#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fa0 n SER 3 N 0.00 0.00 0.00 4.04 3.41 -1.26 -4.99 113.62 114.82 1fa0 n SER 3 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.66 1fa0 n SER 3 Cb 0.00 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.18 1fa0 n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fa0 n GLN 4 N -0.01 0.09 0.29 4.33 6.02 -1.26 -1.99 117.38 124.85 1fa0 n GLN 4 Ca 0.00 0.25 0.17 0.00 -0.01 0.00 0.00 57.00 57.40 1fa0 n GLN 4 Cb 0.00 -1.50 0.89 0.00 1.02 0.00 0.00 30.24 30.65 1fa0 n GLN 4 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1fa0 h LYS 5 N 0.00 0.00 0.00 -1.09 1.79 -1.94 -0.86 116.57 114.48 1fa0 h LYS 5 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1fa0 h LYS 5 Cb 0.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 1fa0 h LYS 5 CO 0.00 0.05 0.00 1.33 -1.08 0.00 0.00 179.45 179.75 1fa0 n VAL 6 N -3.43 0.45 0.35 0.50 0.24 -0.84 -2.12 118.33 113.48 1fa0 n VAL 6 Ca -0.02 0.11 0.11 0.00 -2.04 0.00 0.00 64.34 62.51 1fa0 n VAL 6 Cb 0.18 -0.83 0.25 0.00 -1.47 0.00 0.00 33.84 31.97 1fa0 n VAL 6 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1fa0 n PHE 7 N -1.26 0.54 -0.46 6.34 3.72 -0.33 -3.88 117.46 122.14 1fa0 n PHE 7 Ca 0.09 -0.27 0.06 0.00 -0.05 0.00 0.00 57.45 57.27 1fa0 n PHE 7 Cb 0.13 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 1fa0 n PHE 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fa0 n GLY 8 N 1.47 -2.46 0.00 1.37 0.00 -0.90 -2.55 105.19 102.12 1fa0 n GLY 8 Ca 0.20 -1.35 0.02 0.00 0.00 0.00 0.00 46.02 44.88 1fa0 n GLY 8 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fa0 n ILE 9 N -2.94 0.00 -0.64 -0.61 -5.35 -1.26 -1.45 119.36 107.10 1fa0 n ILE 9 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1fa0 n ILE 9 Cb 0.22 -0.52 0.00 0.00 -1.74 0.00 0.00 39.64 37.60 1fa0 n ILE 9 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1fa0 n THR 10 N -0.68 0.01 -0.50 7.28 -2.24 -1.26 -5.11 114.28 111.77 1fa0 n THR 10 Ca 0.03 -0.18 0.06 0.00 -2.27 0.00 0.00 64.05 61.69 1fa0 n THR 10 Cb 0.01 1.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.85 1fa0 n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fa0 n GLY 11 N -0.00 -2.31 3.74 3.38 0.00 -0.53 -4.91 105.19 104.56 1fa0 n GLY 11 Ca 0.00 -1.35 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 1fa0 n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fa0 s PRO 12 N -2.62 1.96 -0.04 1.61 0.04 -1.23 -4.83 135.00 129.89 1fa0 s PRO 12 Ca 0.00 1.34 -0.02 0.00 0.04 0.00 0.00 61.00 62.37 1fa0 s PRO 12 Cb 0.00 -1.85 -0.27 0.00 0.04 0.00 0.00 34.50 32.42 1fa0 s PRO 12 CO 0.00 -1.89 0.69 0.28 0.04 0.00 0.00 177.00 176.12 1fa0 h VAL 13 N -1.15 0.95 -2.50 -0.36 2.07 -1.51 -3.47 116.25 110.28 1fa0 h VAL 13 Ca -0.44 -2.65 -0.09 0.00 0.82 0.00 0.00 66.70 64.34 1fa0 h VAL 13 Cb 1.25 2.64 -0.21 0.00 -1.52 0.00 0.00 31.29 33.44 1fa0 h VAL 13 CO 0.49 0.78 -0.07 -0.55 0.02 0.00 0.00 177.57 178.24 1fa0 s SER 14 N -6.86 -0.48 -0.02 0.57 0.15 -1.23 -5.05 113.70 100.79 1fa0 s SER 14 Ca -0.12 0.71 0.07 0.00 0.70 0.00 0.00 55.95 57.31 1fa0 s SER 14 Cb 0.07 0.73 0.20 0.00 -1.71 0.00 0.00 66.02 65.31 1fa0 s SER 14 CO 0.83 -0.37 1.16 0.35 1.20 0.00 0.00 173.24 176.41 1fa0 n THR 15 N 1.89 1.13 -2.01 6.45 -2.24 -1.26 -4.28 114.28 113.96 1fa0 n THR 15 Ca -0.17 -1.12 -0.41 0.00 -2.27 0.00 0.00 64.05 60.08 1fa0 n THR 15 Cb 0.56 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.19 1fa0 n THR 15 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1fa0 s VAL 16 N -1.22 2.53 0.80 2.28 1.01 -1.26 -4.48 120.40 120.05 1fa0 s VAL 16 Ca 0.16 0.50 -0.12 0.00 0.00 0.00 0.00 61.98 62.52 1fa0 s VAL 16 Cb 0.10 -3.32 0.07 0.00 0.00 0.00 0.00 36.38 33.23 1fa0 s VAL 16 CO 0.08 0.11 1.12 -0.83 0.00 0.00 0.00 175.10 175.59 1fa0 s GLY 17 N -0.17 1.61 0.13 4.51 0.00 -1.26 -4.10 107.32 108.04 1fa0 s GLY 17 Ca 0.53 -0.39 -0.30 0.00 0.00 0.00 0.00 44.72 44.55 1fa0 s GLY 17 CO 0.53 0.06 1.12 0.00 0.00 0.00 0.00 173.10 174.81 1fa0 s ALA 18 N -3.32 3.36 0.67 3.20 0.00 -1.19 -4.95 121.76 119.54 1fa0 s ALA 18 Ca 0.61 0.81 -0.12 0.00 0.00 0.00 0.00 51.96 53.26 1fa0 s ALA 18 Cb -0.13 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1fa0 s ALA 18 CO 0.52 -0.28 1.06 0.95 0.00 0.00 0.00 175.76 178.01 1fa0 s THR 19 N 0.22 4.01 0.37 0.00 -4.23 -1.26 -4.81 115.64 109.93 1fa0 s THR 19 Ca 0.52 0.73 0.09 0.00 -1.18 0.00 0.00 61.69 61.85 1fa0 s THR 19 Cb -0.29 -3.41 0.32 0.00 1.34 0.00 0.00 72.50 70.46 1fa0 s THR 19 CO 0.33 -0.78 1.89 0.00 -0.54 0.00 0.00 174.62 175.52 1fa0 h ALA 20 N -0.40 1.85 0.29 3.99 0.00 -1.99 -0.63 119.26 122.38 1fa0 h ALA 20 Ca -0.45 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1fa0 h ALA 20 Cb 1.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1fa0 h ALA 20 CO 0.57 -0.07 -0.29 0.00 0.00 0.00 0.00 179.25 179.47 1fa0 h ALA 21 N 1.60 -0.98 -0.78 0.00 0.00 -2.00 -1.50 119.26 115.60 1fa0 h ALA 21 Ca 0.42 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 55.40 1fa0 h ALA 21 Cb 0.67 0.52 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 1fa0 h ALA 21 CO -0.18 -1.00 0.16 0.93 0.00 0.00 0.00 179.25 179.17 1fa0 h GLU 22 N -0.57 0.21 -0.51 0.00 5.08 -1.72 0.30 114.58 117.37 1fa0 h GLU 22 Ca -0.04 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1fa0 h GLU 22 Cb 0.49 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1fa0 h GLU 22 CO -0.03 0.14 0.35 -0.91 -1.00 0.00 0.00 179.01 177.55 1fa0 h ASN 23 N 0.22 0.34 0.13 1.42 2.35 -0.82 0.37 115.58 119.59 1fa0 h ASN 23 Ca 0.45 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.20 1fa0 h ASN 23 Cb 0.82 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.13 1fa0 h ASN 23 CO -0.58 0.22 -0.06 0.50 -1.65 0.00 0.00 177.43 175.85 1fa0 h LYS 24 N 0.39 -0.16 -0.46 0.81 3.64 0.65 -0.71 116.57 120.71 1fa0 h LYS 24 Ca 0.23 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.76 1fa0 h LYS 24 Cb 0.41 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1fa0 h LYS 24 CO -0.06 0.23 0.35 -0.07 -2.27 0.00 0.00 179.45 177.64 1fa0 h LEU 25 N -0.61 0.00 -0.14 5.20 3.38 -0.76 0.22 115.31 122.60 1fa0 h LEU 25 Ca -0.02 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1fa0 h LEU 25 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 1fa0 h LEU 25 CO 0.03 0.00 -0.64 -1.13 0.09 0.00 0.00 178.44 176.79 1fa0 h ASN 26 N 0.00 0.80 -0.14 -0.43 -0.73 -0.63 -2.50 115.58 111.95 1fa0 h ASN 26 Ca 0.22 -0.63 0.02 0.00 1.87 0.00 0.00 56.30 57.78 1fa0 h ASN 26 Cb 0.92 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 39.25 1fa0 h ASN 26 CO -0.00 1.30 0.02 0.44 -0.37 0.00 0.00 177.43 178.82 1fa0 h ASP 27 N 0.36 -0.01 -0.98 1.15 3.32 0.93 -1.49 116.42 119.71 1fa0 h ASP 27 Ca -0.04 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.08 1fa0 h ASP 27 Cb 1.27 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.80 1fa0 h ASP 27 CO 0.13 0.02 0.64 0.77 -1.72 0.00 0.00 179.24 179.08 1fa0 h SER 28 N 0.08 1.05 -0.35 6.45 4.64 -1.25 -2.02 113.55 122.15 1fa0 h SER 28 Ca 0.06 -0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.42 1fa0 h SER 28 Cb 0.06 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 61.87 1fa0 h SER 28 CO -0.09 0.71 0.09 0.25 -0.87 0.00 0.00 176.83 176.92 1fa0 h LEU 29 N 1.22 0.06 -0.33 5.97 5.85 -0.88 -0.24 115.31 126.97 1fa0 h LEU 29 Ca 0.40 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.21 1fa0 h LEU 29 Cb 0.04 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 1fa0 h LEU 29 CO -0.13 0.07 0.08 0.40 -0.34 0.00 0.00 178.44 178.52 1fa0 h ILE 30 N 0.23 0.86 -0.46 4.05 1.08 -0.65 -1.64 117.51 120.98 1fa0 h ILE 30 Ca 0.17 -0.07 0.03 0.00 -0.39 0.00 0.00 64.86 64.60 1fa0 h ILE 30 Cb 0.17 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.54 1fa0 h ILE 30 CO -0.20 0.04 0.30 -0.61 -0.69 0.00 0.00 178.15 176.99 1fa0 h GLN 31 N 0.20 0.49 -0.06 2.37 5.75 -0.66 0.14 115.11 123.34 1fa0 h GLN 31 Ca 0.15 -0.03 -0.16 0.00 -0.15 0.00 0.00 58.65 58.46 1fa0 h GLN 31 Cb 0.15 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 1fa0 h GLN 31 CO -0.19 0.32 -0.68 1.49 -2.65 0.00 0.00 178.83 177.13 1fa0 h GLU 32 N 0.50 0.25 0.00 1.69 4.57 -0.21 -0.97 114.58 120.41 1fa0 h GLU 32 Ca 0.18 -0.19 -0.11 0.00 -1.18 