#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n62 s ILE 2 N 0.00 5.28 0.75 1.12 -1.09 -1.20 -4.66 121.20 121.41 1n62 s ILE 2 Ca 0.00 -0.11 -0.12 0.00 -2.23 0.00 0.00 60.65 58.19 1n62 s ILE 2 Cb 0.00 -3.69 0.05 0.00 -1.58 0.00 0.00 42.46 37.24 1n62 s ILE 2 CO 0.00 0.04 1.11 -2.84 -1.23 0.00 0.00 174.94 172.01 1n62 s PRO 3 N 1.75 2.31 0.75 2.79 0.02 -1.26 -4.76 135.00 136.60 1n62 s PRO 3 Ca 0.07 1.29 -0.13 0.00 0.02 0.00 0.00 61.00 62.25 1n62 s PRO 3 Cb -0.17 -1.90 0.05 0.00 0.02 0.00 0.00 34.50 32.51 1n62 s PRO 3 CO 0.11 -1.62 1.15 0.20 -0.33 0.00 0.00 177.00 176.50 1n62 s GLY 4 N -3.03 2.04 0.63 0.52 0.00 -1.26 -4.99 107.32 101.23 1n62 s GLY 4 Ca 0.64 0.62 -0.17 0.00 0.00 0.00 0.00 44.72 45.81 1n62 s GLY 4 CO 0.51 1.00 1.16 -1.35 0.00 0.00 0.00 173.10 174.42 1n62 s SER 5 N -2.56 5.08 0.19 1.64 1.04 -1.26 -4.98 113.70 112.84 1n62 s SER 5 Ca 0.68 2.21 -0.18 0.00 0.48 0.00 0.00 55.95 59.14 1n62 s SER 5 Cb -0.23 -2.58 0.03 0.00 0.10 0.00 0.00 66.02 63.34 1n62 s SER 5 CO 0.49 -1.66 0.52 0.72 0.98 0.00 0.00 173.24 174.29 1n62 s PHE 6 N -1.95 -0.14 0.10 5.02 -0.12 -1.26 -4.73 117.98 114.89 1n62 s PHE 6 Ca 0.72 -0.19 -0.07 0.00 -0.05 0.00 0.00 56.93 57.34 1n62 s PHE 6 Cb -0.25 0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 42.48 1n62 s PHE 6 CO 0.37 -0.91 0.37 -0.51 -0.05 0.00 0.00 175.22 174.49 1n62 s ASP 7 N -2.86 6.54 -0.07 1.98 1.01 0.12 -4.95 116.67 118.43 1n62 s ASP 7 Ca 0.09 0.65 0.05 0.00 0.71 0.00 0.00 52.55 54.04 1n62 s ASP 7 Cb -0.01 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.80 1n62 s ASP 7 CO -0.04 0.12 -0.24 -0.47 0.21 0.00 0.00 175.17 174.76 1n62 s TYR 8 N -1.51 2.44 0.06 4.23 5.04 -1.26 -0.51 117.35 125.84 1n62 s TYR 8 Ca 0.36 -0.85 0.07 0.00 -2.44 0.00 0.00 57.07 54.21 1n62 s TYR 8 Cb -0.13 -1.62 -0.03 0.00 0.35 0.00 0.00 41.96 40.54 1n62 s TYR 8 CO 0.21 -0.30 -0.18 -1.01 -1.34 0.00 0.00 175.55 172.93 1n62 s HIS 9 N 0.06 1.55 -0.58 4.97 3.76 -0.17 -4.96 115.29 119.92 1n62 s HIS 9 Ca -0.10 -0.39 0.05 0.00 -0.15 0.00 0.00 55.06 54.47 1n62 s HIS 9 Cb -0.15 -0.90 0.18 0.00 1.11 0.00 0.00 32.58 32.82 1n62 s HIS 9 CO 0.06 0.10 0.47 0.54 -0.85 0.00 0.00 174.74 175.06 1n62 n ARG 10 N 1.58 1.25 -1.72 1.40 5.12 -1.26 -0.51 116.66 122.51 1n62 n ARG 10 Ca -0.19 -3.97 -0.35 0.00 -1.93 0.00 0.00 57.85 51.41 1n62 n ARG 10 Cb 0.54 -2.01 0.06 0.00 -1.16 0.00 0.00 32.46 29.90 1n62 n ARG 10 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1n62 s PRO 11 N -1.01 2.56 -0.01 5.56 0.04 -1.25 -4.93 135.00 135.97 1n62 s PRO 11 Ca 0.30 1.81 0.21 0.00 0.04 0.00 0.00 61.00 63.36 1n62 s PRO 11 Cb 0.02 -1.88 -0.23 0.00 0.04 0.00 0.00 34.50 32.45 1n62 s PRO 11 CO -0.16 -1.52 0.81 1.63 0.04 0.00 0.00 177.00 177.80 1n62 n LYS 12 N -2.15 0.17 -4.15 4.56 4.76 -1.26 -4.35 118.16 115.75 1n62 n LYS 12 Ca 0.14 -0.05 -0.11 0.00 -2.87 0.00 0.00 58.31 55.42 1n62 n LYS 12 Cb 0.50 -1.51 -0.09 0.00 -1.84 0.00 0.00 35.03 32.09 1n62 n LYS 12 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1n62 s SER 13 N -3.41 0.15 0.15 4.39 1.04 -1.26 -4.50 113.70 110.27 1n62 s SER 13 Ca 0.04 -1.25 -0.14 0.00 0.48 0.00 0.00 55.95 55.07 1n62 s SER 13 Cb 0.15 0.39 0.04 0.00 0.10 0.00 0.00 66.02 66.70 1n62 s SER 13 CO 0.87 -0.85 1.73 0.40 0.98 0.00 0.00 173.24 176.37 1n62 h ILE 14 N 2.63 1.19 -0.90 -1.02 2.04 -1.96 -0.79 117.51 118.70 1n62 h ILE 14 Ca -0.34 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 1n62 h ILE 14 Cb 1.24 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 1n62 h ILE 14 CO 0.52 0.22 0.51 0.00 0.00 0.00 0.00 178.15 179.40 1n62 h ALA 15 N 1.07 1.20 -0.47 1.87 0.00 -1.99 0.39 119.26 121.33 1n62 h ALA 15 Ca 0.17 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1n62 h ALA 15 Cb 0.13 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1n62 h ALA 15 CO -0.02 0.66 -0.24 -0.44 0.00 0.00 0.00 179.25 179.20 1n62 h ASP 16 N 1.25 1.03 -0.74 0.00 3.32 -1.85 -0.00 116.42 119.43 1n62 h ASP 16 Ca 0.32 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1n62 h ASP 16 Cb 0.00 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 1n62 h ASP 16 CO -0.05 1.21 0.22 0.00 -1.72 0.00 0.00 179.24 178.89 1n62 h ALA 17 N 0.85 0.98 -0.39 3.45 0.00 -0.17 -0.51 119.26 123.48 1n62 h ALA 17 Ca 0.10 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1n62 h ALA 17 Cb 0.83 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1n62 h ALA 17 CO 0.07 0.67 -0.17 0.28 0.00 0.00 0.00 179.25 180.11 1n62 h VAL 18 N 1.11 1.28 -0.46 0.00 2.07 -0.76 1.00 116.25 120.48 1n62 h VAL 18 Ca 0.24 -1.29 0.02 0.00 0.82 0.00 0.00 66.70 66.49 1n62 h VAL 18 Cb 0.33 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1n62 h VAL 18 CO -0.00 0.43 0.27 0.00 0.02 0.00 0.00 177.57 178.29 1n62 h ALA 19 N 0.81 0.58 0.63 1.67 0.00 -0.87 0.87 119.26 122.95 1n62 h ALA 19 Ca 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1n62 h ALA 19 Cb 0.71 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1n62 h ALA 19 CO 0.05 -0.04 -0.40 -0.07 0.00 0.00 0.00 179.25 178.79 1n62 h LEU 20 N 0.55 -1.03 -0.92 0.00 3.38 -0.59 0.66 115.31 117.36 1n62 h LEU 20 Ca 0.18 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.35 1n62 h LEU 20 Cb 0.01 0.31 -0.09 0.00 0.09 0.00 0.00 40.66 40.98 1n62 h LEU 20 CO -0.08 -0.62 0.53 -0.07 0.09 0.00 0.00 178.44 178.29 1n62 h LEU 21 N -0.98 0.72 -0.63 1.67 3.38 -0.61 0.10 115.31 118.96 1n62 h LEU 21 Ca -0.08 0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1n62 h LEU 21 Cb 0.80 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1n62 h LEU 21 CO 0.07 0.34 -0.20 0.74 0.09 0.00 0.00 178.44 179.48 1n62 h THR 22 N 0.79 1.27 0.01 0.22 2.02 -0.41 -2.13 112.91 114.68 1n62 h THR 22 Ca 0.48 -1.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.33 1n62 h THR 22 Cb 0.59 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1n62 h THR 22 CO -0.31 0.45 -0.00 0.50 0.37 0.00 0.00 175.52 176.52 1n62 h LYS 23 N 0.75 -0.01 0.00 6.66 3.64 -0.51 -3.07 116.57 124.03 1n62 h LYS 23 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1n62 h LYS 23 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1n62 h LYS 23 CO 0.06 0.55 0.00 1.28 -2.27 0.00 0.00 179.45 179.07 1n62 n LEU 24 N -4.82 0.17 0.00 5.20 4.77 0.31 -4.98 117.00 117.65 1n62 n LEU 24 Ca -0.09 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1n62 n LEU 24 Cb 0.28 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1n62 n LEU 24 CO 0.33 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1n62 n GLY 25 N 0.68 1.15 0.27 -0.72 0.00 -0.81 -4.09 105.19 101.67 1n62 n GLY 25 Ca 0.05 -0.52 0.13 0.00 0.00 0.00 0.00 46.02 45.67 1n62 n GLY 25 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1n62 h GLU 26 N 0.00 0.00 0.00 1.61 4.11 -1.92 -0.76 114.58 117.61 1n62 h GLU 26 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1n62 h GLU 26 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1n62 h GLU 26 CO 0.00 0.11 0.00 -0.25 0.07 0.00 0.00 179.01 178.94 1n62 n ASP 27 N -3.68 0.00 -4.81 3.06 8.00 -1.26 -4.71 116.55 113.15 1n62 n ASP 27 Ca -0.02 -0.25 -0.36 0.00 0.71 0.00 0.00 54.79 54.87 1n62 n ASP 27 Cb 0.22 -0.22 -0.07 0.00 -0.02 0.00 0.00 41.12 41.03 1n62 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n62 s ALA 28 N -2.45 3.69 -0.01 2.24 0.00 -0.29 0.11 121.76 125.05 1n62 s ALA 28 Ca 0.28 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.60 1n62 s ALA 28 Cb 0.18 -1.83 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 1n62 s ALA 28 CO 0.38 0.59 -0.17 1.03 0.00 0.00 0.00 175.76 177.59 1n62 s ARG 29 N -0.93 1.39 0.52 0.00 1.81 -0.22 -4.95 118.95 116.58 1n62 s ARG 29 Ca 0.14 -0.63 -0.22 0.00 -1.72 0.00 0.00 55.73 53.30 1n62 s ARG 29 Cb -0.12 -1.35 -0.06 0.00 -0.45 0.00 0.00 34.95 32.97 1n62 s ARG 29 CO 0.03 0.37 1.35 -2.14 -0.68 0.00 0.00 175.30 174.23 1n62 s PRO 30 N -0.44 3.29 -0.21 3.54 0.02 -1.26 -0.58 135.00 139.35 1n62 s PRO 30 Ca 0.07 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.32 1n62 s PRO 30 Cb -0.07 -2.34 0.03 0.00 0.02 0.00 0.00 34.50 32.15 1n62 s PRO 30 CO -0.01 -1.07 -0.16 -1.17 -0.33 0.00 0.00 177.00 174.27 1n62 s LEU 31 N -3.35 2.65 0.00 -5.54 2.96 0.11 -4.75 118.68 110.77 1n62 s LEU 31 Ca 0.69 -0.90 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 1n62 s LEU 31 Cb -0.40 -1.52 0.00 0.00 0.50 0.00 0.00 46.19 44.77 1n62 s LEU 31 CO 0.48 -0.07 0.00 0.00 -1.32 0.00 0.00 176.35 175.44 1n62 n ALA 32 N 4.57 0.00 0.49 5.97 0.00 -1.26 -1.13 120.51 129.14 1n62 n ALA 32 Ca -0.18 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.38 1n62 n ALA 32 Cb 0.47 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.38 1n62 n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n62 n GLY 33 N 5.00 -1.42 2.98 0.00 0.00 -1.25 -4.83 105.19 105.67 1n62 n GLY 33 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1n62 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n62 n GLY 34 N 0.46 0.83 0.62 -0.02 0.00 -1.26 -4.58 105.19 101.23 1n62 n GLY 34 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1n62 n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1n62 n HIS 35 N -2.12 0.29 -0.06 1.61 8.25 -1.26 -0.94 115.22 121.00 1n62 n HIS 35 Ca 0.00 -0.14 -0.08 0.00 -0.26 0.00 0.00 57.72 57.24 1n62 n HIS 35 Cb 0.01 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.07 1n62 n HIS 35 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1n62 n SER 36 N 0.45 3.03 -0.06 0.41 7.64 -1.26 -4.69 113.62 119.14 1n62 n SER 36 Ca 0.16 -0.05 -0.13 0.00 1.01 0.00 0.00 58.87 59.86 1n62 n SER 36 Cb 0.34 -0.18 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 1n62 n SER 36 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1n62 h LEU 37 N -0.02 0.40 -0.84 -3.43 5.85 -1.96 -2.77 115.31 112.53 1n62 h LEU 37 Ca -0.25 -0.47 -0.05 0.00 0.84 0.00 0.00 57.88 57.95 1n62 h LEU 37 Cb 1.38 