39 2.79 1.02 0.48 -1.35 119.74 128.64 1aco s LYS 716 Ca 0.29 -1.41 -0.21 0.00 0.02 0.00 0.00 55.97 54.66 1aco s LYS 716 Cb -0.15 -4.05 -0.10 0.00 -0.52 0.00 0.00 37.83 33.01 1aco s LYS 716 CO 0.09 -1.03 0.91 -1.01 -0.92 0.00 0.00 175.35 173.39 1aco s HIS 717 N 1.58 3.38 0.18 3.18 3.76 0.70 -2.16 115.29 125.91 1aco s HIS 717 Ca 0.04 1.57 -0.10 0.00 -0.15 0.00 0.00 55.06 56.42 1aco s HIS 717 Cb -0.24 -2.81 0.09 0.00 1.11 0.00 0.00 32.58 30.73 1aco s HIS 717 CO 0.05 -0.03 1.70 -1.35 -0.85 0.00 0.00 174.74 174.26 1aco h PRO 718 N 2.17 1.03 0.00 8.40 0.11 -1.87 -0.72 132.00 141.12 1aco h PRO 718 Ca -0.49 -0.24 0.00 0.00 0.11 0.00 0.00 66.00 65.38 1aco h PRO 718 Cb 1.18 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1aco h PRO 718 CO 0.62 0.92 0.00 0.27 -0.21 0.00 0.00 178.00 179.61 1aco n ASN 719 N -4.31 0.00 0.00 -2.05 0.23 -1.26 -4.78 115.26 103.09 1aco n ASN 719 Ca 0.04 -0.03 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 1aco n ASN 719 Cb 0.24 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 1aco n ASN 719 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1aco n GLY 720 N -0.89 2.12 3.77 4.83 0.00 -0.28 -5.07 105.19 109.67 1aco n GLY 720 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1aco n GLY 720 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aco s THR 721 N -2.51 3.17 0.10 2.61 2.01 -1.23 -4.82 115.64 114.95 1aco s THR 721 Ca 0.00 0.75 0.06 0.00 0.31 0.00 0.00 61.69 62.81 1aco s THR 721 Cb 0.00 -3.32 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 1aco s THR 721 CO 0.00 -0.13 -0.14 -1.10 -0.69 0.00 0.00 174.62 172.56 1aco s GLN 722 N -3.18 0.92 -0.00 4.92 -0.21 -1.26 -0.22 119.66 120.64 1aco s GLN 722 Ca 0.71 -1.10 0.00 0.00 0.02 0.00 0.00 55.36 55.00 1aco s GLN 722 Cb -0.25 -0.87 0.00 0.00 1.00 0.00 0.00 33.01 32.89 1aco s GLN 722 CO 0.28 0.18 -0.01 -1.21 -2.12 0.00 0.00 175.29 172.42 1aco s GLU 723 N -2.20 0.06 -0.11 2.91 2.02 -0.45 -4.96 118.70 115.97 1aco s GLU 723 Ca 0.03 -0.02 -0.04 0.00 0.02 0.00 0.00 54.97 54.97 1aco s GLU 723 Cb -0.07 -0.07 -0.04 0.00 0.10 0.00 0.00 34.13 34.05 1aco s GLU 723 CO 0.03 0.01 0.03 0.99 0.02 0.00 0.00 175.26 176.34 1aco s THR 724 N 0.03 4.58 0.14 3.63 2.01 -1.26 0.06 115.64 124.83 1aco s THR 724 Ca -0.00 -0.14 0.01 0.00 0.31 0.00 0.00 61.69 61.88 1aco s THR 724 Cb -0.01 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.49 1aco s THR 724 CO -0.00 0.58 -0.02 0.27 -0.69 0.00 0.00 174.62 174.76 1aco s ILE 725 N -0.68 0.62 -0.04 1.82 -4.36 0.40 -4.98 121.20 113.99 1aco s ILE 725 Ca 0.11 -1.95 0.01 0.00 -0.26 0.00 0.00 60.65 58.56 1aco s ILE 725 Cb -0.12 -1.94 -0.03 0.00 1.25 0.00 0.00 42.46 41.62 1aco s ILE 725 CO 0.02 -0.63 -0.04 -0.76 0.24 0.00 0.00 174.94 173.77 1aco s LEU 726 N -3.11 3.31 -0.08 0.37 1.43 -1.26 -0.41 118.68 118.93 1aco s LEU 726 Ca 0.19 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.31 1aco s LEU 726 Cb 0.06 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1aco s LEU 726 CO 0.00 0.33 -0.19 -0.76 0.23 0.00 0.00 176.35 175.97 1aco s LEU 727 N -1.12 1.89 0.41 1.79 1.43 0.41 -1.71 118.68 121.78 1aco s LEU 727 Ca 0.15 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1aco s LEU 727 Cb -0.11 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.97 1aco s LEU 727 CO 0.05 0.12 0.63 0.20 0.23 0.00 0.00 176.35 177.57 1aco s ASN 728 N 0.39 6.04 0.12 2.29 0.01 0.21 -0.54 114.94 123.45 1aco s ASN 728 Ca -0.14 0.39 -0.10 0.00 -0.71 0.00 0.00 52.86 52.30 1aco s ASN 728 Cb -0.16 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.73 1aco s ASN 728 CO 0.06 -0.54 0.25 -1.38 -1.51 0.00 0.00 177.10 173.98 1aco s HIS 729 N -2.47 0.19 -0.23 2.20 -3.43 -1.26 -1.00 115.29 109.28 1aco s HIS 729 Ca 0.45 -0.59 0.12 0.00 -0.80 0.00 0.00 55.06 54.24 1aco s HIS 729 Cb -0.10 -0.02 0.47 0.00 -1.43 0.00 0.00 32.58 31.50 1aco s HIS 729 CO 0.38 -0.62 1.37 0.25 -2.00 0.00 0.00 174.74 174.11 1aco n THR 730 N -0.13 2.35 -2.17 -5.38 -2.24 -1.26 -4.68 114.28 100.76 1aco n THR 730 Ca -0.13 -2.58 -0.41 0.00 -2.27 0.00 0.00 64.05 58.66 1aco n THR 730 Cb 0.63 -0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 1aco n THR 730 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1aco s PHE 731 N -3.11 3.19 0.56 4.78 0.40 -1.26 -5.04 117.98 117.50 1aco s PHE 731 Ca 0.41 1.27 0.07 0.00 -0.60 0.00 0.00 56.93 58.08 1aco s PHE 731 Cb 0.37 -3.64 0.06 0.00 0.51 0.00 0.00 43.02 40.32 1aco s PHE 731 CO 0.01 -1.92 0.53 0.54 0.70 0.00 0.00 175.22 175.09 1aco s ASN 732 N 0.05 4.76 0.54 1.36 4.22 -1.26 -4.05 114.94 120.56 1aco s ASN 732 Ca 0.54 -1.14 0.33 0.00 -2.14 0.00 0.00 52.86 50.45 1aco s ASN 732 Cb -0.38 0.43 1.31 0.00 1.28 0.00 0.00 41.25 43.89 1aco s ASN 732 CO 0.43 -1.21 1.96 -0.33 -2.04 0.00 0.00 177.10 175.91 1aco h GLU 733 N 0.55 0.00 -0.18 3.55 4.39 -1.99 -2.19 114.58 118.71 1aco h GLU 733 Ca -0.34 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.34 1aco h GLU 733 Cb 1.30 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.94 1aco h GLU 733 CO 0.52 0.00 0.05 1.15 -1.16 0.00 0.00 179.01 179.57 1aco h THR 734 N 0.00 1.19 -0.18 1.13 2.02 -2.00 -2.57 112.91 112.50 1aco h THR 734 Ca 0.00 -0.61 -0.12 0.00 0.77 0.00 0.00 66.41 66.46 1aco h THR 734 Cb 0.53 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1aco h THR 734 CO 0.00 0.19 -0.38 1.56 0.37 0.00 0.00 175.52 177.25 1aco h GLN 735 N 0.11 0.40 -0.52 6.66 4.20 -1.83 -2.75 115.11 121.38 1aco h GLN 735 Ca 0.06 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.54 1aco h GLN 735 Cb 0.24 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 1aco h GLN 735 CO -0.00 0.73 0.16 0.82 -0.67 0.00 0.00 178.83 179.86 1aco h ILE 736 N 0.34 1.21 -0.49 2.54 2.04 -1.28 -0.61 117.51 121.25 1aco h ILE 736 Ca 0.03 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.18 1aco h ILE 736 Cb 0.83 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1aco h ILE 736 CO 0.07 0.27 0.31 -0.33 0.00 0.00 0.00 178.15 178.47 1aco h GLU 737 N 0.75 0.65 -0.24 2.37 4.39 -1.17 -0.31 114.58 121.02 1aco h GLU 737 Ca 0.17 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 1aco h GLU 737 Cb 0.23 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1aco h GLU 737 CO -0.01 0.45 0.07 -1.49 -1.16 0.00 0.00 179.01 176.87 1aco h TRP 738 N 0.67 0.40 0.16 4.33 6.55 -0.99 -1.60 115.95 125.47 1aco h TRP 738 Ca 0.18 -0.04 0.01 0.00 0.95 0.00 0.00 58.89 59.98 1aco h TRP 738 Cb -0.05 -0.11 -0.02 0.00 -0.86 0.00 0.00 29.16 28.12 1aco h TRP 738 CO 0.00 0.46 -0.19 0.35 -1.05 0.00 0.00 178.44 178.01 1aco h PHE 739 N 0.23 -0.49 -0.81 0.49 3.57 -1.08 -1.60 116.94 117.24 1aco h PHE 739 Ca 0.08 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1aco h PHE 739 Cb 0.25 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1aco h PHE 739 CO 0.01 -0.28 0.48 0.00 -2.23 0.00 0.00 178.31 176.29 1aco h ARG 740 N -0.39 1.11 0.00 1.11 3.08 -0.93 -2.13 114.38 116.23 1aco h ARG 740 Ca 0.01 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1aco h ARG 740 Cb 0.38 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1aco h ARG 740 CO -0.07 0.78 0.00 0.00 -1.07 0.00 0.00 179.97 179.62 1aco n ALA 741 N -2.42 1.95 0.00 0.04 0.00 -0.61 -1.63 120.51 117.84 1aco n ALA 741 