0.00 0.00 59.36 58.06 1fa0 h GLU 32 Cb 0.11 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1fa0 h GLU 32 CO -0.05 0.83 -0.51 -0.07 -1.18 0.00 0.00 179.01 178.03 1fa0 h LEU 33 N 0.17 0.00 0.70 1.64 3.38 -0.38 -1.69 115.31 119.14 1fa0 h LEU 33 Ca -0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1fa0 h LEU 33 Cb 1.22 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.97 1fa0 h LEU 33 CO 0.11 0.51 -0.33 0.11 0.09 0.00 0.00 178.44 178.92 1fa0 h LYS 34 N 0.00 -0.90 -0.92 1.13 1.79 -0.52 0.51 116.57 117.65 1fa0 h LYS 34 Ca -0.01 0.06 0.18 0.00 -2.18 0.00 0.00 60.65 58.71 1fa0 h LYS 34 Cb 1.03 0.20 -0.08 0.00 -1.58 0.00 0.00 32.23 31.81 1fa0 h LYS 34 CO 0.07 -0.57 0.59 -0.22 -1.08 0.00 0.00 179.45 178.24 1fa0 h LYS 35 N -1.15 0.56 0.00 3.15 3.64 -1.16 0.57 116.57 122.18 1fa0 h LYS 35 Ca -0.10 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1fa0 h LYS 35 Cb 0.74 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1fa0 h LYS 35 CO 0.16 0.37 0.00 -1.91 -2.27 0.00 0.00 179.45 175.80 1fa0 n GLU 36 N -4.58 0.99 -2.50 1.90 4.07 -0.64 -4.89 120.64 114.99 1fa0 n GLU 36 Ca 0.19 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.18 1fa0 n GLU 36 Cb 0.59 -1.38 0.01 0.00 -0.06 0.00 0.00 31.44 30.60 1fa0 n GLU 36 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1fa0 n GLY 37 N 0.86 0.01 0.21 8.31 0.00 0.20 -4.98 105.19 109.80 1fa0 n GLY 37 Ca 0.18 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 1fa0 n GLY 37 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1fa0 h SER 38 N -0.48 -0.44 -4.21 1.61 0.87 -1.04 -3.43 113.55 106.43 1fa0 h SER 38 Ca -0.27 0.02 -0.51 0.00 -1.23 0.00 0.00 61.79 59.79 1fa0 h SER 38 Cb 1.19 0.11 0.10 0.00 -0.44 0.00 0.00 62.40 63.37 1fa0 h SER 38 CO 0.30 -0.24 0.37 -0.36 -0.53 0.00 0.00 176.83 176.37 1fa0 s PHE 39 N -3.65 2.63 0.40 2.24 0.40 -1.26 -4.27 117.98 114.47 1fa0 s PHE 39 Ca -0.08 1.55 0.08 0.00 -0.60 0.00 0.00 56.93 57.88 1fa0 s PHE 39 Cb 0.01 -3.16 -0.03 0.00 0.51 0.00 0.00 43.02 40.35 1fa0 s PHE 39 CO 0.23 -1.68 0.30 -1.83 0.70 0.00 0.00 175.22 172.93 1fa0 s GLU 40 N -4.15 2.47 0.54 0.44 -1.05 -1.26 -4.64 118.70 111.04 1fa0 s GLU 40 Ca 0.66 -1.58 -0.12 0.00 -0.15 0.00 0.00 54.97 53.79 1fa0 s GLU 40 Cb -0.20 -2.28 -0.05 0.00 -0.44 0.00 0.00 34.13 31.16 1fa0 s GLU 40 CO 0.42 -0.11 0.95 0.95 0.95 0.00 0.00 175.26 178.42 1fa0 s THR 41 N -2.48 4.70 0.38 1.83 -4.23 -1.26 -4.91 115.64 109.67 1fa0 s THR 41 Ca 0.45 0.85 0.10 0.00 -1.18 0.00 0.00 61.69 61.90 1fa0 s THR 41 Cb -0.02 -3.81 0.32 0.00 1.34 0.00 0.00 72.50 70.33 1fa0 s THR 41 CO 0.26 -0.90 1.92 -0.33 -0.54 0.00 0.00 174.62 175.03 1fa0 h GLU 42 N 0.30 0.60 -0.26 3.99 5.08 -1.99 -0.98 114.58 121.32 1fa0 h GLU 42 Ca -0.46 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 57.70 1fa0 h GLU 42 Cb 1.19 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 1fa0 h GLU 42 CO 0.62 0.40 -0.53 0.37 -1.00 0.00 0.00 179.01 178.87 1fa0 h GLN 43 N 0.62 0.76 -0.48 2.33 5.75 -1.99 -1.54 115.11 120.55 1fa0 h GLN 43 Ca 0.37 -0.47 -0.02 0.00 -0.15 0.00 0.00 58.65 58.38 1fa0 h GLN 43 Cb 0.58 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 1fa0 h GLN 43 CO -0.14 1.09 0.21 0.93 -2.65 0.00 0.00 178.83 178.28 1fa0 h GLU 44 N 0.59 0.71 0.35 1.69 5.08 -1.64 -2.35 114.58 119.01 1fa0 h GLU 44 Ca 0.02 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1fa0 h GLU 44 Cb 1.11 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1fa0 h GLU 44 CO 0.11 0.61 -0.34 1.15 -1.00 0.00 0.00 179.01 179.54 1fa0 h THR 45 N 0.64 0.29 -1.05 1.13 2.02 -1.11 -1.73 112.91 113.10 1fa0 h THR 45 Ca 0.16 0.00 0.28 0.00 0.77 0.00 0.00 66.41 67.62 1fa0 h THR 45 Cb 0.15 0.29 -0.08 0.00 -1.74 0.00 0.00 68.15 66.78 1fa0 h THR 45 CO -0.02 0.00 0.70 0.00 0.37 0.00 0.00 175.52 176.57 1fa0 h ALA 46 N -0.24 2.47 -0.45 6.16 0.00 -1.12 0.11 119.26 126.19 1fa0 h ALA 46 Ca -0.02 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1fa0 h ALA 46 Cb 0.65 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1fa0 h ALA 46 CO -0.06 -0.84 -0.11 -0.91 0.00 0.00 0.00 179.25 177.33 1fa0 h ASN 47 N 0.28 0.88 0.02 0.00 2.35 -0.78 0.14 115.58 118.47 1fa0 h ASN 47 Ca 0.57 -0.36 0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1fa0 h ASN 47 Cb 1.66 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.78 1fa0 h ASN 47 CO -0.21 1.04 -0.05 0.03 -1.65 0.00 0.00 177.43 176.59 1fa0 h ARG 48 N 0.71 -0.10 -0.87 0.81 3.08 -0.36 -0.70 114.38 116.95 1fa0 h ARG 48 Ca 0.11 0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.32 1fa0 h ARG 48 Cb 0.66 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.64 1fa0 h ARG 48 CO 0.05 -0.07 0.47 0.28 -1.07 0.00 0.00 179.97 179.63 1fa0 h VAL 49 N -0.10 0.75 -0.58 2.04 2.07 -1.09 -1.22 116.25 118.11 1fa0 h VAL 49 Ca 0.02 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.21 1fa0 h VAL 49 Cb 0.12 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1fa0 h VAL 49 CO -0.04 0.12 -0.03 -0.61 0.02 0.00 0.00 177.57 177.03 1fa0 h GLN 50 N 0.67 1.05 -0.48 1.57 -0.00 -0.33 -2.13 115.11 115.46 1fa0 h GLN 50 Ca 0.47 -0.35 0.01 0.00 -0.00 0.00 0.00 58.65 58.78 1fa0 h GLN 50 Cb 0.65 -0.09 -0.03 0.00 0.00 0.00 0.00 27.48 28.02 1fa0 h GLN 50 CO -0.35 1.04 0.31 0.28 0.00 0.00 0.00 178.83 180.11 1fa0 h VAL 51 N 0.94 1.11 -0.79 2.39 2.07 -0.02 -2.35 116.25 119.60 1fa0 h VAL 51 Ca 0.16 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1fa0 h VAL 51 Cb 0.59 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1fa0 h VAL 51 CO 0.04 0.12 0.50 -0.07 0.02 0.00 0.00 177.57 178.17 1fa0 h LEU 52 N 0.63 0.92 -0.96 2.57 3.38 -1.11 0.82 115.31 121.55 1fa0 h LEU 52 Ca 0.18 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1fa0 h LEU 52 Cb -0.05 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1fa0 h LEU 52 CO -0.05 0.68 0.64 0.11 0.09 0.00 0.00 178.44 179.91 1fa0 h LYS 53 N 1.07 1.25 -0.09 1.13 1.79 -0.87 0.15 116.57 121.01 1fa0 h LYS 53 Ca 0.29 -0.08 -0.22 0.00 -2.18 0.00 0.00 60.65 58.47 1fa0 h LYS 53 Cb -0.09 -0.28 0.01 0.00 -1.58 0.00 0.00 32.23 30.28 1fa0 h LYS 53 CO -0.06 0.83 -0.82 0.82 -1.08 0.00 0.00 179.45 179.14 1fa0 h ILE 54 N 1.29 1.33 0.18 1.86 2.04 -1.01 -2.85 117.51 120.36 1fa0 h ILE 54 Ca 0.36 -2.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.08 1fa0 h ILE 54 Cb -0.12 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1fa0 h ILE 54 CO -0.09 0.66 -0.09 -0.07 0.00 0.00 0.00 178.15 178.56 1fa0 h LEU 55 N 0.39 -0.20 -0.54 1.44 3.38 -0.24 -1.23 115.31 118.31 1fa0 h LEU 55 Ca -0.06 -0.05 0.11 0.00 0.09 0.00 0.00 57.88 57.97 1fa0 h LEU 55 Cb 1.43 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 42.14 1fa0 h LEU 55 CO 0.15 -0.09 -0.05 -0.61 0.09 0.00 0.00 178.44 177.93 1fa0 h GLN 56 N -0.31 0.06 -0.51 1.13 5.75 -0.75 0.26 115.11 120.74 1fa0 h GLN 56 Ca -0.02 -0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.53 1fa0 h GLN 56 Cb 0.24 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.72 1fa0 h GLN 56 CO 0.04 0.04 0.21 0.93 -2.65 0.00 0.00 178.83 177.40 1fa0 h GLU 57 N 0.07 0.40 -0.69 1.69 5.08 -1.25 -0.38 114.58 119.50 1fa0 h GLU 57 Ca 0.27 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.57 1fa0 h GLU 57 Cb 0.42 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1fa0 h GLU 57 CO -0.50 0.26 0.30 -0.07 -1.00 0.00 0.00 179.01 178.00 1fa0 h LEU 58 N 0.41 0.93 -0.38 1.33 3.38 0.06 0.18 115.31 121.22 1fa0 h LEU 58 Ca 0.24 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1fa0 h LEU 58 Cb 0.23 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1fa0 h LEU 58 CO -0.22 0.83 0.20 0.00 0.09 0.00 0.00 178.44 179.34 1fa0 h ALA 59 N 1.14 0.47 0.27 1.53 0.00 0.22 0.43 119.26 123.32 1fa0 h ALA 59 Ca 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1fa0 h ALA 59 Cb 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1fa0 h ALA 59 CO -0.02 -0.15 -0.13 1.96 0.00 0.00 0.00 179.25 180.90 1fa0 h GLN 60 N 0.41 -0.35 -0.96 0.00 4.20 -0.69 -1.51 115.11 116.21 1fa0 h GLN 60 Ca 0.16 0.02 0.18 0.00 0.06 0.00 0.00 58.65 59.07 1fa0 h GLN 60 Cb 0.04 0.08 -0.09 0.00 0.30 0.00 0.00 27.48 27.82 1fa0 h GLN 60 CO -0.09 -0.13 0.61 0.00 -0.67 0.00 0.00 178.83 178.54 1fa0 h ARG 61 N -0.53 0.67 0.29 1.46 3.08 -0.39 0.20 114.38 119.17 1fa0 h ARG 61 Ca -0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1fa0 h ARG 61 Cb 0.39 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1fa0 h ARG 61 CO 0.06 0.44 -0.32 0.35 -1.07 0.00 0.00 179.97 179.44 1fa0 h PHE 62 N 0.69 -0.88 -0.62 3.04 3.57 0.38 0.08 116.94 123.20 1fa0 h PHE 62 Ca 0.51 0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.09 1fa0 h PHE 62 Cb 0.89 0.35 -0.06 0.00 2.79 0.00 0.00 35.95 39.91 1fa0 h PHE 62 CO -0.00 -0.41 0.31 0.28 -2.23 0.00 0.00 178.31 176.26 1fa0 h VAL 63 N -0.61 0.91 -0.19 1.41 2.07 -0.49 -2.23 116.25 117.12 1fa0 h VAL 63 Ca -0.04 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.34 1fa0 h VAL 63 Cb 0.54 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1fa0 h VAL 63 CO -0.05 0.10 -0.24 0.22 0.02 0.00 0.00 177.57 177.62 1fa0 h TYR 64 N 0.57 -0.65 -0.45 1.57 3.20 -0.38 0.44 116.97 121.28 1fa0 h TYR 64 Ca 0.29 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.20 1fa0 h TYR 64 Cb 0.24 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 1fa0 h TYR 64 CO -0.10 -0.32 0.29 0.93 -1.64 0.00 0.00 178.16 177.31 1fa0 h GLU 65 N -0.27 0.57 -0.57 1.82 5.08 -0.44 -1.93 114.58 118.84 1fa0 h GLU 65 Ca 0.12 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1fa0 h GLU 65 Cb 0.46 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1fa0 h GLU 65 CO -0.35 0.38 0.29 0.28 -1.00 0.00 0.00 179.01 178.61 1fa0 h VAL 66 N 0.59 1.20 -0.76 3.13 2.07 -1.02 -1.62 116.25 119.84 1fa0 h VAL 66 Ca 0.17 -0.54 0.11 0.00 0.82 0.00 0.00 66.70 67.25 1fa0 h VAL 66 Cb -0.05 0.51 -0.08 0.00 -1.52 0.00 0.00 31.29 30.15 1fa0 h VAL 66 CO -0.05 0.22 0.39 0.28 0.02 0.00 0.00 177.57 178.44 1fa0 h SER 67 N 0.77 0.51 -0.41 0.57 0.02 -0.50 0.32 113.55 114.83 1fa0 h SER 67 Ca 0.20 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.17 1fa0 h SER 67 Cb 0.09 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1fa0 h SER 67 CO -0.03 0.27 0.10 0.11 -1.14 0.00 0.00 176.83 176.14 1fa0 h LYS 68 N 0.63 0.67 -0.24 3.45 1.79 -0.92 -1.15 116.57 120.79 1fa0 h LYS 68 Ca 0.38 -0.16 0.06 0.00 -2.18 0.00 0.00 60.65 58.75 1fa0 h LYS 68 Cb 0.43 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1fa0 h LYS 68 CO -0.29 0.68 0.17 0.87 -1.08 0.00 0.00 179.45 179.80 1fa0 h LYS 69 N 0.53 0.03 -0.02 3.15 1.79 -0.25 1.29 116.57 123.10 1fa0 h LYS 69 Ca 0.13 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1fa0 h LYS 69 Cb 0.32 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1fa0 h LYS 69 CO 0.00 0.02 0.00 1.63 -1.08 0.00 0.00 179.45 180.02 1fa0 n LYS 70 N -4.47 1.09 -2.86 3.15 4.76 -0.02 -4.90 118.16 114.91 1fa0 n LYS 70 Ca 0.03 -0.14 -0.09 0.00 -2.87 0.00 0.00 58.31 55.24 1fa0 n LYS 70 Cb 0.29 -1.29 0.03 0.00 -1.84 0.00 0.00 35.03 32.23 1fa0 n LYS 70 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1fa0 n ASN 71 N -0.63 -3.41 -4.96 4.39 2.85 0.44 -5.06 115.26 108.88 1fa0 n ASN 71 Ca 0.13 -0.21 -0.23 0.00 -0.11 0.00 0.00 54.58 54.17 1fa0 n ASN 71 Cb 0.09 -2.20 -0.02 0.00 1.24 0.00 0.00 39.78 38.90 1fa0 n ASN 71 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1fa0 s MET 72 N -5.35 3.46 0.94 1.20 -1.94 -0.97 -5.02 119.30 111.62 1fa0 s MET 72 Ca 0.19 -0.62 -0.12 0.00 -1.71 0.00 0.00 55.69 53.43 1fa0 s MET 72 Cb -0.08 -2.85 0.16 0.00 2.01 0.00 0.00 34.83 34.07 1fa0 s MET 72 CO 0.27 0.38 1.09 -1.54 -0.01 0.00 0.00 175.02 175.21 1fa0 s SER 73 N -3.86 3.01 0.37 3.03 1.04 -1.26 -4.66 113.70 111.37 1fa0 s SER 73 Ca 0.36 1.59 0.07 0.00 0.48 0.00 0.00 55.95 58.44 1fa0 s SER 73 Cb -0.09 -2.24 0.73 0.00 0.10 0.00 0.00 66.02 64.51 1fa0 s SER 73 CO 0.30 -2.94 1.92 0.44 0.98 0.00 0.00 173.24 173.94 1fa0 h ASP 74 N -1.76 0.37 -0.12 7.02 3.32 -1.98 0.17 116.42 123.44 1fa0 h ASP 74 Ca -0.50 -0.06 -0.17 0.00 0.02 0.00 0.00 57.03 56.32 1fa0 h ASP 74 Cb 1.29 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 1fa0 h ASP 74 CO 0.52 0.45 -0.52 1.23 -1.72 0.00 0.00 179.24 179.20 1fa0 h GLY 75 N 0.73 0.76 1.39 2.75 0.00 -1.99 -0.90 103.07 105.82 1fa0 h GLY 75 Ca 0.09 -0.87 -0.25 0.00 0.00 0.00 0.00 47.33 46.30 1fa0 h GLY 75 CO 0.01 0.78 -1.00 1.98 0.00 0.00 0.00 176.54 178.31 1fa0 h MET 76 N 0.54 0.54 0.00 4.80 1.85 -1.83 -1.72 114.93 119.12 1fa0 h MET 76 Ca 0.02 -0.59 -0.02 0.00 -0.61 0.00 0.00 59.70 58.49 1fa0 h MET 76 Cb 1.09 0.17 -0.00 0.00 0.43 0.00 0.00 31.60 33.28 1fa0 h MET 76 CO 0.11 1.21 -0.12 0.00 -0.40 0.00 0.00 176.91 177.71 1fa0 h ALA 77 N 0.58 1.47 0.05 0.39 0.00 -0.57 -0.74 119.26 120.45 1fa0 h ALA 77 Ca -0.11 -0.11 -0.29 0.00 0.00 0.00 0.00 54.91 54.41 1fa0 h ALA 77 Cb 1.65 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1fa0 h ALA 77 CO 0.18 0.15 -1.52 -0.09 0.00 0.00 0.00 179.25 177.97 1fa0 h ARG 78 N 0.00 0.12 0.00 0.00 2.43 -1.06 -3.32 114.38 112.54 1fa0 h ARG 78 Ca -0.00 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 58.94 1fa0 h ARG 78 Cb 0.27 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1fa0 h ARG 78 CO 0.02 0.89 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.79 1fa0 h ASP 79 N 0.03 0.00 -0.09 -3.80 3.45 -0.40 -2.69 116.42 112.92 1fa0 h ASP 79 Ca -0.23 0.00 0.03 0.00 0.43 0.00 0.00 57.03 57.26 1fa0 h ASP 79 Cb 1.97 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.73 1fa0 h ASP 79 CO 0.12 0.13 0.10 0.00 -1.57 0.00 0.00 179.24 178.02 1fa0 h ALA 80 N 1.87 1.70 -0.48 3.45 0.00 -1.27 -3.39 119.26 121.13 1fa0 h ALA 80 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fa0 h ALA 80 Cb 0.78 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1fa0 h ALA 80 CO 0.02 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.53 1fa0 n GLY 81 N -1.38 1.88 0.00 0.00 0.00 -1.02 -1.26 105.19 103.42 1fa0 n GLY 81 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1fa0 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fa0 n GLY 82 N 0.00 3.61 3.00 -0.02 0.00 -0.64 -4.46 105.19 106.68 1fa0 n GLY 82 Ca 0.00 -0.83 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 1fa0 n GLY 82 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fa0 s LYS 83 N -4.29 0.35 0.03 1.61 2.20 -1.10 -4.34 119.74 114.20 1fa0 s LYS 83 Ca 0.00 -0.60 0.01 0.00 -0.36 0.00 0.00 55.97 55.02 1fa0 s LYS 83 Cb 0.00 -0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.26 1fa0 s LYS 83 CO 0.00 -0.01 0.08 0.42 -0.36 0.00 0.00 175.35 175.48 1fa0 s ILE 84 N -1.31 4.65 0.19 5.43 1.09 -1.26 -1.08 121.20 128.91 1fa0 s ILE 84 Ca -0.13 -0.57 -0.00 0.00 -1.10 0.00 0.00 60.65 58.85 1fa0 s ILE 84 Cb -0.09 -3.18 -0.04 0.00 -1.06 0.00 0.00 42.46 38.09 1fa0 s ILE 84 CO -0.01 0.25 0.10 -0.36 -0.10 0.00 0.00 174.94 174.82 1fa0 s PHE 85 N -1.28 1.16 0.04 3.97 0.40 0.13 -5.00 117.98 117.40 1fa0 s PHE 85 Ca 0.26 -1.28 0.02 0.00 -0.60 0.00 0.00 56.93 55.33 1fa0 s PHE 85 Cb -0.12 -0.61 -0.02 0.00 0.51 0.00 0.00 43.02 42.77 1fa0 s PHE 85 CO 0.18 -0.52 -0.07 0.95 0.70 0.00 0.00 175.22 176.45 1fa0 s THR 86 N -4.02 0.50 0.08 0.64 -4.23 -1.26 -1.38 115.64 105.97 1fa0 s THR 86 Ca 0.34 -1.01 0.01 0.00 -1.18 0.00 0.00 61.69 59.85 1fa0 s THR 86 Cb 0.07 -0.57 -0.00 0.00 1.34 0.00 0.00 72.50 73.34 1fa0 s THR 86 CO 0.09 -0.36 0.05 0.00 -0.54 0.00 0.00 174.62 173.86 1fa0 n TYR 87 N 1.57 -0.07 -4.19 3.99 0.18 -1.13 -4.70 117.16 112.81 1fa0 n TYR 87 Ca -0.22 -0.56 0.00 0.00 1.88 0.00 0.00 57.90 58.99 1fa0 n TYR 87 Cb 0.55 0.03 0.00 0.00 -0.38 0.00 0.00 39.34 39.54 1fa0 n TYR 87 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1fa0 n GLY 88 N 0.74 -1.64 0.20 -7.48 0.00 -1.26 -3.80 105.19 91.95 1fa0 n GLY 88 Ca 0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 46.02 44.69 1fa0 n GLY 88 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fa0 h SER 89 N 0.00 -0.38 0.03 1.61 4.64 -1.93 -2.77 113.55 114.75 1fa0 h SER 89 Ca 0.00 0.14 0.03 0.00 -0.47 0.00 0.00 61.79 61.49 1fa0 h SER 89 Cb 0.00 0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 62.33 1fa0 h SER 89 CO 0.00 -0.14 -0.30 0.22 -0.87 0.00 0.00 176.83 175.74 1fa0 h TYR 90 N 0.04 -0.82 -0.83 4.77 3.20 -1.81 -0.04 116.97 121.49 1fa0 h TYR 90 Ca 0.26 0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.30 1fa0 h TYR 90 Cb 0.39 0.36 -0.10 0.00 1.54 0.00 0.00 36.73 38.92 1fa0 h TYR 90 CO -0.39 -0.40 0.40 -0.09 -1.64 0.00 