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 1n62 h LEU 37 CO -0.05 0.78 0.23 0.40 -0.34 0.00 0.00 178.44 179.47 1n62 h ILE 38 N 0.02 1.25 -0.94 4.05 2.04 -1.36 0.38 117.51 122.96 1n62 h ILE 38 Ca 0.03 -0.86 0.02 0.00 1.00 0.00 0.00 64.86 65.04 1n62 h ILE 38 Cb 0.66 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1n62 h ILE 38 CO 0.04 0.34 0.62 -0.65 0.00 0.00 0.00 178.15 178.49 1n62 h PRO 39 N 1.05 1.20 0.00 2.37 0.11 -1.70 0.62 132.00 135.66 1n62 h PRO 39 Ca 0.23 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1n62 h PRO 39 Cb 0.28 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1n62 h PRO 39 CO -0.01 0.79 -0.08 -0.84 -0.21 0.00 0.00 178.00 177.65 1n62 h ILE 40 N 1.24 0.00 -0.20 4.15 3.07 -1.10 -2.72 117.51 121.94 1n62 h ILE 40 Ca 0.35 -0.72 -0.20 0.00 1.55 0.00 0.00 64.86 65.85 1n62 h ILE 40 Cb -0.09 1.67 0.00 0.00 -0.27 0.00 0.00 36.82 38.13 1n62 h ILE 40 CO -0.09 0.00 -0.66 0.24 -1.05 0.00 0.00 178.15 176.59 1n62 h MET 41 N 0.00 0.76 0.00 0.16 2.86 0.03 -0.85 114.93 117.89 1n62 h MET 41 Ca 0.00 -0.55 -0.04 0.00 -2.06 0.00 0.00 59.70 57.05 1n62 h MET 41 Cb 0.86 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 1n62 h MET 41 CO 0.00 1.17 -0.18 0.87 1.06 0.00 0.00 176.91 179.83 1n62 h LYS 42 N 0.56 0.00 0.00 1.72 1.57 -0.63 -0.08 116.57 119.70 1n62 h LYS 42 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1n62 h LYS 42 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1n62 h LYS 42 CO 0.14 0.18 -0.30 0.25 -0.57 0.00 0.00 179.45 179.15 1n62 n THR 43 N -4.05 0.22 -2.28 -0.16 -2.24 -1.05 -0.96 114.28 103.75 1n62 n THR 43 Ca -0.02 -0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.43 1n62 n THR 43 Cb 0.26 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1n62 n THR 43 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1n62 n ARG 44 N -1.82 -1.55 -0.12 -0.78 1.74 -0.04 -4.86 116.66 109.22 1n62 n ARG 44 Ca 0.05 0.98 -0.12 0.00 -0.77 0.00 0.00 57.85 58.00 1n62 n ARG 44 Cb 0.38 -5.55 0.00 0.00 -1.02 0.00 0.00 32.46 26.27 1n62 n ARG 44 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1n62 h LEU 45 N 0.00 0.96 -9.07 0.55 5.85 -1.49 -3.40 115.31 108.71 1n62 h LEU 45 Ca -0.46 -0.42 -0.63 0.00 0.84 0.00 0.00 57.88 57.21 1n62 h LEU 45 Cb 1.34 -0.27 -0.17 0.00 0.37 0.00 0.00 40.66 41.93 1n62 h LEU 45 CO 0.56 1.20 -0.60 0.00 -0.34 0.00 0.00 178.44 179.26 1n62 s ALA 46 N -4.45 3.28 -0.42 1.25 0.00 -0.44 -5.01 121.76 115.97 1n62 s ALA 46 Ca -0.11 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.19 1n62 s ALA 46 Cb 0.12 -1.75 0.35 0.00 0.00 0.00 0.00 23.12 21.84 1n62 s ALA 46 CO 0.87 0.27 0.78 0.25 0.00 0.00 0.00 175.76 177.93 1n62 n THR 47 N 3.27 0.58 -1.70 0.00 -2.24 -1.26 -4.15 114.28 108.79 1n62 n THR 47 Ca -0.17 -4.82 -0.37 0.00 -2.27 0.00 0.00 64.05 56.43 1n62 n THR 47 Cb 0.53 -0.52 0.07 0.00 -2.10 0.00 0.00 70.33 68.31 1n62 n THR 47 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1n62 s PRO 48 N -2.67 2.48 0.25 -0.78 0.04 -1.26 -4.92 135.00 128.14 1n62 s PRO 48 Ca 0.42 2.03 0.23 0.00 0.04 0.00 0.00 61.00 63.72 1n62 s PRO 48 Cb 0.33 -1.84 0.10 0.00 0.04 0.00 0.00 34.50 33.14 1n62 s PRO 48 CO -0.09 -1.64 1.19 0.93 0.04 0.00 0.00 177.00 177.43 1n62 h GLU 49 N 0.43 0.00 -3.47 4.56 4.39 -0.62 -3.42 114.58 116.45 1n62 h GLU 49 Ca -0.51 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 58.99 1n62 h GLU 49 Cb 1.33 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.71 1n62 h GLU 49 CO 0.53 0.00 -0.60 -1.01 -1.16 0.00 0.00 179.01 176.77 1n62 s HIS 50 N -3.32 -0.12 -0.08 4.33 3.76 -0.79 -0.70 115.29 118.37 1n62 s HIS 50 Ca 0.02 0.29 0.03 0.00 -0.15 0.00 0.00 55.06 55.24 1n62 s HIS 50 Cb 0.09 0.03 -0.02 0.00 1.11 0.00 0.00 32.58 33.79 1n62 s HIS 50 CO 0.76 -0.06 -0.16 -0.51 -0.85 0.00 0.00 174.74 173.92 1n62 s LEU 51 N 0.12 2.60 -0.49 0.89 1.43 0.33 -1.05 118.68 122.51 1n62 s LEU 51 Ca -0.01 -0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1n62 s LEU 51 Cb -0.01 -1.54 0.13 0.00 0.03 0.00 0.00 46.19 44.79 1n62 s LEU 51 CO -0.00 0.26 0.29 -0.69 0.23 0.00 0.00 176.35 176.44 1n62 s VAL 52 N -0.22 3.38 0.01 -1.59 1.01 0.25 -1.00 120.40 122.24 1n62 s VAL 52 Ca 0.00 -2.48 -0.30 0.00 0.00 0.00 0.00 61.98 59.20 1n62 s VAL 52 Cb -0.13 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1n62 s VAL 52 CO 0.03 -0.77 1.10 -0.62 0.00 0.00 0.00 175.10 174.85 1n62 s ASP 53 N 1.25 7.20 0.00 3.32 -1.08 0.33 0.09 116.67 127.78 1n62 s ASP 53 Ca 0.12 1.82 0.20 0.00 -0.52 0.00 0.00 52.55 54.17 1n62 s ASP 53 Cb -0.22 -2.57 0.70 0.00 -1.46 0.00 0.00 42.92 39.37 1n62 s ASP 53 CO -0.04 -0.40 1.52 0.18 0.52 0.00 0.00 175.17 176.95 1n62 n LEU 54 N 4.15 1.69 -0.27 -1.34 4.77 -0.28 -3.85 117.00 121.87 1n62 n LEU 54 Ca 0.08 -0.72 0.17 0.00 -0.03 0.00 0.00 56.01 55.51 1n62 n LEU 54 Cb 0.48 -0.12 0.45 0.00 -2.33 0.00 0.00 43.42 41.91 1n62 n LEU 54 CO 0.54 0.36 1.22 -0.09 -1.33 0.00 0.00 177.39 178.09 1n62 h ARG 55 N 2.20 0.50 -0.14 3.23 2.43 -1.88 -1.62 114.38 119.11 1n62 h ARG 55 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1n62 h ARG 55 Cb 0.48 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1n62 h ARG 55 CO 0.00 0.33 0.00 -0.25 -1.51 0.00 0.00 179.97 178.54 1n62 n ASP 56 N -4.56 1.65 -4.35 -3.80 8.00 -1.26 -4.71 116.55 107.52 1n62 n ASP 56 Ca 0.20 -1.67 -0.46 0.00 0.71 0.00 0.00 54.79 53.57 1n62 n ASP 56 Cb 0.64 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.62 1n62 n ASP 56 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1n62 s ILE 57 N -1.83 5.25 0.36 0.53 1.01 -0.61 -4.79 121.20 121.12 1n62 s ILE 57 Ca 0.33 -1.87 0.03 0.00 0.00 0.00 0.00 60.65 59.14 1n62 s ILE 57 Cb 0.18 -4.50 0.25 0.00 0.01 0.00 0.00 42.46 38.41 1n62 s ILE 57 CO 0.28 -1.09 2.01 1.23 0.00 0.00 0.00 174.94 177.36 1n62 h GLY 58 N 8.81 0.82 1.77 6.18 0.00 -1.85 -1.78 103.07 117.02 1n62 h GLY 58 Ca -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1n62 h GLY 58 CO 0.93 0.31 0.00 1.22 0.00 0.00 0.00 176.54 179.00 1n62 n ASP 59 N -4.43 0.00 -0.18 0.19 8.00 -1.26 -1.45 116.55 117.42 1n62 n ASP 59 Ca 0.05 0.30 0.14 0.00 0.71 0.00 0.00 54.79 55.99 1n62 n ASP 59 Cb 0.06 -0.39 0.57 0.00 -0.02 0.00 0.00 41.12 41.35 1n62 n ASP 59 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1n62 n LEU 60 N -1.39 0.68 -4.39 0.64 4.77 -0.67 -4.84 117.00 111.80 1n62 n LEU 60 Ca 0.04 -0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.59 1n62 n LEU 60 Cb 0.11 -0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 40.93 1n62 n LEU 60 CO 0.10 0.12 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.14 1n62 s VAL 61 N -2.39 3.05 0.00 4.08 1.01 -0.53 0.18 120.40 125.80 1n62 s VAL 61 Ca 0.30 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1n62 s VAL 61 Cb 0.20 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.32 1n62 s VAL 61 CO 0.46 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.71 1n62 n GLY 62 N 3.28 3.61 2.93 4.51 0.00 -1.26 -4.80 105.19 113.46 1n62 n GLY 62 Ca -0.18 -1.35 -0.25 0.00 0.00 0.00 0.00 46.02 44.24 1n62 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n62 s ILE 63 N -2.00 0.95 0.04 -0.61 1.01 -1.26 -0.24 121.20 119.09 1n62 s ILE 63 Ca 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.27 1n62 s ILE 63 Cb 0.00 -0.95 -0.00 0.00 0.01 0.00 0.00 42.46 41.52 1n62 s ILE 63 CO 0.00 0.34 0.14 0.00 0.00 0.00 0.00 174.94 175.42 1n62 s ARG 64 N 1.27 0.62 -0.21 2.79 1.70 -0.52 -4.99 118.95 119.61 1n62 s ARG 64 Ca -0.04 -0.68 -0.10 0.00 -0.47 0.00 0.00 55.73 54.44 1n62 s ARG 64 Cb -0.14 0.25 -0.05 0.00 -0.57 0.00 0.00 34.95 34.44 1n62 s ARG 64 CO -0.03 -0.17 0.15 -2.00 -1.08 0.00 0.00 175.30 172.18 1n62 s GLU 65 N -2.50 4.15 -0.09 3.89 2.12 -1.26 0.40 118.70 125.40 1n62 s GLU 65 Ca -0.06 -0.21 -0.00 0.00 0.36 0.00 0.00 54.97 55.06 1n62 s GLU 65 Cb -0.02 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.94 1n62 s GLU 65 CO -0.04 0.21 -0.05 -2.00 -0.54 0.00 0.00 175.26 172.84 1n62 s GLU 66 N 0.62 1.21 4.10 4.30 2.12 0.71 -4.94 118.70 126.84 1n62 s GLU 66 Ca 0.08 -0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1n62 s GLU 66 Cb -0.12 -1.34 0.00 0.00 0.26 0.00 0.00 34.13 32.93 1n62 s GLU 66 CO 0.01 -0.25 0.00 0.41 -0.54 0.00 0.00 175.26 174.89 1n62 n GLY 67 N 4.89 3.12 0.89 -1.50 0.00 -1.26 -1.16 105.19 110.17 1n62 n GLY 67 Ca -0.12 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 45.94 1n62 n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n62 n THR 68 N 0.00 0.76 -4.40 2.61 -2.24 -1.26 -4.92 114.28 104.84 1n62 n THR 68 Ca 0.00 -0.62 -0.26 0.00 -2.27 0.00 0.00 64.05 60.90 1n62 n THR 68 Cb 0.00 0.18 -0.11 0.00 -2.10 0.00 0.00 70.33 68.30 1n62 n THR 68 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1n62 s ASP 69 N -0.91 3.67 -0.16 3.42 1.01 -0.31 -0.94 116.67 122.46 1n62 s ASP 69 Ca 0.30 -0.83 -0.07 0.00 0.71 0.00 0.00 52.55 52.66 1n62 s ASP 69 Cb 0.17 -0.38 -0.04 0.00 1.01 0.00 0.00 42.92 43.67 1n62 s ASP 69 CO 0.18 0.10 0.08 -0.69 0.21 0.00 0.00 175.17 175.05 1n62 s VAL 70 N -1.85 4.98 -0.16 -1.27 1.01 0.67 -0.20 120.40 123.57 1n62 s VAL 70 Ca 0.24 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 1n62 s VAL 70 Cb -0.07 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1n62 s VAL 70 CO 0.12 0.50 -0.10 -0.69 0.00 0.00 0.00 175.10 174.93 1n62 s VAL 71 N -0.02 3.19 -0.13 2.92 1.01 0.16 0.28 120.40 127.82 1n62 s VAL 71 Ca 0.07 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1n62 s VAL 71 Cb -0.12 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.89 1n62 s VAL 71 CO 0.01 0.49 -0.20 -0.63 0.00 0.00 0.00 175.10 174.77 1n62 s ILE 72 N 0.70 1.86 0.49 2.22 1.01 0.31 -1.44 121.20 126.35 1n62 s ILE 72 Ca -0.05 -0.86 -0.23 0.00 0.00 0.00 0.00 60.65 59.51 1n62 s ILE 72 Cb -0.15 -1.66 -0.07 0.00 0.01 0.00 0.00 42.46 40.59 1n62 s ILE 72 CO 0.02 0.51 1.28 -0.83 0.00 0.00 0.00 174.94 175.92 1n62 s GLY 73 N 0.86 2.85 0.48 6.18 0.00 0.67 -0.63 107.32 117.73 1n62 s GLY 73 Ca -0.07 1.16 0.13 0.00 0.00 0.00 0.00 44.72 45.94 1n62 s GLY 73 CO -0.01 1.67 2.12 0.00 0.00 0.00 0.00 173.10 176.88 1n62 h ALA 74 N 1.91 1.90 -0.31 3.20 0.00 -0.16 -1.35 119.26 124.45 1n62 h ALA 74 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1n62 h ALA 74 Cb 1.