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1aco n ALA 741 Cb 0.07 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1aco n ALA 741 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aco n GLY 742 N 0.63 2.98 3.60 0.00 0.00 -0.69 -4.17 105.19 107.54 1aco n GLY 742 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.06 1aco n GLY 742 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aco s SER 743 N 0.00 -0.05 0.29 1.61 1.04 -0.69 -3.83 113.70 112.07 1aco s SER 743 Ca 0.00 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1aco s SER 743 Cb 0.00 0.09 0.45 0.00 0.10 0.00 0.00 66.02 66.65 1aco s SER 743 CO 0.00 -0.15 1.80 0.00 0.98 0.00 0.00 173.24 175.86 1aco h ALA 744 N 2.00 1.20 -0.45 5.32 0.00 -0.97 -2.44 119.26 123.92 1aco h ALA 744 Ca -0.19 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1aco h ALA 744 Cb 1.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1aco h ALA 744 CO 0.25 0.52 -0.06 1.25 0.00 0.00 0.00 179.25 181.21 1aco h LEU 745 N 0.60 0.75 -0.80 0.00 5.85 -1.95 -1.13 115.31 118.64 1aco h LEU 745 Ca 0.12 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 1aco h LEU 745 Cb 0.44 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1aco h LEU 745 CO 0.02 0.86 0.03 0.78 -0.34 0.00 0.00 178.44 179.79 1aco h ASN 746 N 0.71 0.90 -0.24 1.25 2.35 -1.78 -0.87 115.58 117.90 1aco h ASN 746 Ca 0.13 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1aco h ASN 746 Cb 0.52 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1aco h ASN 746 CO 0.03 0.95 0.07 -0.09 -1.65 0.00 0.00 177.43 176.73 1aco h ARG 747 N 0.87 0.39 -0.63 0.81 1.12 -1.10 -0.45 114.38 115.39 1aco h ARG 747 Ca 0.17 -0.09 0.01 0.00 -1.11 0.00 0.00 59.98 58.96 1aco h ARG 747 Cb 0.47 -0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 30.35 1aco h ARG 747 CO 0.02 0.48 0.41 1.98 -3.11 0.00 0.00 179.97 179.76 1aco h MET 748 N 0.22 0.82 -0.07 0.20 4.05 -1.00 -1.48 114.93 117.67 1aco h MET 748 Ca 0.08 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.35 1aco h MET 748 Cb 0.26 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1aco h MET 748 CO -0.00 0.54 -0.41 0.87 0.23 0.00 0.00 176.91 178.14 1aco h LYS 749 N 0.84 0.16 -0.72 0.39 1.57 -1.01 -2.50 116.57 115.30 1aco h LYS 749 Ca 0.23 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1aco h LYS 749 Cb -0.09 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1aco h LYS 749 CO -0.06 0.55 0.27 0.93 -0.57 0.00 0.00 179.45 180.58 1aco h GLU 750 N 0.14 1.09 0.00 3.15 5.08 -0.08 -2.79 114.58 121.17 1aco h GLU 750 Ca 0.01 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1aco h GLU 750 Cb 0.79 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1aco h GLU 750 CO 0.06 0.91 0.00 1.28 -1.00 0.00 0.00 179.01 180.26 1aco n LEU 751 N -4.33 0.48 -1.25 1.33 4.77 -0.77 -2.64 117.00 114.58 1aco n LEU 751 Ca 0.06 0.68 -0.01 0.00 -0.03 0.00 0.00 56.01 56.70 1aco n LEU 751 Cb 0.19 -0.69 0.01 0.00 -2.33 0.00 0.00 43.42 40.60 1aco n LEU 751 CO 0.40 -0.73 0.73 0.00 -1.33 0.00 0.00 177.39 176.47 1aco n GLN 752 N -2.10 1.07 -1.69 3.23 6.02 -1.05 -4.82 117.38 118.03 1aco n GLN 752 Ca 0.00 -0.15 -0.15 0.00 -0.01 0.00 0.00 57.00 56.69 1aco n GLN 752 Cb 0.10 -1.06 -0.05 0.00 1.02 0.00 0.00 30.24 30.25 1aco n GLN 752 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1aco n GLN 753 N 0.80 -1.52 0.00 -1.09 10.64 -1.08 -5.10 117.38 120.03 1aco n GLN 753 Ca 0.03 0.83 0.00 0.00 -1.83 0.00 0.00 57.00 56.03 1aco n GLN 753 Cb 0.54 -5.20 0.00 0.00 -0.86 0.00 0.00 30.24 24.72 1aco n GLN 753 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59