0.00 178.16 176.04 1fa0 h ARG 91 N -0.47 0.53 0.00 1.82 9.65 -1.59 0.15 114.38 124.47 1fa0 h ARG 91 Ca 0.05 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 1fa0 h ARG 91 Cb 0.54 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1fa0 h ARG 91 CO -0.23 0.35 0.00 -0.07 2.80 0.00 0.00 179.97 182.82 1fa0 h LEU 92 N 0.55 0.00 0.15 3.80 3.38 -1.11 -3.47 115.31 118.60 1fa0 h LEU 92 Ca 0.46 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.39 1fa0 h LEU 92 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1fa0 h LEU 92 CO -0.39 0.00 -0.05 0.61 0.09 0.00 0.00 178.44 178.69 1fa0 n GLY 93 N 0.42 0.34 0.48 0.83 0.00 0.54 -4.87 105.19 102.92 1fa0 n GLY 93 Ca 0.03 -0.78 0.06 0.00 0.00 0.00 0.00 46.02 45.32 1fa0 n GLY 93 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fa0 n VAL 94 N -3.87 1.28 -1.81 1.61 0.24 -0.89 -4.96 118.33 109.94 1fa0 n VAL 94 Ca -0.02 -1.80 -0.29 0.00 -2.04 0.00 0.00 64.34 60.18 1fa0 n VAL 94 Cb 0.52 0.09 0.12 0.00 -1.47 0.00 0.00 33.84 33.09 1fa0 n VAL 94 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 1fa0 s HIS 95 N -1.92 2.62 0.44 6.34 -3.43 -1.23 -4.92 115.29 113.18 1fa0 s HIS 95 Ca 0.26 0.71 0.03 0.00 -0.80 0.00 0.00 55.06 55.26 1fa0 s HIS 95 Cb 0.25 -3.56 -0.02 0.00 -1.43 0.00 0.00 32.58 27.81 1fa0 s HIS 95 CO -0.03 -2.07 0.09 0.20 -2.00 0.00 0.00 174.74 170.93 1fa0 s GLY 96 N -4.49 2.72 0.50 -1.38 0.00 -1.26 -4.68 107.32 98.73 1fa0 s GLY 96 Ca 0.64 -1.03 0.26 0.00 0.00 0.00 0.00 44.72 44.59 1fa0 s GLY 96 CO 0.51 -1.95 2.00 -0.56 0.00 0.00 0.00 173.10 173.10 1fa0 h PRO 97 N 1.66 0.00 0.15 2.90 0.13 -1.83 -2.86 132.00 132.16 1fa0 h PRO 97 Ca -0.38 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.44 1fa0 h PRO 97 Cb 1.28 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.42 1fa0 h PRO 97 CO 0.63 0.16 -1.47 0.78 -0.23 0.00 0.00 178.00 177.87 1fa0 h GLY 98 N 1.14 0.37 -3.15 1.56 0.00 -1.94 -3.47 103.07 97.59 1fa0 h GLY 98 Ca -0.00 -0.94 -0.57 0.00 0.00 0.00 0.00 47.33 45.82 1fa0 h GLY 98 CO 0.02 0.83 0.27 -1.14 0.00 0.00 0.00 176.54 176.51 1fa0 n SER 99 N -3.53 1.49 -2.30 0.19 3.41 -1.08 -4.89 113.62 106.91 1fa0 n SER 99 Ca -0.15 0.94 -0.03 0.00 -0.26 0.00 0.00 58.87 59.37 1fa0 n SER 99 Cb 1.05 -1.43 0.02 0.00 -0.26 0.00 0.00 64.21 63.59 1fa0 n SER 99 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1fa0 n ASP 100 N -0.28 0.13 -4.00 4.04 3.85 -1.26 -4.76 116.55 114.26 1fa0 n ASP 100 Ca 0.11 -1.12 -0.31 0.00 -0.71 0.00 0.00 54.79 52.76 1fa0 n ASP 100 Cb 0.43 -0.09 -0.15 0.00 -1.35 0.00 0.00 41.12 39.96 1fa0 n ASP 100 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1fa0 s ILE 101 N -0.50 1.92 -0.12 2.12 1.01 0.24 -4.58 121.20 121.28 1fa0 s ILE 101 Ca 0.09 -1.59 -0.29 0.00 0.00 0.00 0.00 60.65 58.85 1fa0 s ILE 101 Cb -0.00 -2.15 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 1fa0 s ILE 101 CO 0.06 -0.17 0.98 -1.81 0.00 0.00 0.00 174.94 174.00 1fa0 s ASP 102 N 1.19 7.19 -0.08 3.58 1.11 -1.26 -1.48 116.67 126.93 1fa0 s ASP 102 Ca -0.04 1.47 0.03 0.00 0.18 0.00 0.00 52.55 54.19 1fa0 s ASP 102 Cb -0.19 -2.54 0.01 0.00 1.07 0.00 0.00 42.92 41.26 1fa0 s ASP 102 CO -0.07 -0.45 -0.17 -0.89 1.18 0.00 0.00 175.17 174.77 1fa0 s THR 103 N 2.10 1.53 -0.23 -1.27 2.01 0.50 -2.83 115.64 117.46 1fa0 s THR 103 Ca 0.47 -0.72 -0.08 0.00 0.31 0.00 0.00 61.69 61.66 1fa0 s THR 103 Cb -0.18 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 1fa0 s THR 103 CO 0.16 0.44 0.10 -0.22 -0.69 0.00 0.00 174.62 174.42 1fa0 s LEU 104 N 0.45 3.76 -0.21 4.42 2.96 -0.48 -0.58 118.68 129.00 1fa0 s LEU 104 Ca -0.15 -0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.65 1fa0 s LEU 104 Cb -0.16 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1fa0 s LEU 104 CO 0.06 0.04 0.06 -0.69 -1.32 0.00 0.00 176.35 174.50 1fa0 s VAL 105 N 1.21 4.54 -0.19 1.68 1.01 0.09 -0.69 120.40 128.05 1fa0 s VAL 105 Ca 0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.90 1fa0 s VAL 105 Cb -0.14 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 1fa0 s VAL 105 CO 0.04 0.40 -0.07 -0.69 0.00 0.00 0.00 175.10 174.78 1fa0 s VAL 106 N 0.97 3.25 0.14 2.92 1.01 -0.24 -0.74 120.40 127.70 1fa0 s VAL 106 Ca 0.04 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.54 1fa0 s VAL 106 Cb -0.14 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1fa0 s VAL 106 CO 0.03 0.46 -0.17 0.68 0.00 0.00 0.00 175.10 176.10 1fa0 s VAL 107 N 1.13 1.58 0.77 2.92 -7.23 -0.74 -2.70 120.40 116.13 1fa0 s VAL 107 Ca 0.01 -1.76 -0.12 0.00 -1.81 0.00 0.00 61.98 58.30 1fa0 s VAL 107 Cb -0.15 -1.65 0.06 0.00 0.56 0.00 0.00 36.38 35.21 1fa0 s VAL 107 CO -0.01 -0.32 1.13 -2.16 -0.31 0.00 0.00 175.10 173.43 1fa0 s PRO 108 N -2.58 2.05 0.21 4.82 0.04 -1.26 -2.29 135.00 135.99 1fa0 s PRO 108 Ca 0.11 1.44 -0.00 0.00 0.04 0.00 0.00 61.00 62.59 1fa0 s PRO 108 Cb -0.06 -1.85 0.48 0.00 0.04 0.00 0.00 34.50 33.11 1fa0 s PRO 108 CO 0.05 -1.84 1.10 1.17 0.04 0.00 0.00 177.00 177.52 1fa0 n LYS 109 N -3.28 -0.06 0.00 4.56 0.00 -0.85 0.36 118.16 118.89 1fa0 n LYS 109 Ca 0.11 1.07 0.11 0.00 0.00 0.00 0.00 58.31 59.60 1fa0 n LYS 109 Cb 0.52 -1.67 0.68 0.00 0.00 0.00 0.00 35.03 34.56 1fa0 n LYS 109 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1fa0 n HIS 110 N -5.01 0.00 -3.61 5.64 1.44 -1.26 -4.61 115.22 107.82 1fa0 n HIS 110 Ca 0.15 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.47 1fa0 n HIS 110 Cb 0.49 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.49 1fa0 n HIS 110 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1fa0 s VAL 111 N -2.00 4.96 0.64 0.61 1.01 0.16 -4.95 120.40 120.83 1fa0 s VAL 111 Ca 0.34 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.17 1fa0 s VAL 111 Cb 0.16 -3.48 0.10 0.00 0.00 0.00 0.00 36.38 33.16 1fa0 s VAL 111 CO 0.27 0.11 0.89 0.42 0.00 0.00 0.00 175.10 176.78 1fa0 s THR 112 N 1.68 2.18 0.17 3.92 -4.23 -1.26 -4.83 115.64 113.27 1fa0 s THR 112 Ca 0.06 -0.79 -0.12 0.00 -1.18 0.00 0.00 61.69 59.66 1fa0 s THR 112 Cb -0.17 -2.38 0.06 0.00 1.34 0.00 0.00 72.50 71.35 1fa0 s THR 112 CO 0.08 0.00 1.69 -0.09 -0.54 0.00 0.00 174.62 175.76 1fa0 h ARG 113 N -0.16 0.91 -0.07 3.99 9.65 -1.98 -2.44 114.38 124.27 1fa0 h ARG 113 Ca -0.34 -0.21 -0.03 0.00 -1.10 0.00 0.00 59.98 58.31 1fa0 h ARG 113 Cb 1.28 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.72 1fa0 h ARG 113 CO 0.41 0.83 -0.10 0.93 2.80 0.00 0.00 179.97 184.83 1fa0 h GLU 114 N 0.82 0.11 -0.13 0.20 3.07 -1.98 -0.57 114.58 116.11 1fa0 h GLU 114 Ca 0.18 -0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 58.89 1fa0 h GLU 114 Cb 0.31 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1fa0 h GLU 114 CO -0.00 0.22 -0.51 -0.44 -1.40 0.00 0.00 179.01 176.88 1fa0 h ASP 115 N 0.11 0.39 -0.34 1.42 3.45 -1.83 -2.76 116.42 116.86 1fa0 h ASP 115 Ca 0.02 -0.20 -0.04 0.00 0.43 0.00 0.00 57.03 57.25 1fa0 h ASP 115 Cb 0.25 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.90 1fa0 h ASP 115 CO 0.02 0.83 0.05 0.15 -1.57 0.00 0.00 179.24 178.72 1fa0 h PHE 116 N 0.28 0.60 -0.29 4.55 3.57 -0.76 0.36 116.94 125.26 1fa0 h PHE 116 Ca 0.01 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.42 1fa0 h PHE 116 Cb 0.99 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1fa0 h PHE 116 CO 0.03 0.64 0.00 1.19 -2.23 0.00 0.00 178.31 177.94 1fa0 n PHE 117 N -4.58 0.46 0.05 0.41 3.01 -0.91 -3.11 117.46 112.79 1fa0 n PHE 117 Ca -0.02 -0.21 0.00 0.00 1.01 0.00 0.00 57.45 58.23 1fa0 n PHE 117 Cb 0.23 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 1fa0 n PHE 117 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1fa0 n THR 118 N 0.36 0.65 -0.02 4.37 -1.04 -1.04 -4.64 114.28 112.91 1fa0 n THR 118 Ca 0.10 0.22 -0.16 0.00 -2.04 0.00 0.00 64.05 62.17 1fa0 n THR 118 Cb 0.30 -1.16 -0.12 0.00 -1.82 0.00 0.00 70.33 67.53 1fa0 n THR 118 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1fa0 h VAL 119 N 0.00 1.59 -0.65 12.58 2.07 -0.49 -2.74 116.25 128.61 1fa0 h VAL 119 Ca 0.00 -2.10 -0.05 0.00 0.82 0.00 0.00 66.70 65.37 1fa0 h VAL 119 Cb 0.00 2.