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1n62 h ALA 74 CO 0.59 0.09 0.00 -1.33 0.00 0.00 0.00 179.25 178.60 1n62 n MET 75 N -4.52 1.82 -2.10 0.00 2.81 0.13 -0.22 117.12 115.04 1n62 n MET 75 Ca -0.01 -1.26 -0.42 0.00 -1.81 0.00 0.00 57.70 54.20 1n62 n MET 75 Cb 0.08 -1.32 -0.03 0.00 -0.71 0.00 0.00 33.22 31.24 1n62 n MET 75 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1n62 s THR 76 N -1.59 3.22 0.60 2.03 2.01 -0.51 -4.79 115.64 116.61 1n62 s THR 76 Ca 0.27 0.81 -0.10 0.00 0.31 0.00 0.00 61.69 62.98 1n62 s THR 76 Cb 0.14 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1n62 s THR 76 CO 0.20 0.04 0.99 0.42 -0.69 0.00 0.00 174.62 175.58 1n62 s THR 77 N 1.61 4.73 0.22 -0.82 -4.23 -1.26 -0.67 115.64 115.22 1n62 s THR 77 Ca 0.67 0.76 -0.08 0.00 -1.18 0.00 0.00 61.69 61.86 1n62 s THR 77 Cb -0.37 -3.87 0.16 0.00 1.34 0.00 0.00 72.50 69.76 1n62 s THR 77 CO 0.30 -1.10 1.76 1.56 -0.54 0.00 0.00 174.62 176.61 1n62 h GLN 78 N -0.23 0.49 -0.65 3.99 1.08 -0.98 0.17 115.11 118.98 1n62 h GLN 78 Ca -0.45 -0.03 0.06 0.00 -1.45 0.00 0.00 58.65 56.79 1n62 h GLN 78 Cb 1.19 -0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 28.46 1n62 h GLN 78 CO 0.62 0.32 0.34 1.25 -0.95 0.00 0.00 178.83 180.41 1n62 h HIS 79 N 0.50 0.62 -0.73 2.96 2.76 -1.29 -0.61 115.15 119.37 1n62 h HIS 79 Ca 0.33 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.47 1n62 h HIS 79 Cb 0.37 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.11 1n62 h HIS 79 CO -0.14 0.28 0.24 0.00 -1.30 0.00 0.00 177.93 177.02 1n62 h ALA 80 N 1.35 1.04 -0.42 5.26 0.00 -1.59 -0.48 119.26 124.42 1n62 h ALA 80 Ca 0.30 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1n62 h ALA 80 Cb 0.22 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1n62 h ALA 80 CO -0.20 0.65 0.25 -0.07 0.00 0.00 0.00 179.25 179.88 1n62 h LEU 81 N 1.08 0.40 -0.98 0.00 3.38 -0.10 -2.05 115.31 117.05 1n62 h LEU 81 Ca 0.24 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 1n62 h LEU 81 Cb 0.28 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1n62 h LEU 81 CO -0.01 0.29 0.23 0.40 0.09 0.00 0.00 178.44 179.44 1n62 h ILE 82 N 0.50 1.23 0.00 1.22 2.04 -0.85 -2.74 117.51 118.92 1n62 h ILE 82 Ca 0.17 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1n62 h ILE 82 Cb 0.01 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1n62 h ILE 82 CO -0.08 0.30 0.00 1.23 0.00 0.00 0.00 178.15 179.61 1n62 h GLY 83 N 1.04 0.00 -6.95 5.37 0.00 -0.46 -3.44 103.07 98.63 1n62 h GLY 83 Ca 0.22 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.99 1n62 h GLY 83 CO -0.01 0.00 1.02 -0.45 0.00 0.00 0.00 176.54 177.10 1n62 s SER 84 N -5.20 6.36 0.47 0.19 0.15 -0.83 -4.85 113.70 109.98 1n62 s SER 84 Ca 0.04 0.30 0.27 0.00 0.70 0.00 0.00 55.95 57.25 1n62 s SER 84 Cb 0.09 -2.55 0.95 0.00 -1.71 0.00 0.00 66.02 62.80 1n62 s SER 84 CO 0.52 -1.52 1.83 0.44 1.20 0.00 0.00 173.24 175.71 1n62 h ASP 85 N 10.12 0.00 -0.41 5.45 3.32 -1.89 -0.85 116.42 132.16 1n62 h ASP 85 Ca -0.26 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.64 1n62 h ASP 85 Cb 1.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1n62 h ASP 85 CO 1.16 0.13 -0.33 0.15 -1.72 0.00 0.00 179.24 178.64 1n62 h PHE 86 N 0.00 1.13 -0.32 4.55 3.57 -1.97 -0.98 116.94 122.92 1n62 h PHE 86 Ca -0.00 -0.31 -0.11 0.00 3.53 0.00 0.00 57.97 61.07 1n62 h PHE 86 Cb 0.74 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1n62 h PHE 86 CO 0.00 1.14 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.88 1n62 h LEU 87 N 0.80 0.65 -1.59 0.59 3.38 -1.77 -1.29 115.31 116.08 1n62 h LEU 87 Ca 0.08 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1n62 h LEU 87 Cb 0.92 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1n62 h LEU 87 CO 0.09 0.90 -0.21 0.00 0.09 0.00 0.00 178.44 179.30 1n62 h ALA 88 N 1.15 1.35 0.02 1.53 0.00 -0.71 0.53 119.26 123.12 1n62 h ALA 88 Ca 0.07 -0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.55 1n62 h ALA 88 Cb 0.75 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.53 1n62 h ALA 88 CO 0.06 0.27 -0.93 0.00 0.00 0.00 0.00 179.25 178.64 1n62 h ALA 89 N 1.79 0.09 0.08 0.00 0.00 -0.11 -3.20 119.26 117.91 1n62 h ALA 89 Ca -0.00 -0.67 -0.30 0.00 0.00 0.00 0.00 54.91 53.94 1n62 h ALA 89 Cb 0.47 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1n62 h ALA 89 CO 0.03 0.58 -1.64 0.87 0.00 0.00 0.00 179.25 179.09 1n62 h LYS 90 N 0.21 0.16 -1.90 0.00 1.79 -1.00 -3.43 116.57 112.41 1n62 h LYS 90 Ca -0.12 -0.28 -0.48 0.00 -2.18 0.00 0.00 60.65 57.59 1n62 h LYS 90 Cb 1.61 0.10 -0.40 0.00 -1.58 0.00 0.00 32.23 31.96 1n62 h LYS 90 CO 0.18 1.13 -1.10 1.28 -1.08 0.00 0.00 179.45 179.86 1n62 n LEU 91 N -3.91 1.57 0.31 2.94 4.77 0.18 -4.48 117.00 118.38 1n62 n LEU 91 Ca -0.31 -4.94 0.19 0.00 -0.03 0.00 0.00 56.01 50.92 1n62 n LEU 91 Cb 0.89 0.46 1.04 0.00 -2.33 0.00 0.00 43.42 43.47 1n62 n LEU 91 CO 0.33 2.20 1.11 1.55 -1.33 0.00 0.00 177.39 181.26 1n62 h PRO 92 N 2.98 0.00 0.00 3.23 0.13 -1.52 -0.56 132.00 136.26 1n62 h PRO 92 Ca 0.08 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1n62 h PRO 92 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 1n62 h PRO 92 CO 0.56 0.00 -0.04 0.97 -0.23 0.00 0.00 178.00 179.26 1n62 h ILE 93 N 0.00 0.74 0.12 -3.56 2.10 -1.89 -2.80 117.51 112.21 1n62 h ILE 93 Ca 0.00 -0.14 -0.01 0.00 1.08 0.00 0.00 64.86 65.80 1n62 h ILE 93 Cb 0.13 1.08 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1n62 h ILE 93 CO 0.00 0.03 -0.06 0.40 -1.08 0.00 0.00 178.15 177.45 1n62 h ILE 94 N 0.00 1.08 -0.79 2.19 2.04 -1.43 -0.46 117.51 120.14 1n62 h ILE 94 Ca -0.00 -0.90 0.10 0.00 1.00 0.00 0.00 64.86 65.06 1n62 h ILE 94 Cb 0.08 1.63 -0.08 0.00 -0.74 0.00 0.00 36.82 37.71 1n62 h ILE 94 CO 0.00 0.21 0.43 -0.09 0.00 0.00 0.00 178.15 178.70 1n62 h ARG 95 N -0.59 0.68 -0.45 2.37 2.43 -1.69 0.24 114.38 117.38 1n62 h ARG 95 Ca -0.02 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1n62 h ARG 95 Cb 0.47 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1n62 h ARG 95 CO 0.03 0.45 0.28 1.49 -1.51 0.00 0.00 179.97 180.71 1n62 h GLU 96 N 0.71 0.55 -0.12 0.20 4.81 -1.33 -1.09 114.58 118.31 1n62 h GLU 96 Ca 0.39 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 1n62 h GLU 96 Cb 0.40 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1n62 h GLU 96 CO -0.27 0.37 0.02 1.15 -0.73 0.00 0.00 179.01 179.55 1n62 h THR 97 N 0.57 1.22 -0.67 0.32 2.02 -0.39 -3.18 112.91 112.79 1n62 h THR 97 Ca 0.17 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.69 1n62 h THR 97 Cb -0.02 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 1n62 h THR 97 CO -0.06 0.20 0.45 0.28 0.37 0.00 0.00 175.52 176.75 1n62 h SER 98 N -0.03 0.74 0.47 4.18 0.02 -0.25 0.55 113.55 119.22 1n62 h SER 98 Ca 0.04 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1n62 h SER 98 Cb 0.29 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1n62 h SER 98 CO 0.00 0.52 0.00 0.18 -1.14 0.00 0.00 176.83 176.39 1n62 n LEU 99 N -4.45 0.14 -1.06 5.07 4.77 -0.44 -1.36 117.00 119.67 1n62 n LEU 99 Ca 0.08 0.54 0.11 0.00 -0.03 0.00 0.00 56.01 56.71 1n62 n LEU 99 Cb 0.08 -0.52 0.25 0.00 -2.33 0.00 0.00 43.42 40.90 1n62 n LEU 99 CO 0.35 -0.36 0.72 0.18 -1.33 0.00 0.00 177.39 176.96 1n62 n LEU 100 N -1.65 3.16 -4.57 2.23 4.77 0.17 -4.90 117.00 116.22 1n62 n LEU 100 Ca 0.03 -1.39 -0.36 0.00 -0.03 0.00 0.00 56.01 54.26 1n62 n LEU 100 Cb 0.16 -0.25 -0.11 0.00 -2.33 0.00 0.00 43.42 40.88 1n62 n LEU 100 CO 0.13 0.70 -0.24 -0.63 -1.33 0.00 0.00 177.39 176.01 1n62 s ILE 101 N -1.49 4.75 0.00 -0.08 1.01 -0.47 -4.85 121.20 120.07 1n62 s ILE 101 Ca 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 61.00 1n62 s ILE 101 Cb 0.22 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.50 1n62 s ILE 101 CO 0.30 0.38 0.00 0.00 0.00 0.00 0.00 174.94 175.62 1n62 n ALA 102 N 4.28 0.00 -3.26 9.38 0.00 -1.26 -4.77 120.51 124.88 1n62 n ALA 102 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.17 1n62 n ALA 102 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 1n62 n ALA 102 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1n62 s ASP 103 N -4.00 0.37 0.14 0.00 1.47 -1.26 -3.07 116.67 110.32 1n62 s ASP 103 Ca 0.00 -1.22 -0.16 0.00 1.18 0.00 0.00 52.55 52.35 1n62 s ASP 103 Cb 0.00 0.70 0.00 0.00 -0.34 0.00 0.00 42.92 43.29 1n62 s ASP 103 CO 0.00 -1.38 1.76 -0.65 0.68 0.00 0.00 175.17 175.58 1n62 h PRO 104 N 2.11 0.55 -0.42 2.11 0.11 -1.98 0.82 132.00 135.29 1n62 h PRO 104 Ca -0.28 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1n62 h PRO 104 Cb 1.25 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1n62 h PRO 104 CO 0.38 0.44 0.28 1.96 -0.21 0.00 0.00 178.00 180.84 1n62 h GLN 105 N 0.52 0.56 -0.29 1.05 7.50 -1.99 -1.03 115.11 121.42 1n62 h GLN 105 Ca 0.14 -0.03 -0.09 0.00 0.50 0.00 0.00 58.65 59.17 1n62 h GLN 105 Cb 0.04 -0.13 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 1n62 h GLN 105 CO -0.02 0.37 -0.21 0.82 -1.50 0.00 0.00 178.83 178.29 1n62 h ILE 106 N 0.57 1.26 0.00 2.54 2.04 -1.83 -2.68 117.51 119.41 1n62 h ILE 106 Ca 0.15 -1.22 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 1n62 h ILE 106 Cb -0.07 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1n62 h ILE 106 CO -0.03 0.39 -0.18 0.03 0.00 0.00 0.00 178.15 178.36 1n62 h ARG 107 N 0.49 0.00 -0.04 2.37 3.08 -0.38 0.43 114.38 120.32 1n62 h ARG 107 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1n62 h ARG 107 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 1n62 h ARG 