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 1fa0 h VAL 119 CO 0.00 0.57 0.21 0.15 0.02 0.00 0.00 177.57 178.52 1fa0 h PHE 120 N -0.59 1.02 -0.07 1.57 3.57 -1.57 -1.94 116.94 118.92 1fa0 h PHE 120 Ca -0.04 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.40 1fa0 h PHE 120 Cb 1.09 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 1fa0 h PHE 120 CO 0.20 0.81 -0.08 0.22 -2.23 0.00 0.00 178.31 177.23 1fa0 h ASP 121 N 0.96 -0.26 -0.42 0.41 3.58 -1.62 -2.46 116.42 116.62 1fa0 h ASP 121 Ca 0.21 0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.72 1fa0 h ASP 121 Cb 0.27 0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 1fa0 h ASP 121 CO -0.01 -0.12 0.27 -1.28 -2.88 0.00 0.00 179.24 175.22 1fa0 h SER 122 N -0.12 0.46 -0.75 2.28 0.87 -1.18 -2.09 113.55 113.02 1fa0 h SER 122 Ca 0.06 -0.01 0.09 0.00 -1.23 0.00 0.00 61.79 60.70 1fa0 h SER 122 Cb 0.20 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.99 1fa0 h SER 122 CO -0.14 0.33 0.50 -0.07 -0.53 0.00 0.00 176.83 176.92 1fa0 h LEU 123 N 0.55 0.61 -0.16 2.23 3.38 -1.12 -1.46 115.31 119.34 1fa0 h LEU 123 Ca 0.16 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.93 1fa0 h LEU 123 Cb -0.05 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.60 1fa0 h LEU 123 CO -0.04 0.37 -0.74 -0.07 0.09 0.00 0.00 178.44 178.05 1fa0 h LEU 124 N 0.68 0.93 -1.36 1.67 3.38 -1.13 -3.16 115.31 116.32 1fa0 h LEU 124 Ca 0.34 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1fa0 h LEU 124 Cb 0.44 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1fa0 h LEU 124 CO -0.13 1.40 0.36 0.03 0.09 0.00 0.00 178.44 180.19 1fa0 h ARG 125 N 0.52 0.79 -0.69 1.13 2.47 -0.65 -2.32 114.38 115.64 1fa0 h ARG 125 Ca -0.05 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1fa0 h ARG 125 Cb 1.37 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1fa0 h ARG 125 CO 0.15 0.55 0.00 0.39 0.56 0.00 0.00 179.97 181.63 1fa0 n GLU 126 N -4.42 0.77 -4.74 0.04 1.02 -0.63 -4.77 120.64 107.90 1fa0 n GLU 126 Ca 0.06 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.89 1fa0 n GLU 126 Cb 0.07 -1.35 -0.14 0.00 -0.02 0.00 0.00 31.44 30.01 1fa0 n GLU 126 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1fa0 s ARG 127 N -1.10 1.90 0.05 3.49 0.52 -0.87 -5.03 118.95 117.92 1fa0 s ARG 127 Ca 0.00 -1.07 -0.19 0.00 -0.52 0.00 0.00 55.73 53.95 1fa0 s ARG 127 Cb 0.00 -2.08 -0.13 0.00 0.52 0.00 0.00 34.95 33.26 1fa0 s ARG 127 CO 0.00 0.52 1.38 0.87 0.02 0.00 0.00 175.30 178.09 1fa0 h LYS 128 N 4.58 0.41 0.00 3.54 1.57 -1.88 -3.02 116.57 121.77 1fa0 h LYS 128 Ca -0.47 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 1fa0 h LYS 128 Cb 1.15 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1fa0 h LYS 128 CO 0.45 0.75 0.09 0.39 -0.57 0.00 0.00 179.45 180.56 1fa0 n GLU 129 N -4.54 0.00 -2.71 3.15 4.71 -1.26 -4.51 120.64 115.49 1fa0 n GLU 129 Ca -0.05 0.35 -0.43 0.00 -0.01 0.00 0.00 57.16 57.02 1fa0 n GLU 129 Cb 0.35 -1.59 -0.03 0.00 -1.01 0.00 0.00 31.44 29.17 1fa0 n GLU 129 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1fa0 s LEU 130 N -2.68 3.94 -0.17 -4.62 1.98 -1.14 0.58 118.68 116.57 1fa0 s LEU 130 Ca 0.00 0.86 -0.14 0.00 -2.89 0.00 0.00 54.13 51.97 1fa0 s LEU 130 Cb 0.00 -3.43 -0.06 0.00 0.66 0.00 0.00 46.19 43.36 1fa0 s LEU 130 CO 0.00 -0.87 -0.21 0.47 -1.89 0.00 0.00 176.35 173.85 1fa0 n ASP 131 N 6.84 1.87 -3.92 3.68 10.43 -0.08 -4.96 116.55 130.40 1fa0 n ASP 131 Ca 0.10 0.50 -0.10 0.00 2.57 0.00 0.00 54.79 57.85 1fa0 n ASP 131 Cb 0.48 -0.84 -0.12 0.00 1.84 0.00 0.00 41.12 42.48 1fa0 n ASP 131 CO 0.00 0.00 0.00 -1.83 -1.07 0.00 0.00 177.20 174.30 1fa0 s GLU 132 N -2.49 0.22 -0.01 -1.24 -1.05 -1.16 -4.96 118.70 108.00 1fa0 s GLU 132 Ca -0.22 -0.34 0.00 0.00 -0.15 0.00 0.00 54.97 54.26 1fa0 s GLU 132 Cb 0.04 0.08 0.02 0.00 -0.44 0.00 0.00 34.13 33.83 1fa0 s GLU 132 CO 0.34 -0.04 0.01 -1.50 0.95 0.00 0.00 175.26 175.02 1fa0 s ILE 133 N -0.88 0.03 -0.35 1.83 2.07 -1.26 -0.01 121.20 122.64 1fa0 s ILE 133 Ca -0.10 0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.23 1fa0 s ILE 133 Cb -0.06 -0.10 0.12 0.00 0.13 0.00 0.00 42.46 42.55 1fa0 s ILE 133 CO -0.00 0.07 0.17 0.00 -1.91 0.00 0.00 174.94 173.27 1fa0 s ALA 134 N 0.61 1.30 0.61 1.50 0.00 0.18 -4.99 121.76 120.97 1fa0 s ALA 134 Ca -0.05 -1.81 -0.18 0.00 0.00 0.00 0.00 51.96 49.91 1fa0 s ALA 134 Cb -0.08 -1.63 -0.03 0.00 0.00 0.00 0.00 23.12 21.39 1fa0 s ALA 134 CO -0.02 -1.89 1.23 -2.14 0.00 0.00 0.00 175.76 172.95 1fa0 s PRO 135 N 1.27 2.83 -0.40 0.00 0.02 -1.26 -2.08 135.00 135.38 1fa0 s PRO 135 Ca 0.14 1.89 0.10 0.00 0.02 0.00 0.00 61.00 63.15 1fa0 s PRO 135 Cb -0.20 -1.90 0.33 0.00 0.02 0.00 0.00 34.50 32.75 1fa0 s PRO 135 CO -0.14 -1.33 0.84 0.28 -0.33 0.00 0.00 177.00 176.31 1fa0 n VAL 136 N -1.71 -0.14 -0.05 3.83 0.31 0.54 -4.91 118.33 116.20 1fa0 n VAL 136 Ca 0.14 -3.58 -0.01 0.00 -0.01 0.00 0.00 64.34 60.88 1fa0 n VAL 136 Cb 0.49 0.21 -0.01 0.00 -0.91 0.00 0.00 33.84 33.62 1fa0 n VAL 136 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1fa0 n PRO 137 N 0.40 -0.05 -2.61 5.55 -0.02 -1.26 -2.95 135.00 134.05 1fa0 n PRO 137 Ca 0.19 0.99 -0.41 0.00 -2.02 0.00 0.00 63.50 62.24 1fa0 n PRO 137 Cb 0.66 -1.47 -0.03 0.00 -0.02 0.00 0.00 33.50 32.64 1fa0 n PRO 137 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fa0 s ASP 138 N -3.31 6.21 0.21 2.55 -0.00 -1.26 -3.98 116.67 117.10 1fa0 s ASP 138 Ca -0.01 -0.70 -0.11 0.00 -0.00 0.00 0.00 52.55 51.73 1fa0 s ASP 138 Cb 0.01 -2.53 -0.01 0.00 -0.00 0.00 0.00 42.92 40.39 1fa0 s ASP 138 CO 0.07 -1.72 0.39 0.00 -0.00 0.00 0.00 175.17 173.91 1fa0 s ALA 139 N 5.29 -0.12 0.29 5.23 0.00 -1.25 -5.00 121.76 126.20 1fa0 s ALA 139 Ca 0.34 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.49 1fa0 s ALA 139 Cb -0.09 1.00 0.83 0.00 0.00 0.00 0.00 23.12 24.86 1fa0 s ALA 139 CO 0.11 -0.75 1.42 0.34 0.00 0.00 0.00 175.76 176.87 1fa0 n PHE 140 N -0.31 0.70 -3.65 0.00 -0.00 -1.26 -3.67 117.46 109.27 1fa0 n PHE 140 Ca -0.04 1.08 -0.18 0.00 -0.00 0.00 0.00 57.45 58.31 1fa0 n PHE 140 Cb 0.63 -1.25 -0.16 0.00 -0.00 0.00 0.00 39.48 38.70 1fa0 n PHE 140 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1fa0 s VAL 141 N -5.74 -0.24 0.35 -2.13 0.11 -1.26 -4.91 120.40 106.57 1fa0 s VAL 141 Ca -0.11 0.31 -0.20 0.00 -2.93 0.00 0.00 61.98 59.05 1fa0 s VAL 141 Cb 0.28 -0.32 -0.15 0.00 -1.53 0.00 0.00 36.38 34.66 1fa0 s VAL 141 CO 0.70 0.11 0.13 -2.65 -3.33 0.00 0.00 175.10 170.06 1fa0 n PRO 142 N 5.32 0.00 -3.48 1.54 -0.02 -1.24 -4.98 135.00 132.14 1fa0 n PRO 142 Ca -0.05 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.29 1fa0 n PRO 142 Cb 0.50 -0.92 -0.04 0.00 -0.02 0.00 0.00 33.50 33.02 1fa0 n PRO 142 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1fa0 s ILE 143 N -1.47 0.00 -0.29 4.25 2.07 -1.15 -4.49 121.20 120.12 1fa0 s ILE 143 Ca 0.55 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.79 1fa0 s ILE 143 Cb -0.62 -1.00 0.09 0.00 0.13 0.00 0.00 42.46 41.06 1fa0 s ILE 143 CO 0.57 0.00 0.06 -0.63 -1.91 0.00 0.00 174.94 173.03 1fa0 s ILE 144 N -2.40 1.15 0.01 2.00 1.01 -0.76 -0.34 121.20 121.87 1fa0 s ILE 144 Ca -0.05 -1.40 -0.25 0.00 0.00 0.00 0.00 60.65 58.95 1fa0 s ILE 144 Cb -0.00 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 1fa0 s ILE 144 CO -0.01 -0.50 0.78 -0.54 0.00 0.00 0.00 174.94 174.67 1fa0 s LYS 145 N 1.50 4.49 0.08 2.79 1.02 -0.88 -2.67 119.74 126.07 1fa0 s LYS 145 Ca 0.06 1.07 -0.12 0.00 0.02 0.00 0.00 55.97 57.00 1fa0 s LYS 145 Cb -0.18 -3.40 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 1fa0 s LYS 145 CO -0.17 0.17 0.28 0.96 -0.92 0.00 0.00 175.35 175.66 1fa0 s ILE 146 N 0.36 0.11 -0.26 2.17 -4.36 -0.83 0.49 121.20 118.86 1fa0 s ILE 146 Ca 0.40 -0.87 -0.02 0.00 -0.26 0.00 0.00 60.65 59.90 1fa0 s ILE 146 Cb -0.20 -1.16 0.03 0.00 1.25 0.00 0.00 42.46 42.38 1fa0 s ILE 146 CO 0.22 -0.48 -0.03 -0.75 0.24 0.00 0.00 174.94 174.15 1fa0 s LYS 147 N -3.40 2.80 -0.20 0.37 2.20 0.99 -0.21 119.74 122.28 1fa0 s LYS 147 Ca 0.01 -1.01 -0.02 0.00 -0.36 0.00 0.00 55.97 54.59 1fa0 s LYS 147 Cb 0.02 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 1fa0 s LYS 147 CO -0.09 -0.45 -0.10 0.12 -0.36 0.00 0.00 175.35 174.47 1fa0 s PHE 148 N 1.34 2.89 -1.58 4.03 5.36 0.64 -0.90 117.98 129.75 1fa0 s PHE 148 Ca -0.00 -1.18 -0.09 0.00 -0.96 0.00 0.00 56.93 54.70 1fa0 s PHE 148 Cb -0.17 -2.03 0.08 0.00 -0.34 0.00 0.00 43.02 40.55 1fa0 s PHE 148 CO -0.03 -0.63 0.47 0.43 -1.46 0.00 0.00 175.22 174.00 1fa0 n SER 149 N 4.69 -1.18 0.00 6.13 7.64 0.20 -1.29 113.62 129.81 1fa0 n SER 149 Ca -0.19 -1.09 0.00 0.00 1.01 0.00 0.00 58.87 58.60 1fa0 n SER 149 Cb 0.51 -2.50 0.00 0.00 -1.01 0.00 0.00 64.21 61.20 1fa0 n SER 149 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fa0 n GLY 150 N -1.83 2.26 3.75 0.23 0.00 -1.26 -5.00 105.19 103.33 1fa0 n GLY 150 Ca -0.15 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1fa0 n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fa0 s ILE 151 N -0.14 3.34 -0.03 -0.61 1.09 -0.42 -4.98 121.20 119.45 1fa0 s ILE 151 Ca 0.00 1.18 -0.27 0.00 -1.10 0.00 0.00 60.65 60.45 1fa0 s ILE 151 Cb 0.00 -3.75 -0.03 0.00 -1.06 0.00 0.00 42.46 37.62 1fa0 s ILE 151 CO 0.00 0.21 0.87 -0.44 -0.10 0.00 0.00 174.94 175.48 1fa0 s SER 152 N -0.07 7.21 -0.13 3.58 0.01 -1.26 -0.26 113.70 122.79 1fa0 s SER 152 Ca 0.52 1.46 0.00 0.00 1.31 0.00 0.00 55.95 59.24 1fa0 s SER 152 Cb -0.35 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.40 1fa0 s SER 152 CO 0.40 -0.21 -0.11 -0.63 0.41 0.00 0.00 173.24 173.11 1fa0 s ILE 153 N 0.95 1.28 -0.22 1.44 -1.09 0.70 -0.60 121.20 123.67 1fa0 s ILE 153 Ca 0.46 -0.45 -0.18 0.00 -2.23 0.00 0.00 60.65 58.25 1fa0 s ILE 153 Cb -0.20 -1.25 -0.03 0.00 -1.58 0.00 0.00 42.46 39.41 1fa0 s ILE 153 CO 0.24 0.41 0.50 -1.81 -1.23 0.00 0.00 174.94 173.05 1fa0 s ASP 154 N 1.57 6.50 -0.22 3.58 1.01 -0.55 -1.97 116.67 126.59 1fa0 s ASP 154 Ca 0.04 0.60 0.02 0.00 0.71 0.00 0.00 52.55 53.93 1fa0 s ASP 154 Cb -0.13 -2.28 0.05 0.00 1.01 0.00 0.00 42.92 41.57 1fa0 s ASP 154 CO -0.09 -0.20 -0.13 -0.76 0.21 0.00 0.00 175.17 174.20 1fa0 s LEU 155 N 1.81 2.80 0.23 1.23 1.02 -1.09 0.19 118.68 124.86 1fa0 s LEU 155 Ca 0.22 -1.08 0.09 0.00 0.02 0.00 0.00 54.13 53.38 1fa0 s LEU 155 Cb -0.15 -1.43 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 1fa0 s LEU 155 CO 0.09 -0.14 -0.01 0.27 0.02 0.00 0.00 176.35 176.59 1fa0 s ILE 156 N 1.24 3.53 -0.12 -0.59 -4.36 0.25 -1.84 121.20 119.32 1fa0 s ILE 156 Ca -0.04 -1.72 0.03 0.00 -0.26 0.00 0.00 60.65 58.66 1fa0 s ILE 156 Cb -0.17 -2.84 0.01 0.00 1.25 0.00 0.00 42.46 40.71 1fa0 s ILE 156 CO -0.08 -0.26 -0.20 0.00 0.24 0.00 0.00 174.94 174.64 1fa0 s ALA 158 N 0.72 2.61 -0.33 0.00 0.00 0.08 -4.86 121.76 119.98 1fa0 s ALA 158 Ca -0.11 -0.92 -0.09 0.00 0.00 0.00 0.00 51.96 50.85 1fa0 s ALA 158 Cb -0.16 -1.23 0.01 0.00 0.00 0.00 0.00 23.12 21.74 1fa0 s ALA 158 CO 0.01 0.19 0.15 0.50 0.00 0.00 0.00 175.76 176.61 1fa0 s ARG 159 N 0.45 3.02 0.36 0.00 3.52 -1.26 -1.78 118.95 123.25 1fa0 s ARG 159 Ca -0.10 -0.93 -0.06 0.00 -0.13 0.00 0.00 55.73 54.51 1fa0 s ARG 159 Cb -0.16 -3.56 -0.05 0.00 -1.56 0.00 0.00 34.95 29.62 1fa0 s ARG 159 CO 0.05 -0.55 0.66 -0.51 -0.81 0.00 0.00 175.30 174.14 1fa0 s LEU 160 N 1.54 3.91 -0.60 -0.88 1.43 -0.97 -4.92 118.68 118.19 1fa0 s LEU 160 Ca 0.02 0.87 -0.05 0.00 -1.03 0.00 0.00 54.13 53.94 1fa0 s LEU 160 Cb -0.18 -3.73 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 1fa0 s LEU 160 CO 0.05 -0.33 2.96 -0.67 0.23 0.00 0.00 176.35 178.58 1fa0 n ASP 161 N -1.34 6.64 -3.83 2.29 2.03 -1.26 -2.58 116.55 118.49 1fa0 n ASP 161 Ca -0.00 -2.94 -0.11 0.00 0.52 0.00 0.00 54.79 52.26 1fa0 n ASP 161 Cb 0.54 -1.34 -0.08 0.00 -0.72 0.00 0.00 41.12 39.52 1fa0 n ASP 161 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fa0 s GLN 162 N -0.50 0.69 0.54 -0.67 -2.07 -1.26 -5.00 119.66 111.38 1fa0 s GLN 162 Ca 0.61 -0.58 0.32 0.00 -1.82 0.00 0.00 55.36 53.90 1fa0 s GLN 162 Cb 0.31 0.29 1.24 0.00 -1.09 0.00 0.00 33.01 33.76 1fa0 s GLN 162 CO -0.12 -0.20 1.94 -1.00 -1.32 0.00 0.00 175.29 174.58 1fa0 h PRO 163 N 3.51 0.00 -4.45 9.60 0.13 -1.96 -2.26 132.00 136.56 1fa0 h PRO 163 Ca -0.32 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.64 1fa0 h PRO 163 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.17 1fa0 h PRO 163 CO 0.47 0.00 -0.69 -0.65 -0.23 0.00 0.00 178.00 176.90 1fa0 s GLN 164 N -3.61 0.72 -0.38 0.86 -0.21 -1.26 -4.69 119.66 111.08 1fa0 s GLN 164 Ca 0.02 -1.26 0.01 0.00 0.02 0.00 0.00 55.36 54.15 1fa0 s GLN 164 Cb 0.08 -0.01 0.15 0.00 1.00 0.00 0.00 33.01 34.24 1fa0 s GLN 164 CO 0.56 -0.06 0.25 0.08 -2.12 0.00 0.00 175.29 174.00 1fa0 s VAL 165 N -3.69 0.38 0.80 1.09 1.01 -0.39 -4.86 120.40 114.74 1fa0 s VAL 165 Ca 0.09 -2.10 -0.11 0.00 0.00 0.00 0.00 61.98 59.86 1fa0 s VAL 165 Cb 0.06 -1.28 0.07 0.00 0.00 0.00 0.00 36.38 35.23 1fa0 s VAL 165 CO -0.07 -1.05 1.09 -2.16 0.00 0.00 0.00 175.10 172.91 1fa0 s PRO 166 N 0.68 2.03 0.59 2.72 0.04 -1.26 -1.62 135.00 138.17 1fa0 s PRO 166 Ca 0.22 0.84 0.35 0.00 0.04 0.00 0.00 61.00 62.45 1fa0 s PRO 166 Cb -0.16 -1.90 1.87 0.00 0.04 0.00 0.00 34.50 34.36 1fa0 s PRO 166 CO -0.05 -1.71 2.20 -0.07 0.04 0.00 0.00 177.00 177.41 1fa0 h LEU 167 N -1.16 0.00 0.00 -3.56 3.38 -1.97 -2.26 115.31 109.74 1fa0 h LEU 167 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1fa0 h LEU 167 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1fa0 h LEU 167 CO 0.56 0.04 -0.06 -1.54 0.09 0.00 0.00 178.44 177.53 1fa0 n SER 168 N -3.39 0.14 -4.70 -0.43 3.41 -1.26 -4.91 113.62 102.48 1fa0 n SER 168 Ca -0.02 0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 58.58 1fa0 n SER 168 Cb 0.16 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 1fa0 n SER 168 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1fa0 n LEU 169 N -1.58 3.54 -4.48 1.04 7.94 -0.85 -5.02 117.00 117.60 1fa0 n LEU 169 Ca 0.07 1.16 -0.23 0.00 -1.11 0.00 0.00 56.01 55.89 1fa0 n LEU 169 Cb 0.35 -1.48 -0.10 0.00 0.53 0.00 0.00 43.42 42.71 1fa0 n LEU 169 CO 0.28 -0.31 -0.39 0.42 -1.11 0.00 0.00 177.39 176.29 1fa0 s THR 170 N -0.23 1.98 -1.19 1.96 -4.23 -1.26 -5.05 115.64 107.61 1fa0 s THR 170 Ca 0.65 -2.19 0.17 0.00 -1.18 0.00 0.00 61.69 59.14 1fa0 s THR 170 Cb -0.59 -2.50 0.58 0.00 1.34 0.00 0.00 72.50 71.33 1fa0 s THR 170 CO 0.52 -0.28 1.49 0.18 -0.54 0.00 0.00 174.62 175.99 1fa0 n LEU 171 N -0.67 4.02 0.33 4.79 4.77 -1.26 -4.68 117.00 124.30 1fa0 n LEU 171 Ca -0.05 -2.28 -0.17 0.00 -0.03 0.00 0.00 56.01 53.47 1fa0 n LEU 171 Cb 0.63 -0.47 -0.09 0.00 -2.33 0.00 0.00 43.42 41.17 1fa0 n LEU 171 CO 0.41 0.83 0.68 0.28 -1.33 0.00 0.00 177.39 178.25 1fa0 h SER 172 N 3.40 -0.67 -1.90 -1.43 0.02 -1.97 -3.44 113.55 107.57 1fa0 h SER 172 Ca 0.00 0.02 -0.65 0.00 -0.84 0.00 0.00 61.79 60.32 1fa0 h SER 172 Cb 1.16 0.17 0.02 0.00 0.14 0.00 0.00 62.40 63.89 1fa0 h SER 172 CO 0.12 -0.47 1.05 -0.67 -1.14 0.00 0.00 176.83 175.71 1fa0 n ASP 173 N -5.43 3.17 0.00 3.07 4.64 -1.26 -4.82 116.55 115.92 1fa0 n ASP 173 Ca -0.13 1.00 0.05 0.00 -1.38 0.00 0.00 54.79 54.33 1fa0 n ASP 173 Cb 0.32 -1.31 0.26 0.00 -1.04 0.00 0.00 41.12 39.36 1fa0 n ASP 173 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67 1fa0 n LYS 174 N 6.32 0.19 0.02 -0.67 2.85 -1.26 -1.81 118.16 123.80 1fa0 n LYS 174 Ca 0.24 0.13 0.14 0.00 -1.05 0.00 0.00 58.31 57.77 1fa0 n LYS 174 Cb 0.25 -1.50 0.54 0.00 -0.65 0.00 0.00 35.03 33.67 1fa0 n LYS 174 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1fa0 n ASN 175 N -1.20 0.18 0.11 -5.58 3.02 -1.26 -2.39 115.26 108.14 1fa0 n ASN 175 Ca 0.06 0.42 0.11 0.00 -0.03 0.00 0.00 54.58 55.14 1fa0 n ASN 175 Cb 0.06 -0.44 0.46 0.00 -0.61 0.00 0.00 39.78 39.25 1fa0 n ASN 175 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1fa0 n LEU 176 N -1.62 0.56 0.17 3.41 4.77 -0.75 -2.28 117.00 121.26 1fa0 n LEU 176 Ca 0.07 0.64 0.13 0.00 -0.03 0.00 0.00 56.01 56.81 1fa0 n LEU 176 Cb 0.35 -0.57 0.29 0.00 -2.33 0.00 0.00 43.42 41.16 1fa0 n LEU 176 CO 0.29 -0.52 0.85 -0.07 -1.33 0.00 0.00 177.39 176.60 1fa0 h LEU 177 N 0.00 0.00 -9.63 2.23 3.38 -1.69 -3.43 115.31 106.17 1fa0 h LEU 177 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1fa0 h LEU 177 Cb 0.33 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.20 1fa0 h LEU 177 CO 0.00 0.00 0.32 -2.11 0.09 0.00 0.00 178.44 176.74 1fa0 n ARG 178 N -2.74 1.74 -0.87 1.13 1.85 -0.97 -2.13 116.66 114.67 1fa0 n ARG 178 Ca 0.04 0.61 -0.02 0.00 -1.00 0.00 0.00 57.85 57.49 1fa0 n ARG 178 Cb 0.47 -2.11 -0.01 0.00 -1.05 0.00 0.00 32.46 29.77 1fa0 n ARG 178 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1fa0 n ASN 179 N 0.92 -4.60 -4.70 2.89 4.13 -1.26 -4.51 115.26 108.12 1fa0 n ASN 179 Ca 0.07 0.05 -0.42 0.00 1.68 0.00 0.00 54.58 55.97 1fa0 n ASN 179 Cb 0.35 -2.97 -0.03 0.00 -1.54 0.00 0.00 39.78 35.59 1fa0 n ASN 179 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1fa0 s LEU 180 N -0.56 4.33 0.57 3.41 1.43 -0.91 -4.94 118.68 122.02 1fa0 s LEU 180 Ca 0.00 1.57 -0.16 0.00 -1.03 0.00 0.00 54.13 54.51 1fa0 s LEU 180 Cb 0.00 -3.51 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 1fa0 s LEU 180 CO 0.00 -0.29 1.03 1.51 0.23 0.00 0.00 176.35 178.83 1fa0 s ASP 181 N 1.01 6.05 0.06 2.29 -4.77 -1.26 -4.73 116.67 115.32 1fa0 s ASP 181 Ca 0.49 1.72 -0.12 0.00 -3.30 0.00 0.00 52.55 51.34 1fa0 s ASP 181 Cb -0.20 -2.52 -0.03 0.00 -1.09 0.00 0.00 42.92 39.08 1fa0 s ASP 181 CO 0.24 -0.98 0.67 -0.62 0.70 0.00 0.00 175.17 175.18 1fa0 n GLU 182 N -1.95 -0.17 -0.27 2.11 -0.58 -1.26 -0.03 120.64 118.49 1fa0 n GLU 182 Ca 0.08 0.65 0.13 0.00 -0.42 0.00 0.00 57.16 57.60 1fa0 n GLU 182 Cb 0.53 -0.96 0.39 0.00 -0.57 0.00 0.00 31.44 30.82 1fa0 n GLU 182 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1fa0 h LYS 183 N 0.00 0.65 0.00 3.49 1.57 -1.92 -0.65 116.57 119.72 1fa0 h LYS 183 Ca 0.06 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 1fa0 h LYS 183 Cb 0.16 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1fa0 h LYS 183 CO -0.37 0.43 -0.66 -0.44 -0.57 0.00 0.00 179.45 177.85 1fa0 h ASP 184 N 0.67 0.00 -0.39 0.86 3.32 -0.78 -1.88 116.42 118.22 1fa0 h ASP 184 Ca 0.46 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.36 1fa0 h ASP 184 Cb 0.78 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1fa0 h ASP 184 CO -0.22 0.66 -0.32 -0.07 -1.72 0.00 0.00 179.24 177.57 1fa0 h LEU 185 N 0.00 0.98 -0.16 1.55 3.38 -0.69 -2.00 115.31 118.37 1fa0 h LEU 185 Ca -0.01 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 1fa0 h LEU 185 Cb 1.23 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1fa0 h LEU 185 CO 0.09 1.20 -0.06 0.03 0.09 0.00 0.00 178.44 179.78 1fa0 h ARG 186 N 0.78 0.33 -0.75 1.13 3.08 -1.30 -1.41 114.38 116.24 1fa0 h ARG 186 Ca 0.08 -0.14 0.13 0.00 0.07 0.00 0.00 59.98 60.13 1fa0 h ARG 186 Cb 0.90 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.85 1fa0 h ARG 186 CO 0.08 0.63 0.31 0.00 -1.07 0.00 0.00 179.97 179.92 1fa0 h ALA 187 N 0.69 1.05 0.00 0.04 0.00 -1.27 -2.24 119.26 117.52 1fa0 h ALA 187 Ca 0.04 0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1fa0 h ALA 187 Cb 0.53 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1fa0 h ALA 187 CO 0.02 -0.19 -0.71 1.25 0.00 0.00 0.00 179.25 179.62 1fa0 h LEU 188 N 0.47 0.00 -1.30 0.00 5.85 -1.27 -3.34 115.31 115.71 1fa0 h LEU 188 Ca 0.40 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.14 1fa0 h LEU 188 Cb 0.59 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 1fa0 h LEU 188 CO -0.38 0.71 0.48 -1.13 -0.34 0.00 0.00 178.44 177.78 1fa0 h ASN 189 N 0.00 0.80 0.12 1.25 -0.00 -0.61 -2.81 115.58 114.33 1fa0 h ASN 189 Ca -0.01 -0.02 0.01 0.00 -0.00 0.00 0.00 56.30 56.29 1fa0 h ASN 189 Cb 1.36 -0.20 -0.04 0.00 -0.00 0.00 0.00 38.32 39.44 1fa0 h ASN 189 CO 0.09 0.57 -0.48 1.23 -0.00 0.00 0.00 177.43 178.84 1fa0 h GLY 190 N 0.95 -1.17 0.92 1.57 0.00 -1.68 -0.35 103.07 103.30 1fa0 h GLY 190 Ca 0.27 0.64 -0.01 0.00 0.00 0.00 0.00 47.33 48.23 1fa0 h GLY 190 CO -0.07 -0.29 0.12 -0.84 0.00 0.00 0.00 176.54 175.47 1fa0 h THR 191 N -0.69 1.16 -0.94 4.70 2.02 -1.79 -1.95 112.91 115.41 1fa0 h THR 191 Ca -0.01 -0.46 0.12 0.00 0.77 0.00 0.00 66.41 66.84 1fa0 h THR 191 Cb 0.69 0.98 -0.08 0.00 -1.74 0.00 0.00 68.15 68.00 1fa0 h THR 191 CO -0.26 0.16 0.57 0.03 0.37 0.00 0.00 175.52 176.38 1fa0 h ARG 192 N 0.28 0.85 -0.14 6.66 3.08 -1.35 0.37 114.38 124.14 1fa0 h ARG 192 Ca 0.09 -0.05 -0.22 0.00 0.07 0.00 0.00 59.98 59.87 1fa0 h ARG 192 Cb 0.14 -0.19 0.01 0.00 0.08 0.00 0.00 29.97 30.01 1fa0 h ARG 192 CO -0.01 0.57 -0.79 0.28 -1.07 0.00 0.00 179.97 178.95 1fa0 h VAL 193 N 0.88 1.29 -0.17 2.04 2.07 -0.83 -2.63 116.25 118.89 1fa0 h VAL 193 Ca 0.47 -2.01 -0.15 0.00 0.82 0.00 0.00 66.70 65.83 1fa0 h VAL 193 Cb 0.51 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1fa0 h VAL 193 CO -0.28 0.63 -0.53 0.71 0.02 0.00 0.00 177.57 178.12 1fa0 h THR 194 N 0.50 1.33 -0.68 2.57 1.35 -0.94 -2.45 112.91 114.59 1fa0 h THR 194 Ca -0.05 -1.78 -0.06 0.00 -0.55 0.00 0.00 66.41 63.97 1fa0 h THR 194 Cb 1.41 1.77 -0.03 0.00 -1.73 0.00 0.00 68.15 69.57 1fa0 h THR 194 CO 0.16 0.55 0.19 0.44 -0.25 0.00 0.00 175.52 176.61 1fa0 h ASP 195 N 0.39 0.98 0.43 5.36 3.32 -0.97 -2.87 116.42 123.06 1fa0 h ASP 195 Ca 0.01 -0.19 -0.16 0.00 0.02 0.00 0.00 57.03 56.71 1fa0 h ASP 195 Cb 1.05 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1fa0 h ASP 195 CO 0.10 0.93 -0.68 -0.33 -1.72 0.00 0.00 179.24 177.53 1fa0 h GLU 196 N 1.01 0.22 -0.51 3.56 5.08 -1.34 -3.07 114.58 119.53 1fa0 h GLU 196 Ca 0.22 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1fa0 h GLU 196 Cb 0.31 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1fa0 h GLU 196 CO -0.00 0.82 0.12 0.82 -1.00 0.00 0.00 179.01 179.77 1fa0 h ILE 197 N 0.16 1.24 -0.22 3.13 2.04 -1.34 -2.22 117.51 120.30 1fa0 h ILE 197 Ca -0.02 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 1fa0 h ILE 197 Cb 1.22 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1fa0 h ILE 197 CO 0.11 0.31 0.09 -0.07 0.00 0.00 0.00 178.15 178.59 1fa0 h LEU 198 N 0.71 0.27 0.00 1.44 3.38 -1.47 -1.03 115.31 118.61 1fa0 h LEU 198 Ca 0.16 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1fa0 h LEU 198 Cb 0.34 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1fa0 h LEU 198 CO 0.00 0.25 -0.14 -0.62 0.09 0.00 0.00 178.44 178.02 1fa0 n GLU 199 N -4.45 0.14 -0.23 1.13 -0.58 -1.02 -3.90 120.64 111.73 1fa0 n GLU 199 Ca 0.00 0.09 0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1fa0 n GLU 199 Cb 0.12 -1.64 0.23 0.00 -0.57 0.00 0.00 31.44 29.58 1fa0 n GLU 199 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1fa0 n LEU 200 N -1.87 3.48 -4.55 -4.62 4.77 -0.40 -4.69 117.00 109.12 1fa0 n LEU 200 Ca 0.06 -1.65 -0.29 0.00 -0.03 0.00 0.00 56.01 54.10 1fa0 n LEU 200 Cb 0.39 -0.30 -0.10 0.00 -2.33 0.00 0.00 43.42 41.08 1fa0 n LEU 200 CO 0.30 0.79 -0.44 0.68 -1.33 0.00 0.00 177.39 177.39 1fa0 s VAL 201 N -1.30 3.19 0.04 4.08 -7.23 -1.20 -4.42 120.40 113.57 1fa0 s VAL 201 Ca 0.39 -1.39 -0.23 0.00 -1.81 0.00 0.00 61.98 58.94 1fa0 s VAL 201 Cb 0.22 -2.49 -0.12 0.00 0.56 0.00 0.00 36.38 34.55 1fa0 s VAL 201 CO 0.30 0.08 1.35 -0.65 -0.31 0.00 0.00 175.10 175.87 1fa0 h PRO 202 N 3.56 -0.71 -4.46 4.82 0.11 -1.84 -3.41 132.00 130.07 1fa0 h PRO 202 Ca -0.49 0.05 -0.65 0.00 0.11 0.00 0.00 66.00 65.02 1fa0 h PRO 202 Cb 1.17 0.16 -0.40 0.00 0.11 0.00 0.00 31.00 32.04 1fa0 h PRO 202 CO 0.50 -0.48 -0.72 0.15 -0.21 0.00 0.00 178.00 177.25 1fa0 s LYS 203 N -4.81 1.45 0.26 1.05 -0.14 -1.26 -4.84 119.74 111.44 1fa0 s LYS 203 Ca -0.12 -1.87 -0.11 0.00 -1.36 0.00 0.00 55.97 52.51 1fa0 s LYS 203 Cb 0.02 -3.10 0.37 0.00 -1.68 0.00 0.00 37.83 33.45 1fa0 s LYS 203 CO 0.37 -0.96 1.57 -1.35 -0.76 0.00 0.00 175.35 174.22 1fa0 h PRO 204 N 7.55 -0.01 -0.58 -1.68 0.11 -1.89 -1.14 132.00 134.36 1fa0 h PRO 204 Ca -0.05 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.99 1fa0 h PRO 204 Cb 1.01 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1fa0 h PRO 204 CO 0.53 -0.01 0.07 -0.91 -0.21 0.00 0.00 178.00 177.48 1fa0 h ASN 205 N -0.01 0.91 -0.38 -2.05 -0.26 -1.97 -0.07 115.58 111.76 1fa0 h ASN 205 Ca 0.42 -0.21 -0.01 0.00 -0.56 0.00 0.00 56.30 55.94 1fa0 h ASN 205 Cb 0.66 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.66 1fa0 h ASN 205 CO -0.95 0.93 0.20 0.58 -1.06 0.00 0.00 177.43 177.13 1fa0 h VAL 206 N 0.90 1.14 -0.19 2.81 2.07 -1.60 -1.92 116.25 119.46 1fa0 h VAL 206 Ca 0.18 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 67.25 1fa0 h VAL 206 Cb 0.42 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1fa0 h VAL 206 CO 0.01 0.16 -0.13 0.15 0.02 0.00 0.00 177.57 177.78 1fa0 h PHE 207 N 0.57 0.50 -0.78 1.57 3.57 -0.76 -2.77 116.94 118.84 1fa0 h PHE 207 Ca 0.15 -0.14 0.02 0.00 3.53 0.00 0.00 57.97 