107 CO 0.04 0.18 -0.30 1.88 -1.07 0.00 0.00 179.97 180.71 1n62 h TYR 108 N 0.00 0.08 0.00 3.04 0.05 -0.85 -0.15 116.97 119.15 1n62 h TYR 108 Ca -0.00 -0.01 -0.32 0.00 0.05 0.00 0.00 58.73 58.45 1n62 h TYR 108 Cb 0.70 -0.02 -0.05 0.00 1.01 0.00 0.00 36.73 38.37 1n62 h TYR 108 CO 0.00 0.37 -2.16 -1.33 -1.05 0.00 0.00 178.16 173.99 1n62 n MET 109 N -4.16 0.49 -2.16 4.88 2.81 -0.76 -4.82 117.12 113.40 1n62 n MET 109 Ca -0.02 0.14 -0.39 0.00 -1.81 0.00 0.00 57.70 55.62 1n62 n MET 109 Cb 0.36 -1.36 -0.01 0.00 -0.71 0.00 0.00 33.22 31.49 1n62 n MET 109 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1n62 s GLY 110 N -5.80 2.92 0.24 3.03 0.00 0.14 -3.89 107.32 103.96 1n62 s GLY 110 Ca -0.28 1.13 0.09 0.00 0.00 0.00 0.00 44.72 45.65 1n62 s GLY 110 CO 0.44 1.69 0.02 -0.51 0.00 0.00 0.00 173.10 174.74 1n62 s THR 111 N -1.30 3.64 0.20 0.90 -4.23 -1.26 -0.98 115.64 112.61 1n62 s THR 111 Ca 0.56 -1.72 -0.07 0.00 -1.18 0.00 0.00 61.69 59.28 1n62 s THR 111 Cb -0.35 -2.92 0.05 0.00 1.34 0.00 0.00 72.50 70.62 1n62 s THR 111 CO 0.45 -0.30 1.63 -0.29 -0.54 0.00 0.00 174.62 175.58 1n62 h ILE 112 N 2.01 1.26 -0.51 2.99 2.10 -0.95 -1.01 117.51 123.42 1n62 h ILE 112 Ca -0.46 -1.23 -0.11 0.00 1.08 0.00 0.00 64.86 64.14 1n62 h ILE 112 Cb 1.23 0.98 -0.02 0.00 -1.09 0.00 0.00 36.82 37.92 1n62 h ILE 112 CO 0.60 0.43 -0.13 1.23 -1.08 0.00 0.00 178.15 179.19 1n62 h GLY 113 N 0.96 1.05 1.91 8.18 0.00 -0.85 -0.66 103.07 113.65 1n62 h GLY 113 Ca 0.14 -0.85 -0.11 0.00 0.00 0.00 0.00 47.33 46.51 1n62 h GLY 113 CO 0.04 0.78 -0.47 -1.33 0.00 0.00 0.00 176.54 175.57 1n62 h GLY 114 N 0.94 0.11 1.36 4.60 0.00 -1.65 0.30 103.07 108.74 1n62 h GLY 114 Ca 0.13 -0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 1n62 h GLY 114 CO 0.05 0.10 -0.18 -0.57 0.00 0.00 0.00 176.54 175.94 1n62 h ASN 115 N 0.08 0.75 0.56 0.19 -0.73 -0.86 -0.93 115.58 114.64 1n62 h ASN 115 Ca 0.00 -0.25 -0.29 0.00 1.87 0.00 0.00 56.30 57.64 1n62 h ASN 115 Cb 0.86 -0.20 -0.00 0.00 0.27 0.00 0.00 38.32 39.24 1n62 h ASN 115 CO 0.07 0.93 -1.38 0.00 -0.37 0.00 0.00 177.43 176.67 1n62 h ALA 116 N 1.14 0.21 0.00 1.57 0.00 -0.68 -3.28 119.26 118.21 1n62 h ALA 116 Ca 0.10 -1.01 -0.04 0.00 0.00 0.00 0.00 54.91 53.96 1n62 h ALA 116 Cb 0.67 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1n62 h ALA 116 CO 0.05 1.08 -0.50 0.00 0.00 0.00 0.00 179.25 179.88 1n62 h ALA 117 N 0.57 0.77 -0.98 0.00 0.00 -0.40 -3.39 119.26 115.82 1n62 h ALA 117 Ca -0.18 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 54.74 1n62 h ALA 117 Cb 1.99 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.67 1n62 h ALA 117 CO 0.18 0.24 0.57 -0.97 0.00 0.00 0.00 179.25 179.27 1n62 h ASN 118 N 0.00 0.68 -1.75 0.00 -0.00 -1.23 -3.46 115.58 109.83 1n62 h ASN 118 Ca -0.02 0.12 -0.35 0.00 -0.00 0.00 0.00 56.30 56.05 1n62 h ASN 118 Cb 1.15 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 39.40 1n62 h ASN 118 CO 0.02 0.19 -0.39 0.61 -0.00 0.00 0.00 177.43 177.86 1n62 n GLY 119 N -1.32 0.53 3.66 1.57 0.00 -1.26 -4.48 105.19 103.88 1n62 n GLY 119 Ca 0.24 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1n62 n GLY 119 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n62 s ASP 120 N -2.48 6.43 0.06 1.61 2.15 -1.26 -0.09 116.67 123.08 1n62 s ASP 120 Ca 0.00 0.50 0.05 0.00 0.43 0.00 0.00 52.55 53.53 1n62 s ASP 120 Cb 0.00 -2.24 0.25 0.00 -0.30 0.00 0.00 42.92 40.64 1n62 s ASP 120 CO 0.00 -0.11 1.15 -0.81 -0.17 0.00 0.00 175.17 175.23 1n62 n PRO 121 N 4.68 0.03 0.19 4.34 -0.04 -1.26 -0.86 135.00 142.08 1n62 n PRO 121 Ca -0.08 0.50 0.03 0.00 -0.04 0.00 0.00 63.50 63.92 1n62 n PRO 121 Cb 0.51 -1.58 0.38 0.00 -0.04 0.00 0.00 33.50 32.77 1n62 n PRO 121 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1n62 h GLY 122 N 0.23 0.00 -2.96 0.55 0.00 -1.92 -2.82 103.07 96.15 1n62 h GLY 122 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1n62 h GLY 122 CO 0.00 0.00 0.60 -1.31 0.00 0.00 0.00 176.54 175.83 1n62 s ASN 123 N -6.91 5.66 0.02 0.19 0.02 -0.04 -4.36 114.94 109.52 1n62 s ASN 123 Ca -0.03 2.70 0.01 0.00 -1.02 0.00 0.00 52.86 54.52 1n62 s ASN 123 Cb 0.14 -2.63 -0.26 0.00 0.02 0.00 0.00 41.25 38.52 1n62 s ASN 123 CO 0.72 -1.30 0.91 0.44 0.02 0.00 0.00 177.10 177.89 1n62 h ASP 124 N 1.86 0.25 -0.43 -1.22 3.32 -1.89 -3.37 116.42 114.94 1n62 h ASP 124 Ca -0.50 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.14 1n62 h ASP 124 Cb 1.28 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 1n62 h ASP 124 CO 0.59 1.29 0.09 0.24 -1.72 0.00 0.00 179.24 179.73 1n62 h MET 125 N 0.04 0.78 -0.24 3.56 2.86 -1.91 -3.13 114.93 116.89 1n62 h MET 125 Ca -0.20 -0.17 0.06 0.00 -2.06 0.00 0.00 59.70 57.33 1n62 h MET 125 Cb 1.97 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 33.44 1n62 h MET 125 CO 0.14 0.73 -0.28 -1.35 1.06 0.00 0.00 176.91 177.21 1n62 h PRO 126 N 0.75 -0.28 0.00 -0.22 0.11 -1.81 0.18 132.00 130.73 1n62 h PRO 126 Ca 0.16 0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.20 1n62 h PRO 126 Cb 0.33 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1n62 h PRO 126 CO 0.00 -0.19 -0.43 0.00 -0.21 0.00 0.00 178.00 177.17 1n62 h ALA 127 N 0.68 1.12 -0.29 -0.75 0.00 -1.81 0.03 119.26 118.23 1n62 h ALA 127 Ca 0.13 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1n62 h ALA 127 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1n62 h ALA 127 CO -0.40 0.54 0.14 1.25 0.00 0.00 0.00 179.25 180.78 1n62 h LEU 128 N 0.00 0.38 -1.20 0.00 5.85 -1.25 0.12 115.31 119.22 1n62 h LEU 128 Ca -0.00 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 1n62 h LEU 128 Cb 0.86 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1n62 h LEU 128 CO 0.06 0.40 0.06 0.24 -0.34 0.00 0.00 178.44 178.85 1n62 h MET 129 N 0.34 0.61 -0.24 1.25 2.86 -0.03 0.24 114.93 119.96 1n62 h MET 129 Ca 0.10 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1n62 h MET 129 Cb 0.12 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1n62 h MET 129 CO -0.01 0.59 0.09 1.96 1.06 0.00 0.00 176.91 180.59 1n62 h GLN 130 N 0.59 0.37 -0.54 1.72 4.20 -0.72 0.51 115.11 121.23 1n62 h GLN 130 Ca 0.13 -0.07 0.10 0.00 0.06 0.00 0.00 58.65 58.87 1n62 h GLN 130 Cb 0.29 -0.06 -0.08 0.00 0.30 0.00 0.00 27.48 27.93 1n62 h GLN 130 CO 0.00 0.43 0.09 0.00 -0.67 0.00 0.00 178.83 178.69 1n62 n LEU 132 N -5.14 0.04 -2.88 0.00 4.77 0.02 -4.64 117.00 109.17 1n62 n LEU 132 Ca 0.07 0.51 -0.18 0.00 -0.03 0.00 0.00 56.01 56.38 1n62 n LEU 132 Cb 0.28 -0.50 0.06 0.00 -2.33 0.00 0.00 43.42 40.94 1n62 n LEU 132 CO 0.18 -0.10 0.18 0.61 -1.33 0.00 0.00 177.39 176.93 1n62 n GLY 133 N 0.95 -0.20 3.77 -0.72 0.00 -0.34 -4.38 105.19 104.28 1n62 n GLY 133 Ca 0.06 0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1n62 n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n62 s ALA 134 N -3.25 2.47 -0.04 4.61 0.00 0.02 -4.58 121.76 121.00 1n62 s ALA 134 Ca 0.41 0.50 0.06 0.00 0.00 0.00 0.00 51.96 52.93 1n62 s ALA 134 Cb -0.18 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 1n62 s ALA 134 CO 0.56 -1.29 -0.21 0.00 0.00 0.00 0.00 175.76 174.82 1n62 s ALA 135 N -2.42 2.38 -0.24 0.00 0.00 0.50 -0.74 121.76 121.25 1n62 s ALA 135 Ca 0.66 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 51.48 1n62 s ALA 135 Cb -0.20 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 1n62 s ALA 135 CO 0.43 0.53 0.12 0.71 0.00 0.00 0.00 175.76 177.55 1n62 s TYR 136 N -0.62 3.21 -0.26 0.00 2.02 0.64 -0.19 117.35 122.16 1n62 s TYR 136 Ca 0.09 -0.01 -0.20 0.00 -0.37 0.00 0.00 57.07 56.58 1n62 s TYR 136 Cb -0.11 -2.24 -0.02 0.00 -0.40 0.00 0.00 41.96 39.19 1n62 s TYR 136 CO -0.00 -0.08 0.62 -1.21 -1.57 0.00 0.00 175.55 173.30 1n62 s GLU 137 N 1.21 4.10 -0.07 -0.62 2.02 -0.16 -1.11 118.70 124.07 1n62 s GLU 137 Ca 0.06 0.51 0.03 0.00 0.02 0.00 0.00 54.97 55.60 1n62 s GLU 137 Cb -0.14 -3.65 -0.02 0.00 0.10 0.00 0.00 34.13 30.42 1n62 s GLU 137 CO 0.05 -0.41 -0.17 -0.51 0.02 0.00 0.00 175.26 174.24 1n62 s LEU 138 N 2.49 2.57 -0.06 1.80 1.43 0.11 -0.10 118.68 126.91 1n62 s LEU 138 Ca 0.26 -0.31 0.05 0.00 -1.03 0.00 0.00 54.13 53.10 1n62 s LEU 138 Cb -0.15 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 1n62 s LEU 138 CO 0.09 0.27 -0.22 -0.89 0.23 0.00 0.00 176.35 175.83 1n62 s THR 139 N -0.31 1.85 0.00 5.49 2.01 0.42 -0.44 115.64 124.66 1n62 s THR 139 Ca 0.02 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.08 1n62 s THR 139 Cb -0.13 -1.58 0.00 0.00 0.01 0.00 0.00 72.50 70.81 1n62 s THR 139 CO 0.03 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.08 1n62 n GLY 140 N 3.11 4.43 0.19 4.40 0.00 0.08 -0.30 105.19 117.10 1n62 n GLY 140 Ca -0.18 -1.60 0.14 0.00 0.00 0.00 0.00 46.02 44.39 1n62 n GLY 140 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n62 h PRO 141 N 0.00 0.00 -0.12 1.61 0.13 -1.85 -1.30 132.00 130.46 1n62 h PRO 141 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1n62 h PRO 141 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1n62 h PRO 141 CO 0.00 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.16 1n62 n GLU 142 N -2.55 2.34 0.00 0.86 1.02 -1.26 -5.05 120.64 116.00 1n62 n GLU 142 Ca 0.01 -1.97 0.00 0.00 -0.02 0.00 0.00 57.16 55.18 1n62 n GLU 142 Cb 0.22 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1n62 n GLU 142 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n62 n GLY 143 N 1.38 -0.43 3.83 0.62 0.00 -0.49 -5.03 105.19 105.06 1n62 n GLY 143 Ca 0.16 -2.20 -0.35 0.00 0.00 0.00 0.00 46.02 43.62 1n62 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n62 s ALA 144 N -2.00 3.43 0.24 4.61 0.00 -1.26 -0.74 121.76 126.04 1n62 s ALA 144 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.94 1n62 s ALA 144 Cb 0.00 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.36 1n62 s ALA 144 CO 0.00 0.35 0.42 -0.98 0.00 0.00 0.00 175.76 175.55 1n62 s ARG 145 N -2.18 1.50 -0.06 0.00 1.70 0.41 -5.00 118.95 115.33 1n62 s ARG 145 Ca 0.44 -1.34 0.05 0.00 -0.47 0.00 0.00 55.73 54.41 1n62 s ARG 145 Cb -0.15 0.43 -0.00 0.00 -0.57 0.00 0.00 34.95 34.66 1n62 s ARG 145 CO 0.20 -0.61 -0.21 0.42 -1.08 0.00 0.00 175.30 174.02 1n62 s ILE 146 N -4.00 1.79 -0.11 4.99 1.01 -1.26 -0.72 121.20 122.90 1n62 s ILE 146 Ca 0.26 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 60.02 1n62 s ILE 146 Cb 0.01 -1.53 0.01 0.00 0.01 0.00 0.00 42.46 40.96 1n62 s ILE 146 CO 0.10 0.50 -0.16 -0.69 0.00 0.00 0.00 174.94 174.70 1n62 s VAL 147 N 0.06 1.53 0.45 2.92 1.01 -0.27 -4.95 120.40 121.16 1n62 s VAL 147 Ca -0.07 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.00 1n62 s VAL 147 Cb -0.14 -1.40 -0.09 0.00 0.00 0.00 0.00 36.38 34.76 1n62 s VAL 147 CO 0.04 0.45 1.29 0.00 0.00 0.00 0.00 175.10 176.88 1n62 n ALA 148 N 4.21 1.39 -0.26 5.51 0.00 -1.26 -0.26 120.51 129.83 1n62 n ALA 148 Ca -0.19 0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.56 1n62 n ALA 148 Cb 0.51 -2.29 0.33 0.00 0.00 0.00 0.00 19.45 18.01 1n62 n ALA 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n62 h ALA 149 N 1.94 1.71 0.00 0.00 0.00 -1.25 0.13 119.26 121.80 1n62 h ALA 149 Ca -0.49 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1n62 h ALA 149 Cb 1.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1n62 h ALA 149 CO 0.59 0.09 -0.02 0.00 0.00 0.00 0.00 179.25 179.91 1n62 h ARG 150 N 0.80 0.00 -0.17 0.00 3.08 -1.88 -2.37 114.38 113.84 1n62 h ARG 150 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1n62 h ARG 150 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1n62 h ARG 150 CO -0.17 0.02 0.00 -0.25 -1.07 0.00 0.00 179.97 178.50 1n62 n ASP 151 N -3.41 2.75 0.07 7.04 8.00 0.43 -4.66 116.55 126.77 1n62 n ASP 151 Ca -0.02 -1.81 0.03 0.00 0.71 0.00 0.00 54.79 53.70 1n62 n ASP 151 Cb 0.13 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.09 1n62 n ASP 151 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1n62 h TYR 152 N 3.42 0.00 -3.34 1.24 3.20 -0.99 -3.44 116.97 117.06 1n62 h TYR 152 Ca 0.00 0.00 -0.66 0.00 3.14 0.00 0.00 58.73 61.21 1n62 h TYR 152 Cb 0.78 0.00 -0.27 0.00 1.54 0.00 0.00 36.73 38.77 1n62 h TYR 152 CO 0.10 0.44 -0.74 0.71 -1.64 0.00 0.00 178.16 177.03 1n62 s TYR 153 N -3.02 2.90 -0.01 -3.82 1.51 -1.26 -0.49 117.35 113.15 1n62 s TYR 153 Ca -0.01 -0.80 0.09 0.00 -1.01 0.00 0.00 57.07 55.34 1n62 s TYR 153 Cb 0.08 -1.98 -0.13 0.00 -0.11 0.00 0.00 41.96 39.82 1n62 s TYR 153 CO 0.79 -0.38 0.18 1.04 -1.11 0.00 0.00 175.55 176.07 1n62 n GLN 154 N 4.18 0.36 -3.21 -0.62 3.00 0.69 -4.98 117.38 116.80 1n62 n GLN 154 Ca -0.18 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.73 1n62 n GLN 154 Cb 0.52 -1.21 0.00 0.00 0.00 0.00 0.00 30.24 29.55 1n62 n GLN 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n62 n GLY 155 N 2.03 -1.40 3.65 1.08 0.00 -0.71 -4.86 105.19 104.97 1n62 n GLY 155 Ca -0.02 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 1n62 n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n62 s ALA 156 N -1.64 3.43 -2.14 4.61 0.00 -1.11 -0.82 121.76 124.10 1n62 s ALA 156 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1n62 s ALA 156 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1n62 s ALA 156 CO 0.00 -1.77 0.00 0.66 0.00 0.00 0.00 175.76 174.65 1n62 n TYR 157 N 8.21 -0.16 -4.00 0.00 4.01 0.87 -4.96 117.16 121.14 1n62 n TYR 157 Ca 0.21 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.64 1n62 n TYR 157 Cb 0.42 -3.55 -0.15 0.00 -0.31 0.00 0.00 39.34 35.75 1n62 n TYR 157 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1n62 s PHE 158 N -2.81 2.72 0.32 -0.72 0.08 0.00 -4.96 117.98 112.60 1n62 s PHE 158 Ca 0.00 -1.94 0.03 0.00 0.12 0.00 0.00 56.93 55.14 1n62 s PHE 158 Cb 0.00 -1.72 -0.04 0.00 -0.57 0.00 0.00 43.02 40.69 1n62 s PHE 158 CO 0.00 -0.81 0.15 0.95 -0.10 0.00 0.00 175.22 175.41 1n62 s THR 159 N 1.29 0.40 -1.23 0.64 -4.23 -1.26 -0.22 115.64 111.03 1n62 s THR 159 Ca -0.06 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.72 1n62 s THR 159 Cb -0.19 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.51 1n62 s THR 159 CO -0.06 0.00 1.92 0.00 -0.54 0.00 0.00 174.62 175.94 1n62 n ALA 160 N -0.62 2.32 -1.76 3.99 0.00 0.35 -4.84 120.51 119.95 1n62 n ALA 160 Ca 0.00 -0.11 -0.38 0.00 0.00 0.00 0.00 53.44 52.94 1n62 n ALA 160 Cb 0.65 -1.45 0.01 0.00 0.00 0.00 0.00 19.45 18.66 1n62 n ALA 160 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1n62 s ILE 161 N -2.77 2.56 0.27 0.00 2.07 -1.26 -5.01 121.20 117.06 1n62 s ILE 161 Ca 0.20 0.45 0.09 0.00 -1.41 0.00 0.00 60.65 59.98 1n62 s ILE 161 Cb 0.18 -3.24 -0.04 0.00 0.13 0.00 0.00 42.46 39.49 1n62 s ILE 161 CO 0.46 0.02 0.04 -1.61 -1.91 0.00 0.00 174.94 171.94 1n62 s GLU 162 N -2.60 2.42 0.15 3.50 2.02 -1.26 -5.04 118.70 117.89 1n62 s GLU 162 Ca 0.64 -1.36 -0.34 0.00 0.02 0.00 0.00 54.97 53.93 1n62 s GLU 162 Cb -0.36 -2.24 -0.15 0.00 0.10 0.00 0.00 34.13 31.48 1n62 s GLU 162 CO 0.45 0.36 1.44 -2.30 0.02 0.00 0.00 175.26 175.23 1n62 n PRO 163 N -0.96 1.72 -0.49 0.39 -0.02 -1.26 -1.78 135.00 132.59 1n62 n PRO 163 Ca -0.06 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1n62 n PRO 163 Cb 0.59 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1n62 n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n62 n GLY 164 N 2.85 0.96 3.87 -1.23 0.00 -1.26 -4.74 105.19 105.64 1n62 n GLY 164 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1n62 n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n62 s GLU 165 N -0.41 3.86 0.01 1.61 2.02 -0.74 -4.23 118.70 120.83 1n62 s GLU 165 Ca 0.00 0.39 0.06 0.00 0.02 0.00 0.00 54.97 55.44 1n62 s GLU 165 Cb 0.00 -2.60 -0.03 0.00 0.10 0.00 0.00 34.13 31.60 1n62 s GLU 165 CO 0.00 0.28 -0.17 -0.51 0.02 0.00 0.00 175.26 174.88 1n62 s LEU 166 N -2.83 2.62 -0.30 1.80 1.43 0.58 -4.89 118.68 117.10 1n62 s LEU 166 Ca 0.49 -0.35 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1n62 s LEU 166 Cb -0.11 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.59 1n62 s LEU 166 CO 0.20 0.29 1.10 -0.22 0.23 0.00 0.00 176.35 177.94 1n62 s LEU 167 N -1.16 3.96 -0.20 1.79 0.20 -1.26 -0.43 118.68 121.58 1n62 s LEU 167 Ca 0.13 1.14 0.16 0.00 0.69 0.00 0.00 54.13 56.26 1n62 s LEU 167 Cb -0.11 -3.54 -0.24 0.00 -0.43 0.00 0.00 46.19 41.87 1n62 s LEU 167 CO 0.03 -0.86 0.07 0.35 -0.29 0.00 0.00 176.35 175.65 1n62 n THR 168 N 5.79 1.41 -3.48 3.68 -2.24 0.85 -4.62 114.28 115.67 1n62 n THR 168 Ca 0.12 -0.83 -0.12 0.00 -2.27 0.00 0.00 64.05 60.95 1n62 n THR 168 Cb 0.47 -0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1n62 n THR 168 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n62 s ALA 169 N -2.50 -1.44 -0.13 6.98 0.00 -1.20 -1.35 121.76 122.12 1n62 s ALA 169 Ca -0.12 0.35 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1n62 s ALA 169 Cb 0.06 0.85 -0.00 0.00 0.00 0.00 0.00 23.12 24.03 1n62 s ALA 169 CO 0.81 -0.75 -0.18 0.42 0.00 0.00 0.00 175.76 176.07 1n62 s ILE 170 N -3.77 2.55 -0.28 0.00 1.01 0.19 -0.99 121.20 119.92 1n62 s ILE 170 Ca 0.02 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.77 1n62 s ILE 170 Cb -0.00 -2.04 0.00 0.00 0.01 0.00 0.00 42.46 40.43 1n62 s ILE 170 CO -0.12 0.53 0.06 -0.60 0.00 0.00 0.00 174.94 174.81 1n62 s ARG 171 N 0.54 3.20 -0.19 2.79 3.52 0.73 -0.53 118.95 129.01 1n62 s ARG 171 Ca -0.11 -0.77 0.00 0.00 -0.13 0.00 0.00 55.73 54.71 1n62 s ARG 171 Cb -0.16 -3.30 0.02 0.00 -1.56 0.00 0.00 34.95 29.94 1n62 s ARG 171 CO 0.04 -0.37 -0.16 0.42 -0.81 0.00 0.00 175.30 174.42 1n62 s ILE 172 N 1.51 2.36 0.29 4.11 1.01 0.14 -0.37 121.20 130.24 1n62 s ILE 172 Ca 0.03 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.50 1n62 s ILE 172 Cb -0.16 -2.04 -0.11 0.00 0.01 0.00 0.00 42.46 40.16 1n62 s ILE 172 CO 0.02 0.48 1.60 -2.84 0.00 0.00 0.00 174.94 174.20 1n62 s PRO 173 N 1.32 4.12 -0.19 2.79 0.02 -1.26 -0.24 135.00 141.56 1n62 s PRO 173 Ca 0.04 2.58 -0.28 0.00 0.02 0.00 0.00 61.00 63.36 1n62 s PRO 173 Cb -0.14 -3.03 -0.00 0.00 0.02 0.00 0.00 34.50 31.35 1n62 s PRO 173 CO -0.10 -0.64 0.98 0.08 -0.33 0.00 0.00 177.00 176.99 1n62 s VAL 174 N 0.10 4.75 0.85 3.83 1.01 -0.12 -4.82 120.40 126.00 1n62 s VAL 174 Ca 0.64 1.93 -0.10 0.00 0.00 0.00 0.00 61.98 64.45 1n62 s VAL 174 Cb -0.48 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 31.74 1n62 s VAL 174 CO 0.47 -0.09 1.12 -2.84 0.00 0.00 0.00 175.10 173.75 1n62 s PRO 175 N 2.71 1.56 0.56 2.72 0.02 -1.26 -4.93 135.00 136.39 1n62 s PRO 175 Ca 0.43 1.32 -0.20 0.00 0.02 0.00 0.00 61.00 62.57 1n62 s PRO 175 Cb -0.16 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.50 1n62 s PRO 175 CO 0.10 -2.18 1.14 -2.30 -0.33 0.00 0.00 177.00 173.43 1n62 n PRO 176 N -3.90 1.25 -1.66 5.54 -0.02 -1.26 -4.90 135.00 130.06 1n62 n PRO 176 Ca 0.10 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.62 1n62 n PRO 176 Cb 0.53 -2.33 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1n62 n PRO 176 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1n62 n THR 177 N -1.34 2.05 -1.00 3.45 -2.24 -1.26 -1.46 114.28 112.48 1n62 n THR 177 Ca 0.12 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1n62 n THR 177 Cb 0.45 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 1n62 n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n62 n GLY 178 N 0.93 0.60 3.73 3.38 0.00 -1.26 -5.02 105.19 107.56 1n62 n GLY 178 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1n62 n GLY 178 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1n62 s HIS 179 N -2.44 2.13 0.38 1.61 -0.00 -0.54 -4.24 115.29 112.19 1n62 s HIS 179 Ca 0.00 1.59 -0.13 0.00 -0.00 0.00 0.00 55.06 56.52 1n62 s HIS 179 Cb 0.00 -3.45 -0.08 0.00 -0.00 0.00 0.00 32.58 29.06 1n62 s HIS 179 CO 0.00 -2.50 0.78 0.20 -0.00 0.00 0.00 174.74 173.22 1n62 s GLY 180 N -2.04 2.12 0.08 -1.38 0.00 0.11 -4.33 107.32 101.88 1n62 s GLY 180 Ca 0.74 -0.06 -0.22 0.00 0.00 0.00 0.00 44.72 45.18 1n62 s GLY 180 CO 0.44 0.14 0.53 -2.52 0.00 0.00 0.00 173.10 171.69 1n62 s TYR 181 N -2.24 -0.43 -0.18 1.90 1.13 -1.26 -1.34 117.35 114.93 1n62 s TYR 181 Ca 0.53 0.37 -0.29 0.00 -1.41 0.00 0.00 57.07 56.27 1n62 s TYR 181 Cb -0.10 0.38 0.12 0.00 -1.10 0.00 0.00 41.96 41.27 1n62 s TYR 181 CO 0.25 -0.70 1.00 0.00 -2.51 0.00 0.00 175.55 173.59 1n62 s ALA 182 N -2.94 -1.94 -0.15 9.51 0.00 -0.39 -3.85 121.76 121.99 1n62 s ALA 182 Ca -0.03 1.64 -0.00 0.00 0.00 0.00 0.00 51.96 53.58 1n62 s ALA 182 Cb -0.00 -0.86 0.03 0.00 0.00 0.00 0.00 23.12 22.29 1n62 s ALA 182 CO -0.06 -0.29 -0.09 -0.47 0.00 0.00 0.00 175.76 174.85 1n62 s TYR 183 N -0.80 1.91 -0.21 0.00 5.04 -1.26 -0.80 117.35 121.23 1n62 s TYR 183 Ca -0.01 -1.13 -0.00 0.00 -2.44 0.00 0.00 57.07 53.48 1n62 s TYR 183 Cb -0.01 -1.43 0.02 0.00 0.35 0.00 0.00 41.96 40.88 1n62 s TYR 183 CO 0.00 -0.63 -0.13 -2.00 -1.34 0.00 0.00 175.55 171.45 1n62 s GLU 184 N 1.57 3.01 -0.04 4.97 2.56 0.05 -4.87 118.70 125.94 1n62 s GLU 184 Ca 0.02 -0.84 0.05 0.00 0.00 0.00 0.00 54.97 54.21 1n62 s GLU 184 Cb -0.14 -2.76 -0.01 0.00 2.00 0.00 0.00 34.13 33.22 1n62 s GLU 184 CO -0.09 -0.26 -0.20 0.21 -0.56 0.00 0.00 175.26 174.36 1n62 s LYS 185 N 1.33 1.97 -0.18 4.30 2.20 -1.26 -0.85 119.74 127.25 1n62 s LYS 185 Ca 0.04 -0.71 -0.03 0.00 -0.36 0.00 0.00 55.97 54.90 1n62 s LYS 185 Cb -0.14 -1.73 -0.02 0.00 -1.51 0.00 0.00 37.83 34.43 1n62 s LYS 185 CO -0.09 0.32 -0.05 -1.17 -0.36 0.00 0.00 175.35 174.00 1n62 s LEU 186 N -0.12 3.08 0.17 5.43 2.96 -0.22 -5.01 118.68 124.97 1n62 s LEU 186 Ca -0.01 -0.24 -0.10 0.00 -0.22 0.00 0.00 54.13 53.56 1n62 s LEU 186 Cb -0.11 -1.75 -0.00 0.00 0.50 0.00 0.00 46.19 44.82 1n62 s LEU 186 CO 0.02 0.10 0.31 -1.59 -1.32 0.00 0.00 176.35 173.87 1n62 s LYS 187 N 0.76 1.18 0.18 1.98 -2.85 -1.26 -0.19 119.74 119.53 1n62 s LYS 187 Ca -0.02 -1.13 0.08 0.00 -1.00 0.00 0.00 55.97 53.90 1n62 s LYS 187 Cb -0.15 0.39 0.02 0.00 -2.06 0.00 0.00 37.83 36.04 1n62 s LYS 187 CO 0.02 -0.44 1.41 0.00 0.10 0.00 0.00 175.35 176.44 1n62 h ARG 188 N 2.51 0.02 -1.87 1.78 3.08 -1.88 -3.48 114.38 114.54 1n62 h ARG 188 Ca -0.31 -0.02 0.24 0.00 0.07 0.00 0.00 59.98 59.96 1n62 h ARG 188 Cb 1.23 0.01 -0.12 0.00 0.08 0.00 0.00 29.97 31.17 1n62 h ARG 188 CO 0.47 0.85 0.66 -1.59 -1.07 0.00 0.00 179.97 179.30 1n62 s LYS 189 N -3.09 0.73 0.08 0.04 -2.85 -1.26 -5.06 119.74 108.33 1n62 s LYS 189 Ca -0.00 -0.38 -0.36 0.00 -1.00 0.00 0.00 55.97 54.23 1n62 s LYS 189 Cb 0.11 0.26 -0.18 0.00 -2.06 0.00 0.00 37.83 35.96 1n62 s LYS 189 CO 0.80 -0.33 1.00 -0.89 0.10 0.00 0.00 175.35 176.03 1n62 n ILE 190 N -0.41 0.55 0.00 3.79 2.08 -1.26 -1.35 119.36 122.77 1n62 n ILE 190 Ca -0.07 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.11 1n62 n ILE 190 Cb 0.61 -0.21 0.00 0.00 -0.75 0.00 0.00 39.64 39.29 1n62 n ILE 190 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1n62 n GLY 191 N 1.78 2.86 3.77 7.39 0.00 -1.18 -5.01 105.19 114.81 1n62 n GLY 191 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1n62 n GLY 191 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n62 s ASP 192 N -1.39 7.22 0.61 1.61 2.15 -0.46 -4.53 116.67 121.88 1n62 s ASP 192 Ca 0.00 2.03 -0.18 0.00 0.43 0.00 0.00 52.55 54.84 1n62 s ASP 192 Cb 0.00 -2.60 -0.03 0.00 -0.30 0.00 0.00 42.92 39.99 1n62 s ASP 192 CO 0.00 -0.16 1.18 -0.31 -0.17 0.00 0.00 175.17 175.71 1n62 s TYR 193 N -1.42 2.43 0.34 -5.34 2.02 -1.26 -4.82 117.35 109.29 1n62 s TYR 193 Ca 0.49 1.54 -0.29 0.00 -0.37 0.00 0.00 57.07 58.44 1n62 s TYR 193 Cb -0.25 -3.41 -0.11 0.00 -0.40 0.00 0.00 41.96 37.80 1n62 s TYR 193 CO 0.31 -2.08 1.46 0.00 -1.57 0.00 0.00 175.55 173.67 1n62 s ALA 194 N -1.77 3.59 0.16 3.71 0.00 -1.26 -4.66 121.76 121.53 1n62 s ALA 194 Ca 0.75 1.48 -0.15 0.00 0.00 0.00 0.00 51.96 54.04 1n62 s ALA 194 Cb -0.28 -3.58 0.04 0.00 0.00 0.00 0.00 23.12 19.31 1n62 s ALA 194 CO 0.34 -0.92 1.82 1.15 0.00 0.00 0.00 175.76 178.16 1n62 h THR 195 N 3.12 1.13 -1.96 0.00 2.02 -0.91 -3.45 112.91 112.86 1n62 h THR 195 Ca -0.49 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 1n62 h THR 195 Cb 1.23 0.44 -0.19 0.00 -1.74 0.00 0.00 68.15 67.88 1n62 h THR 195 CO 0.68 0.13 0.27 0.00 0.37 0.00 0.00 175.52 176.98 1n62 s ALA 196 N -6.11 -1.80 0.05 6.16 0.00 -1.20 -4.73 121.76 114.12 1n62 s ALA 196 Ca -0.13 1.33 -0.10 0.00 0.00 0.00 0.00 51.96 53.07 1n62 s ALA 196 Cb 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1n62 s ALA 196 CO 0.74 -0.38 0.20 0.00 0.00 0.00 0.00 175.76 176.32 1n62 s ALA 197 N -1.32 -0.37 -0.02 0.00 0.00 -0.98 -1.05 121.76 118.02 1n62 s ALA 197 Ca -0.08 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.60 1n62 s ALA 197 Cb -0.00 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1n62 s ALA 197 CO 0.07 -0.38 -0.08 0.00 0.00 0.00 0.00 175.76 175.37 1n62 s ALA 198 N -2.70 0.79 -0.14 0.00 0.00 -0.03 -0.55 121.76 119.13 1n62 s ALA 198 Ca -0.04 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.59 1n62 s ALA 198 Cb -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1n62 s ALA 198 CO -0.05 0.13 -0.01 0.00 0.00 0.00 0.00 175.76 175.83 1n62 s ALA 199 N 0.20 3.13 -0.02 0.00 0.00 0.56 -0.77 121.76 124.85 1n62 s ALA 199 Ca -0.03 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1n62 s ALA 199 Cb -0.08 -1.59 0.01 0.00 0.00 0.00 0.00 23.12 21.46 1n62 s ALA 199 CO 0.00 0.30 -0.06 0.08 0.00 0.00 0.00 175.76 176.09 1n62 s VAL 200 N 0.06 0.51 0.01 0.00 1.01 0.02 -0.43 120.40 121.58 1n62 s VAL 200 Ca 0.01 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.82 1n62 s VAL 200 Cb -0.13 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 1n62 s VAL 200 CO 0.02 0.17 -0.13 -0.69 0.00 0.00 0.00 175.10 174.47 1n62 s VAL 201 N 0.23 1.05 0.08 2.92 1.01 -0.54 -1.27 120.40 123.89 1n62 s VAL 201 Ca -0.03 -0.73 -0.22 0.00 0.00 0.00 0.00 61.98 61.00 1n62 s VAL 201 Cb -0.07 -0.91 0.06 0.00 0.00 0.00 0.00 36.38 35.46 1n62 s VAL 201 CO -0.00 0.17 0.54 -1.48 0.00 0.00 0.00 175.10 174.33 1n62 s LEU 202 N -0.64 -0.21 0.17 3.92 0.05 -0.45 -0.52 118.68 121.00 1n62 s LEU 202 Ca 0.04 0.10 0.07 0.00 0.05 0.00 0.00 54.13 54.39 1n62 s LEU 202 Cb -0.06 2.26 -0.04 0.00 -2.05 0.00 0.00 46.19 46.30 1n62 s LEU 202 CO 0.00 -0.80 -0.15 0.42 -0.55 0.00 0.00 176.35 175.27 1n62 s THR 203 N -2.90 1.63 0.16 5.48 -4.23 -0.35 0.04 115.64 115.47 1n62 s THR 203 Ca -0.03 -1.97 0.08 0.00 -1.18 0.00 0.00 61.69 58.59 1n62 s THR 203 Cb -0.00 -1.83 -0.04 0.00 1.34 0.00 0.00 72.50 71.96 1n62 s THR 203 CO -0.05 -0.46 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.36 1n62 s MET 204 N -3.10 1.23 -0.21 3.99 -1.94 -1.26 -0.46 119.30 117.55 1n62 s MET 204 Ca 0.16 -1.41 -0.11 0.00 -1.71 0.00 0.00 55.69 52.62 1n62 s MET 204 Cb -0.03 -1.19 0.07 0.00 2.01 0.00 0.00 34.83 35.69 1n62 s MET 204 CO 0.05 0.23 0.51 0.45 -0.01 0.00 0.00 175.02 176.26 1n62 s SER 205 N -2.76 -0.67 -1.37 3.03 0.15 0.16 -4.85 113.70 107.39 1n62 s SER 205 Ca 0.16 1.13 0.00 0.00 0.70 0.00 0.00 55.95 57.94 1n62 s SER 205 Cb -0.04 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.32 1n62 s SER 205 CO 0.06 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1n62 n GLY 206 N 4.37 0.41 1.97 9.45 0.00 -1.26 -1.04 105.19 119.10 1n62 n GLY 206 Ca -0.21 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1n62 n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n62 n GLY 207 N -1.07 0.42 3.03 -0.02 0.00 -1.26 -5.00 105.19 101.29 1n62 n GLY 207 Ca -0.16 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 1n62 n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n62 s LYS 208 N -1.42 0.81 0.06 1.61 3.01 -0.21 -4.32 119.74 119.28 1n62 s LYS 208 Ca 0.00 -0.34 -0.31 0.00 -1.01 0.00 0.00 55.97 54.31 1n62 s LYS 208 Cb 0.00 -0.78 -0.07 0.00 -1.01 0.00 0.00 37.83 35.98 1n62 s LYS 208 CO 0.00 0.20 1.38 0.00 0.51 0.00 0.00 175.35 177.44 1n62 n VAL 210 N 4.29 1.51 -4.01 0.00 0.31 0.39 0.38 118.33 121.20 1n62 n VAL 210 Ca 0.12 -0.62 -0.09 0.00 -0.01 0.00 0.00 64.34 63.73 1n62 n VAL 210 Cb 0.43 -1.31 -0.11 0.00 -0.91 0.00 0.00 33.84 31.94 1n62 n VAL 210 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1n62 s THR 211 N -2.52 0.20 -0.15 2.52 -4.23 -1.18 -4.80 115.64 105.48 1n62 s THR 211 Ca -0.30 -1.07 -0.17 0.00 -1.18 0.00 0.00 61.69 58.97 1n62 s THR 211 Cb 0.08 -0.50 0.05 0.00 1.34 0.00 0.00 72.50 73.47 1n62 s THR 211 CO 0.65 -0.55 0.47 0.00 -0.54 0.00 0.00 174.62 174.65 1n62 s ALA 212 N -1.80 -1.18 -0.03 3.99 0.00 -1.26 -1.21 121.76 120.27 1n62 s ALA 212 Ca -0.12 1.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1n62 s ALA 212 Cb -0.07 -0.62 0.01 0.00 0.00 0.00 0.00 23.12 22.44 1n62 s ALA 212 CO -0.02 -0.24 0.10 0.45 0.00 0.00 0.00 175.76 176.05 1n62 s SER 213 N -0.06 -0.09 -0.06 0.00 0.15 0.32 -4.54 113.70 109.43 1n62 s SER 213 Ca -0.03 0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.80 1n62 s SER 213 Cb -0.03 0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.51 1n62 s SER 213 CO 0.02 -0.07 -0.07 -0.63 1.20 0.00 0.00 173.24 173.69 1n62 s ILE 214 N -0.09 0.78 0.10 6.45 1.01 -1.26 -1.47 121.20 126.72 1n62 s ILE 214 Ca -0.02 -0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.46 1n62 s ILE 214 Cb -0.02 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 1n62 s ILE 214 CO 0.00 0.28 -0.14 -0.83 0.00 0.00 0.00 174.94 174.25 1n62 s GLY 215 N 0.87 1.73 -0.09 6.18 0.00 0.43 -0.86 107.32 115.58 1n62 s GLY 215 Ca -0.11 -1.29 0.03 0.00 0.00 0.00 0.00 44.72 43.35 1n62 s GLY 215 CO 0.01 -1.26 -0.20 1.08 0.00 0.00 0.00 173.10 172.73 1n62 s LEU 216 N -2.12 1.95 -0.15 0.66 1.43 0.10 -0.32 118.68 120.24 1n62 s LEU 216 Ca 0.19 -0.48 -0.06 0.00 -1.03 0.00 0.00 54.13 52.75 1n62 s LEU 216 Cb -0.11 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 1n62 s LEU 216 CO 0.11 0.12 0.07 -0.89 0.23 0.00 0.00 176.35 175.99 1n62 s THR 217 N 0.47 4.90 -1.47 5.49 2.01 0.28 -1.28 115.64 126.03 1n62 s THR 217 Ca -0.17 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.75 1n62 s THR 217 Cb -0.17 -3.16 0.02 0.00 0.01 0.00 0.00 72.50 69.20 1n62 s THR 217 CO 0.07 0.53 0.79 -3.20 -0.69 0.00 0.00 174.62 172.11 1n62 n ASN 218 N 2.87 -5.79 -1.18 3.53 5.15 -1.07 -2.31 115.26 116.48 1n62 n ASN 218 Ca -0.18 -0.42 0.03 0.00 -0.60 0.00 0.00 54.58 53.41 1n62 n ASN 218 Cb 0.53 -4.64 0.11 0.00 -0.53 0.00 0.00 39.78 35.25 1n62 n ASN 218 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1n62 n VAL 219 N -4.60 1.31 -3.78 3.44 0.24 -1.26 -4.70 118.33 108.97 1n62 n VAL 219 Ca -0.05 -2.41 -0.01 0.00 -2.04 0.00 0.00 64.34 59.82 1n62 n VAL 219 Cb 0.59 0.27 0.01 0.00 -1.47 0.00 0.00 33.84 33.24 1n62 n VAL 219 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1n62 n ALA 220 N -0.42 -1.93 1.71 2.33 0.00 -1.25 -0.32 120.51 120.63 1n62 n ALA 220 Ca 0.15 -0.66 0.15 0.00 0.00 0.00 0.00 53.44 53.08 1n62 n ALA 220 Cb 0.90 0.33 0.83 0.00 0.00 0.00 0.00 19.45 21.51 1n62 n ALA 220 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1n62 n ASN 221 N -1.01 0.10 -4.30 0.00 2.04 -1.26 -4.70 115.26 106.12 1n62 n ASN 221 Ca -0.01 -0.66 -0.16 0.00 -0.44 0.00 0.00 54.58 53.32 1n62 n ASN 221 Cb 0.39 -0.11 -0.10 0.00 -2.53 0.00 0.00 39.78 37.43 1n62 n ASN 221 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 1n62 s THR 222 N -2.26 0.81 0.95 5.53 -4.23 -1.26 -2.73 115.64 112.45 1n62 s THR 222 Ca 0.39 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.77 1n62 s THR 222 Cb 0.21 -2.35 0.08 0.00 1.34 0.00 0.00 72.50 71.78 1n62 s THR 222 CO 0.41 -0.29 0.64 -0.81 -0.54 0.00 0.00 174.62 174.03 1n62 n PRO 223 N -0.38 -0.45 -4.50 3.99 -0.04 -1.26 -4.57 135.00 127.80 1n62 n PRO 223 Ca -0.04 -0.08 -0.21 0.00 -0.04 0.00 0.00 63.50 63.13 1n62 n PRO 223 Cb 0.64 -2.02 -0.15 0.00 -0.04 0.00 0.00 33.50 31.93 1n62 n PRO 223 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1n62 s LEU 224 N -2.96 1.94 -0.26 1.53 1.43 -0.41 -4.98 118.68 114.98 1n62 s LEU 224 Ca 0.60 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 53.37 1n62 s LEU 224 Cb -0.21 -0.61 -0.05 0.00 0.03 0.00 0.00 46.19 45.35 1n62 s LEU 224 CO 0.64 0.12 0.24 0.86 0.23 0.00 0.00 176.35 178.44 1n62 s TRP 225 N -0.11 3.27 -1.17 0.29 -0.00 -1.26 0.02 118.94 119.99 1n62 s TRP 225 Ca 0.02 0.27 -0.09 0.00 -0.00 0.00 0.00 56.10 56.30 1n62 s TRP 225 Cb -0.06 -2.40 0.24 0.00 -0.00 0.00 0.00 33.47 31.25 1n62 s TRP 225 CO 0.00 -0.08 1.45 0.00 -0.00 0.00 0.00 176.95 178.32 1n62 n ALA 226 N 4.79 4.63 -0.05 5.86 0.00 -0.04 -4.81 120.51 130.90 1n62 n ALA 226 Ca -0.13 -4.53 -0.11 0.00 0.00 0.00 0.00 53.44 48.68 1n62 n ALA 226 Cb 0.52 -2.69 -0.05 0.00 0.00 0.00 0.00 19.45 17.23 1n62 n ALA 226 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1n62 h GLU 227 N 6.26 0.27 -0.75 0.00 4.81 -1.94 -1.61 114.58 121.62 1n62 h GLU 227 Ca 0.26 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1n62 h GLU 227 Cb 0.75 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 1n62 h GLU 227 CO 1.28 0.35 0.33 0.93 -0.73 0.00 0.00 179.01 181.17 1n62 h GLU 228 N 0.14 1.11 -0.75 1.92 5.08 -1.90 -1.54 114.58 118.64 1n62 h GLU 228 Ca 0.06 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1n62 h GLU 228 Cb 0.17 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1n62 h GLU 228 CO -0.01 0.89 0.30 0.00 -1.00 0.00 0.00 179.01 179.19 1n62 h ALA 229 N 1.17 1.10 -0.34 3.43 0.00 -1.74 -1.86 119.26 121.03 1n62 h ALA 229 Ca 0.26 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1n62 h ALA 229 Cb 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1n62 h ALA 229 CO -0.03 0.64 -0.07 0.78 0.00 0.00 0.00 179.25 180.57 1n62 h GLY 230 N 1.13 0.70 1.03 0.00 0.00 -0.97 -3.09 103.07 101.87 1n62 h GLY 230 Ca 0.25 -0.57 0.04 0.00 0.00 0.00 0.00 47.33 47.06 1n62 h GLY 230 CO -0.02 0.52 0.54 1.70 0.00 0.00 0.00 176.54 179.28 1n62 h LYS 231 N 0.43 0.95 0.00 4.80 3.64 -0.92 -1.76 116.57 123.71 1n62 h LYS 231 Ca 0.09 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1n62 h LYS 231 Cb 0.56 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1n62 h LYS 231 CO 0.03 0.63 -0.09 -0.24 -2.27 0.00 0.00 179.45 177.50 1n62 h VAL 232 N 0.97 0.22 0.00 2.00 3.04 -1.26 -1.65 116.25 119.57 1n62 h VAL 232 Ca 0.33 -0.85 -0.12 0.00 -1.01 0.00 0.00 66.70 65.06 1n62 h VAL 232 Cb 0.10 1.70 -0.02 0.00 -2.01 0.00 0.00 31.29 31.06 1n62 h VAL 232 CO -0.11 0.09 -0.59 -0.07 -1.01 0.00 0.00 177.57 175.89 1n62 h LEU 233 N 0.00 0.00 -9.51 3.16 3.38 -1.32 -3.44 115.31 107.59 1n62 h LEU 233 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1n62 h LEU 233 Cb 0.69 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.46 1n62 h LEU 233 CO 0.01 0.59 0.83 -0.69 0.09 0.00 0.00 178.44 179.27 1n62 s VAL 234 N -3.56 3.20 0.00 1.22 1.01 -0.62 -1.76 120.40 119.89 1n62 s VAL 234 Ca -0.01 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1n62 s VAL 234 Cb 0.12 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1n62 s VAL 234 CO 0.75 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.50 1n62 n GLY 235 N 3.67 0.76 4.00 4.51 0.00 0.16 -4.98 105.19 113.31 1n62 n GLY 235 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 1n62 n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n62 s THR 236 N -2.32 2.98 -2.05 2.61 -4.23 -0.73 -4.78 115.64 107.12 1n62 s THR 236 Ca 0.00 -0.91 0.11 0.00 -1.18 0.00 0.00 61.69 59.70 1n62 s THR 236 Cb 0.00 -3.02 0.28 0.00 1.34 0.00 0.00 72.50 71.10 1n62 s THR 236 CO 0.00 -0.01 1.29 0.00 -0.54 0.00 0.00 174.62 175.36 1n62 n ALA 237 N -1.96 2.49 -3.71 3.99 0.00 -1.26 -0.73 120.51 119.32 1n62 n ALA 237 Ca 0.08 -0.40 -0.23 0.00 0.00 0.00 0.00 53.44 52.89 1n62 n ALA 237 Cb 0.59 -1.03 0.04 0.00 0.00 0.00 0.00 19.45 19.05 1n62 n ALA 237 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1n62 n LEU 238 N 0.11 -3.11 0.00 0.00 4.77 -1.26 -4.89 117.00 112.62 1n62 n LEU 238 Ca 0.10 -0.76 -0.09 0.00 -0.03 0.00 0.00 56.01 55.22 1n62 n LEU 238 Cb 0.20 -2.72 0.04 0.00 -2.33 0.00 0.00 43.42 38.61 1n62 n LEU 238 CO 0.07 0.44 0.20 -0.90 -1.33 0.00 0.00 177.39 175.87 1n62 n ASP 239 N -3.01 0.75 -0.20 -1.43 5.68 -1.26 -4.81 116.55 112.27 1n62 n ASP 239 Ca -0.19 -1.58 -0.08 0.00 -0.50 0.00 0.00 54.79 52.44 1n62 n ASP 239 Cb 0.63 -0.24 0.02 0.00 -1.14 0.00 0.00 41.12 40.40 1n62 n ASP 239 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1n62 h LYS 240 N 0.00 0.88 -0.49 0.11 3.64 -1.98 0.75 116.57 119.48 1n62 h LYS 240 Ca -0.13 -0.19 0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1n62 h LYS 240 Cb 0.54 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.18 1n62 h LYS 240 CO 0.16 0.79 0.21 -1.35 -2.27 0.00 0.00 179.45 176.99 1n62 h PRO 241 N 0.80 0.40 -0.22 1.90 0.11 -1.99 0.20 132.00 133.20 1n62 h PRO 241 Ca 0.18 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 1n62 h PRO 241 Cb 0.27 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1n62 h PRO 241 CO -0.01 0.26 0.04 0.00 -0.21 0.00 0.00 178.00 178.09 1n62 h ALA 242 N 1.30 0.29 -0.56 -0.75 0.00 -1.67 -2.11 119.26 115.76 1n62 h ALA 242 Ca 0.23 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1n62 h ALA 242 Cb 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1n62 h ALA 242 CO -0.20 -0.04 0.07 -0.07 0.00 0.00 0.00 179.25 179.02 1n62 h LEU 243 N 0.16 0.86 -0.74 0.00 -0.00 -0.64 -1.29 115.31 113.65 1n62 h LEU 243 Ca 0.07 -0.19 0.01 0.00 -0.00 0.00 0.00 57.88 57.76 1n62 h LEU 243 Cb 0.31 -0.23 -0.04 0.00 -0.00 0.00 0.00 40.66 40.71 1n62 h LEU 243 CO 0.00 0.88 0.49 0.44 -0.00 0.00 0.00 178.44 180.25 1n62 h ASP 244 N 0.85 0.85 -0.64 -0.43 3.32 -0.41 0.20 116.42 120.16 1n62 h ASP 244 Ca 0.17 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 1n62 h ASP 244 Cb 0.40 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1n62 h ASP 244 CO 0.01 0.62 0.07 0.11 -1.72 0.00 0.00 179.24 178.33 1n62 h LYS 245 N 1.01 1.08 -0.46 3.56 1.57 -0.88 -0.93 116.57 121.51 1n62 h LYS 245 Ca 0.27 -0.31 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1n62 h LYS 245 Cb -0.12 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 1n62 h LYS 245 CO -0.06 1.01 0.08 0.00 -0.57 0.00 0.00 179.45 179.91 1n62 h ALA 246 N 1.02 0.61 -0.68 3.86 0.00 -0.77 -1.39 119.26 121.91 1n62 h ALA 246 Ca 0.19 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1n62 h ALA 246 Cb 0.48 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1n62 h ALA 246 CO 0.02 0.33 0.44 0.28 0.00 0.00 0.00 179.25 180.32 1n62 h VAL 247 N 0.63 1.13 -0.05 0.00 2.07 -0.45 0.80 116.25 120.38 1n62 h VAL 247 Ca 0.14 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1n62 h VAL 247 Cb 0.38 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1n62 h VAL 247 CO 0.01 0.16 0.03 0.00 0.02 0.00 0.00 177.57 177.79 1n62 h ALA 248 N 1.27 0.07 0.00 1.67 0.00 -0.76 0.20 119.26 121.70 1n62 h ALA 248 Ca 0.26 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1n62 h ALA 248 Cb -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1n62 h ALA 248 CO -0.08 -0.44 -0.35 -0.07 0.00 0.00 0.00 179.25 178.31 1n62 h LEU 249 N 0.07 0.00 -0.00 0.00 3.38 -0.81 -1.27 115.31 116.67 1n62 h LEU 249 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1n62 h LEU 249 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1n62 h LEU 249 CO -0.00 0.35 -0.04 0.00 0.09 0.00 0.00 178.44 178.84 1n62 h ALA 250 N 1.65 0.01 -0.83 1.53 0.00 -0.55 -3.31 119.26 117.77 1n62 h ALA 250 Ca -0.00 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.63 1n62 h ALA 250 Cb 0.63 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1n62 h ALA 250 CO 0.05 -0.11 0.48 0.93 0.00 0.00 0.00 179.25 180.59 1n62 h GLU 251 N -0.65 0.78 -0.35 0.00 5.08 -0.51 -2.34 114.58 116.60 1n62 h GLU 251 Ca -0.00 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1n62 h GLU 251 Cb 0.74 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1n62 h GLU 251 CO 0.01 0.52 0.26 0.00 -1.00 0.00 0.00 179.01 178.80 1n62 h ALA 252 N 1.45 2.28 -0.01 3.43 0.00 -1.32 -1.37 119.26 123.72 1n62 h ALA 252 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1n62 h ALA 252 Cb 0.34 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1n62 h ALA 252 CO -0.24 -0.44 -0.31 0.44 0.00 0.00 0.00 179.25 178.70 1n62 n ILE 253 N -4.33 0.00 -1.46 0.00 -5.35 -0.88 -4.94 119.36 102.40 1n62 n ILE 253 Ca 0.05 -0.16 -0.30 0.00 -0.27 0.00 0.00 62.75 62.07 1n62 n ILE 253 Cb 0.44 0.61 0.08 0.00 -1.74 0.00 0.00 39.64 39.03 1n62 n ILE 253 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1n62 s THR 254 N -2.49 3.43 -0.47 7.28 -4.23 -0.52 -4.97 115.64 113.67 1n62 s THR 254 Ca 0.23 0.46 0.06 0.00 -1.18 0.00 0.00 61.69 61.26 1n62 s THR 254 Cb 0.19 -3.13 0.27 0.00 1.34 0.00 0.00 72.50 71.17 1n62 s THR 254 CO 0.53 -0.60 1.00 0.00 -0.54 0.00 0.00 174.62 175.01 1n62 n ALA 255 N -3.39 -1.27 -1.43 3.99 0.00 0.56 -5.00 120.51 113.97 1n62 n ALA 255 Ca 0.08 -1.37 -0.31 0.00 0.00 0.00 0.00 53.44 51.84 1n62 n ALA 255 Cb 0.54 -1.36 0.08 0.00 0.00 0.00 0.00 19.45 18.71 1n62 n ALA 255 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1n62 s PRO 256 N 0.51 2.44 0.48 0.00 0.02 -1.03 -3.95 135.00 133.47 1n62 s PRO 256 Ca 0.28 0.97 -0.21 0.00 0.02 0.00 0.00 61.00 62.06 1n62 s PRO 256 Cb 0.25 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.76 1n62 s PRO 256 CO -0.17 -1.45 1.04 0.00 -0.33 0.00 0.00 177.00 176.09 1n62 s ALA 257 N -3.00 2.90 -0.43 -1.55 0.00 -1.26 -4.61 121.76 113.80 1n62 s ALA 257 Ca 0.60 0.63 -0.17 0.00 0.00 0.00 0.00 51.96 53.02 1n62 s ALA 257 Cb -0.15 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.74 1n62 s ALA 257 CO 0.55 -0.31 0.41 -1.12 0.00 0.00 0.00 175.76 175.29 1n62 s SER 258 N -1.91 6.17 0.00 0.00 0.01 -1.26 -4.02 113.70 112.68 1n62 s SER 258 Ca 0.66 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 57.06 1n62 s SER 258 Cb -0.17 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1n62 s SER 258 CO 0.21 -0.59 0.00 -0.90 0.41 0.00 0.00 173.24 172.38 1n62 n ASP 259 N 5.47 0.00 0.29 2.44 5.68 -0.72 -4.95 116.55 124.77 1n62 n ASP 259 Ca -0.09 0.00 0.20 0.00 -0.50 0.00 0.00 54.79 54.40 1n62 n ASP 259 Cb 0.46 0.00 1.03 0.00 -1.14 0.00 0.00 41.12 41.47 1n62 n ASP 259 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1n62 h GLY 260 N 0.00 0.00 1.51 6.12 0.00 -2.03 0.22 103.07 108.89 1n62 h GLY 260 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1n62 h GLY 260 CO 0.00 0.00 -0.05 0.54 0.00 0.00 0.00 176.54 177.03 1n62 n ARG 261 N -2.88 0.36 0.00 4.80 1.74 -1.26 -5.00 116.66 114.42 1n62 n ARG 261 Ca -0.02 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1n62 n ARG 261 Cb 0.09 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 1n62 n ARG 261 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n62 n GLY 262 N 1.34 2.42 3.86 -0.13 0.00 0.07 -4.92 105.19 107.84 1n62 n GLY 262 Ca 0.12 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 1n62 n GLY 262 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n62 s PRO 263 N -1.92 3.57 0.30 1.61 0.04 -1.26 -1.75 135.00 135.59 1n62 s PRO 263 Ca 0.00 0.79 0.06 0.00 0.04 0.00 0.00 61.00 61.89 1n62 s PRO 263 Cb 0.00 -2.08 0.74 0.00 0.04 0.00 0.00 34.50 33.20 1n62 s PRO 263 CO 0.00 -0.59 1.76 0.00 0.04 0.00 0.00 177.00 178.21 1n62 h ALA 264 N -0.24 1.64 -0.16 8.56 0.00 -1.82 -0.93 119.26 126.31 1n62 h ALA 264 Ca -0.44 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1n62 h ALA 264 Cb 1.19 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1n62 h ALA 264 CO 0.61 -0.10 -0.19 1.05 0.00 0.00 0.00 179.25 180.63 1n62 h GLU 265 N 0.71 0.27 -0.15 0.00 9.09 -1.92 -0.15 114.58 122.43 1n62 h GLU 265 Ca 0.58 -0.08 -0.04 0.00 0.05 0.00 0.00 59.36 59.87 1n62 h GLU 265 Cb 0.93 -0.03 -0.00 0.00 -1.65 0.00 0.00 28.75 28.00 1n62 h GLU 265 CO -0.40 0.46 -0.07 -0.92 0.05 0.00 0.00 179.01 178.13 1n62 h TYR 266 N 0.26 0.37 -0.35 2.06 3.20 -1.56 -2.35 116.97 118.59 1n62 h TYR 266 Ca 0.05 -0.09 -0.07 0.00 3.14 0.00 0.00 58.73 61.76 1n62 h TYR 266 Cb 0.48 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 1n62 h TYR 266 CO 0.01 0.63 -0.08 0.00 -1.64 0.00 0.00 178.16 177.08 1n62 h ARG 267 N -0.00 0.59 -0.20 1.82 3.08 -0.74 0.99 114.38 119.92 1n62 h ARG 267 Ca 0.04 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 59.95 1n62 h ARG 267 Cb 0.53 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1n62 h ARG 267 CO 0.02 0.67 0.03 1.15 -1.07 0.00 0.00 179.97 180.77 1n62 h THR 268 N 0.55 0.90 -0.35 2.04 2.02 -0.98 0.87 112.91 117.96 1n62 h THR 268 Ca 0.10 -0.04 -0.05 0.00 0.77 0.00 0.00 66.41 67.20 1n62 h THR 268 Cb 0.47 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1n62 h THR 268 CO 0.03 0.02 0.03 0.11 0.37 0.00 0.00 175.52 176.07 1n62 h LYS 269 N 0.11 0.54 0.00 6.66 1.79 -0.83 -2.18 116.57 122.65 1n62 h LYS 269 Ca 0.09 -0.11 -0.10 0.00 -2.18 0.00 0.00 60.65 58.35 1n62 h LYS 269 Cb 0.09 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1n62 h LYS 269 CO -0.12 0.55 -0.50 0.52 -1.08 0.00 0.00 179.45 178.81 1n62 h MET 270 N 0.52 0.00 -0.52 3.15 2.86 -0.21 -0.13 114.93 120.60 1n62 h MET 270 Ca 0.11 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1n62 h MET 270 Cb 0.30 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 1n62 h MET 270 CO 0.01 0.50 0.34 0.00 1.06 0.00 0.00 176.91 178.81 1n62 h ALA 271 N 1.50 0.67 -0.48 6.32 0.00 -0.22 0.17 119.26 127.21 1n62 h ALA 271 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1n62 h ALA 271 Cb 1.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1n62 h ALA 271 CO 0.06 0.08 0.28 0.78 0.00 0.00 0.00 179.25 180.45 1n62 h GLY 272 N 0.68 0.71 0.95 0.00 0.00 -0.88 -0.55 103.07 103.98 1n62 h GLY 272 Ca 0.20 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 1n62 h GLY 272 CO -0.06 0.29 -0.06 -2.08 0.00 0.00 0.00 176.54 174.63 1n62 h VAL 273 N 0.64 1.27 -0.83 4.60 2.07 -0.62 0.18 116.25 123.57 1n62 h VAL 273 Ca 0.17 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1n62 h VAL 273 Cb 0.01 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1n62 h VAL 273 CO -0.03 0.37 0.51 0.24 0.02 0.00 0.00 177.57 178.68 1n62 h MET 274 N 0.51 1.12 0.15 1.57 2.86 -0.61 -0.90 114.93 119.62 1n62 h MET 274 Ca 0.10 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1n62 h MET 274 Cb 0.56 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 1n62 h MET 274 CO 0.03 0.77 -0.26 1.25 1.06 0.00 0.00 176.91 179.77 1n62 h LEU 275 N 1.13 -0.72 -0.54 1.22 5.85 -0.76 0.21 115.31 121.71 1n62 h LEU 275 Ca 0.30 0.08 0.09 0.00 0.84 0.00 0.00 57.88 59.19 1n62 h LEU 275 Cb -0.07 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 1n62 h LEU 275 CO -0.06 -0.35 0.12 0.03 -0.34 0.00 0.00 178.44 177.84 1n62 h ARG 276 N -0.48 0.25 -0.31 1.25 3.08 -0.55 0.17 114.38 117.80 1n62 h ARG 276 Ca 0.02 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.92 1n62 h ARG 276 Cb 0.49 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1n62 h ARG 276 CO -0.13 0.17 -0.36 0.00 -1.07 0.00 0.00 179.97 178.58 1n62 h ARG 277 N 0.26 0.70 -0.52 0.04 3.08 -0.87 -0.19 114.38 116.89 1n62 h ARG 277 Ca 0.27 -0.34 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1n62 h ARG 277 Cb 0.37 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1n62 h ARG 277 CO -0.34 0.95 -0.06 0.00 -1.07 0.00 0.00 179.97 179.45 1n62 h ALA 278 N 1.01 0.71 -0.47 0.04 0.00 -0.08 -1.09 119.26 119.38 1n62 h ALA 278 Ca 0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1n62 h ALA 278 Cb 0.89 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1n62 h ALA 278 CO 0.08 0.58 0.18 0.28 0.00 0.00 0.00 179.25 180.37 1n62 h VAL 279 N 0.83 1.21 -0.43 0.00 2.07 -0.39 0.17 116.25 119.70 1n62 h VAL 279 Ca 0.14 -0.67 0.04 0.00 0.82 0.00 0.00 66.70 67.03 1n62 h VAL 279 Cb 0.61 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 1n62 h VAL 279 CO 0.04 0.25 0.19 -0.33 0.02 0.00 0.00 177.57 177.74 1n62 h GLU 280 N 0.61 0.38 -0.34 1.57 5.08 -0.85 0.32 114.58 121.36 1n62 h GLU 280 Ca 0.15 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.36 1n62 h GLU 280 Cb 0.21 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1n62 h GLU 280 CO -0.01 0.25 -0.32 0.00 -1.00 0.00 0.00 179.01 177.93 1n62 h ARG 281 N 0.39 0.74 -0.43 2.33 3.08 -0.77 -1.81 114.38 117.92 1n62 h ARG 281 Ca 0.19 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1n62 h ARG 281 Cb 0.13 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1n62 h ARG 281 CO -0.15 0.96 0.23 0.00 -1.07 0.00 0.00 179.97 179.93 1n62 h ALA 282 N 1.01 0.55 -0.56 0.04 0.00 -0.32 -1.48 119.26 118.50 1n62 h ALA 282 Ca 0.07 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1n62 h ALA 282 Cb 0.85 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1n62 h ALA 282 CO 0.07 0.09 0.33 -0.22 0.00 0.00 0.00 179.25 179.52 1n62 h LYS 283 N 0.56 0.62 -0.30 0.00 3.64 -0.13 0.16 116.57 121.12 1n62 h LYS 283 Ca 0.15 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 1n62 h LYS 283 Cb 0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1n62 h LYS 283 CO -0.02 0.41 -0.13 0.00 -2.27 0.00 0.00 179.45 177.44 1n62 h ALA 284 N 1.26 1.21 -0.20 5.00 0.00 -1.13 -2.41 119.26 123.00 1n62 h ALA 284 Ca 0.23 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1n62 h ALA 284 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1n62 h ALA 284 CO -0.12 0.51 -0.49 0.00 0.00 0.00 0.00 179.25 179.15 1n62 h ARG 285 N 0.48 0.53 0.00 0.00 3.08 -0.56 -3.51 114.38 114.39 1n62 h ARG 285 Ca 0.09 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1n62 h ARG 285 Cb 0.51 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1n62 h ARG 285 CO 0.03 0.90 0.00 0.00 -1.07 0.00 0.00 179.97 179.84