61.53 1fa0 h PHE 207 Cb 0.05 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1fa0 h PHE 207 CO 0.00 0.76 0.52 0.00 -2.23 0.00 0.00 178.31 177.36 1fa0 h ARG 208 N 0.10 0.99 0.55 1.11 3.08 -0.36 0.85 114.38 120.70 1fa0 h ARG 208 Ca 0.04 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1fa0 h ARG 208 Cb 0.65 -0.22 0.01 0.00 0.08 0.00 0.00 29.97 30.48 1fa0 h ARG 208 CO 0.04 0.65 -0.27 0.82 -1.07 0.00 0.00 179.97 180.14 1fa0 h ILE 209 N 1.02 0.07 -1.01 2.04 1.08 -1.37 -1.53 117.51 117.81 1fa0 h ILE 209 Ca 0.30 -0.46 0.24 0.00 -0.39 0.00 0.00 64.86 64.55 1fa0 h ILE 209 Cb -0.05 0.10 -0.12 0.00 -3.07 0.00 0.00 36.82 33.68 1fa0 h ILE 209 CO -0.08 0.01 0.60 0.00 -0.69 0.00 0.00 178.15 178.00 1fa0 h ALA 210 N -1.12 1.82 -0.13 1.87 0.00 -1.33 0.60 119.26 120.96 1fa0 h ALA 210 Ca -0.08 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1fa0 h ALA 210 Cb 0.59 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1fa0 h ALA 210 CO 0.13 -0.27 -0.36 1.25 0.00 0.00 0.00 179.25 179.99 1fa0 h LEU 211 N 0.59 0.28 -0.33 0.00 6.46 -0.78 0.10 115.31 121.63 1fa0 h LEU 211 Ca 0.63 -0.11 -0.10 0.00 -0.12 0.00 0.00 57.88 58.18 1fa0 h LEU 211 Cb 1.21 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 1fa0 h LEU 211 CO -0.45 0.63 -0.20 0.03 -0.62 0.00 0.00 178.44 177.82 1fa0 h ARG 212 N 0.23 0.71 0.39 1.25 3.08 0.12 -0.24 114.38 119.93 1fa0 h ARG 212 Ca 0.03 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.72 1fa0 h ARG 212 Cb 0.76 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1fa0 h ARG 212 CO 0.06 0.94 -0.19 0.00 -1.07 0.00 0.00 179.97 179.71 1fa0 h ALA 213 N 0.76 -0.53 -0.56 0.04 0.00 -0.65 -1.89 119.26 116.43 1fa0 h ALA 213 Ca 0.07 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.91 1fa0 h ALA 213 Cb 0.75 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1fa0 h ALA 213 CO 0.06 -0.75 0.23 0.82 0.00 0.00 0.00 179.25 179.60 1fa0 h ILE 214 N -0.63 0.83 -0.54 0.00 1.08 -0.99 0.17 117.51 117.43 1fa0 h ILE 214 Ca -0.05 -0.15 0.07 0.00 -0.39 0.00 0.00 64.86 64.34 1fa0 h ILE 214 Cb 0.46 0.37 -0.06 0.00 -3.07 0.00 0.00 36.82 34.52 1fa0 h ILE 214 CO 0.09 0.08 0.21 0.50 -0.69 0.00 0.00 178.15 178.34 1fa0 h LYS 215 N 0.42 0.39 0.47 2.37 3.64 -0.90 0.51 116.57 123.48 1fa0 h LYS 215 Ca 0.27 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1fa0 h LYS 215 Cb 0.29 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1fa0 h LYS 215 CO -0.26 0.26 -0.23 1.25 -2.27 0.00 0.00 179.45 178.21 1fa0 h LEU 216 N 0.41 -0.54 -1.00 5.20 5.85 -0.66 -1.96 115.31 122.61 1fa0 h LEU 216 Ca 0.26 0.02 0.35 0.00 0.84 0.00 0.00 57.88 59.35 1fa0 h LEU 216 Cb 0.27 0.14 -0.16 0.00 0.37 0.00 0.00 40.66 41.28 1fa0 h LEU 216 CO -0.25 -0.31 0.55 -0.25 -0.34 0.00 0.00 178.44 177.84 1fa0 h TRP 217 N -0.78 0.88 -0.30 1.25 7.01 -0.48 0.28 115.95 123.82 1fa0 h TRP 217 Ca -0.06 0.04 -0.17 0.00 2.11 0.00 0.00 58.89 60.81 1fa0 h TRP 217 Cb 0.49 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 27.32 1fa0 h TRP 217 CO 0.07 -0.27 -0.48 0.00 -2.79 0.00 0.00 178.44 174.97 1fa0 h ALA 218 N 1.89 0.59 -0.08 2.65 0.00 0.13 -2.39 119.26 122.05 1fa0 h ALA 218 Ca 0.76 -0.49 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 1fa0 h ALA 218 Cb 1.83 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1fa0 h ALA 218 CO -0.66 0.68 -0.74 1.96 0.00 0.00 0.00 179.25 180.49 1fa0 h GLN 219 N 0.63 0.44 -0.04 0.00 4.20 -0.18 -1.99 115.11 118.18 1fa0 h GLN 219 Ca 0.03 -0.36 -0.10 0.00 0.06 0.00 0.00 58.65 58.28 1fa0 h GLN 219 Cb 1.06 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.91 1fa0 h GLN 219 CO 0.11 1.00 -0.43 0.00 -0.67 0.00 0.00 178.83 178.83 1fa0 h ARG 220 N 0.30 0.08 -0.50 1.46 2.47 -1.29 -2.92 114.38 113.98 1fa0 h ARG 220 Ca -0.03 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1fa0 h ARG 220 Cb 1.32 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.64 1fa0 h ARG 220 CO 0.13 0.50 0.00 0.54 0.56 0.00 0.00 179.97 181.70 1fa0 n ARG 221 N -4.02 2.19 -3.84 0.04 5.12 -0.90 -2.06 116.66 113.20 1fa0 n ARG 221 Ca -0.02 -1.85 -0.29 0.00 -1.93 0.00 0.00 57.85 53.77 1fa0 n ARG 221 Cb 0.47 -1.41 0.04 0.00 -1.16 0.00 0.00 32.46 30.40 1fa0 n ARG 221 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1fa0 n ALA 222 N 1.01 -1.27 -2.05 7.54 0.00 -1.11 -4.87 120.51 119.76 1fa0 n ALA 222 Ca 0.17 0.24 -0.08 0.00 0.00 0.00 0.00 53.44 53.77 1fa0 n ALA 222 Cb 0.44 -4.67 0.08 0.00 0.00 0.00 0.00 19.45 15.30 1fa0 n ALA 222 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1fa0 n VAL 223 N -4.74 2.00 -3.51 0.00 0.24 -0.76 -4.58 118.33 106.98 1fa0 n VAL 223 Ca 0.04 -3.42 -0.27 0.00 -2.04 0.00 0.00 64.34 58.65 1fa0 n VAL 223 Cb 0.53 -0.30 -0.14 0.00 -1.47 0.00 0.00 33.84 32.46 1fa0 n VAL 223 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1fa0 s TYR 224 N -3.16 0.26 0.00 6.34 6.04 -1.22 -4.27 117.35 121.35 1fa0 s TYR 224 Ca 0.42 -0.88 0.00 0.00 0.04 0.00 0.00 57.07 56.65 1fa0 s TYR 224 Cb 0.38 -0.84 0.00 0.00 -1.04 0.00 0.00 41.96 40.46 1fa0 s TYR 224 CO -0.03 -0.84 0.00 0.00 -1.54 0.00 0.00 175.55 173.14 1fa0 n ALA 225 N 5.11 0.00 -0.01 3.97 0.00 -1.09 -4.90 120.51 123.59 1fa0 n ALA 225 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 1fa0 n ALA 225 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.77 1fa0 n ALA 225 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1fa0 h ASN 226 N 0.00 -0.03 0.00 0.00 -1.24 -1.73 -0.36 115.58 112.23 1fa0 h ASN 226 Ca 0.00 -0.52 0.00 0.00 0.71 0.00 0.00 56.30 56.49 1fa0 h ASN 226 Cb 0.00 0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.06 1fa0 h ASN 226 CO 0.00 0.52 0.42 -0.29 -1.29 0.00 0.00 177.43 176.78 1fa0 h ILE 227 N -0.59 0.00 -0.38 2.57 2.10 -1.96 0.53 117.51 119.77 1fa0 h ILE 227 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1fa0 h ILE 227 Cb 0.55 0.47 0.00 0.00 -1.09 0.00 0.00 36.82 36.75 1fa0 h ILE 227 CO 0.01 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.57 1fa0 n PHE 228 N -2.60 0.86 -0.49 2.19 0.99 -1.20 -4.49 117.46 112.72 1fa0 n PHE 228 Ca -0.01 -0.66 0.00 0.00 -0.00 0.00 0.00 57.45 56.77 1fa0 n PHE 228 Cb 0.45 -0.18 0.00 0.00 -1.00 0.00 0.00 39.48 38.75 1fa0 n PHE 228 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1fa0 n GLY 229 N 0.27 0.71 3.44 1.37 0.00 0.18 -4.85 105.19 106.30 1fa0 n GLY 229 Ca 0.18 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 1fa0 n GLY 229 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fa0 s PHE 230 N -2.00 2.16 0.35 1.61 0.40 -0.15 -4.03 117.98 116.32 1fa0 s PHE 230 Ca 0.00 -0.39 -0.28 0.00 -0.60 0.00 0.00 56.93 55.66 1fa0 s PHE 230 Cb 0.00 -0.95 -0.11 0.00 0.51 0.00 0.00 43.02 42.47 1fa0 s PHE 230 CO 0.00 0.63 1.42 -2.14 0.70 0.00 0.00 175.22 175.83 1fa0 s PRO 231 N -3.54 4.21 0.13 0.24 0.02 -1.26 -2.78 135.00 132.02 1fa0 s PRO 231 Ca 0.28 2.42 0.01 0.00 0.02 0.00 0.00 61.00 63.74 1fa0 s PRO 231 Cb -0.04 -3.02 0.02 0.00 0.02 0.00 0.00 34.50 31.49 1fa0 s PRO 231 CO 0.13 -0.40 0.18 0.41 -0.33 0.00 0.00 177.00 176.99 1fa0 n GLY 232 N 0.74 1.64 0.39 0.52 0.00 -1.26 -2.66 105.19 104.56 1fa0 n GLY 232 Ca 0.01 -2.10 -0.12 0.00 0.00 0.00 0.00 46.02 43.81 1fa0 n GLY 232 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1fa0 h GLY 233 N -0.02 -1.12 0.89 -0.02 0.00 -1.97 -0.31 103.07 100.53 1fa0 h GLY 233 Ca -0.06 0.76 0.03 0.00 0.00 0.00 0.00 47.33 48.06 1fa0 h GLY 233 CO 0.08 -0.17 0.61 -2.08 0.00 0.00 0.00 176.54 174.98 1fa0 h VAL 234 N -0.29 1.17 -0.68 4.60 2.07 -1.99 0.73 116.25 121.87 1fa0 h VAL 234 Ca 0.08 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1fa0 h VAL 234 Cb 0.49 -0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1fa0 h VAL 234 CO -0.58 0.22 0.13 0.00 0.02 0.00 0.00 177.57 177.36 1fa0 h ALA 235 N 1.38 0.96 -0.07 1.67 0.00 -1.77 -1.28 119.26 120.15 1fa0 h ALA 235 Ca 0.37 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 1fa0 h ALA 235 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1fa0 h ALA 235 CO -0.12 0.66 -0.48 -1.49 0.00 0.00 0.00 179.25 177.82 1fa0 h TRP 236 N 1.03 0.20 0.59 0.00 -0.00 -0.32 -1.98 115.95 115.47 1fa0 h TRP 236 Ca 0.21 -0.06 -0.03 0.00 -0.00 0.00 0.00 58.89 59.01 1fa0 h TRP 236 Cb 0.41 -0.04 0.01 0.00 -0.00 0.00 0.00 29.16 29.53 1fa0 h TRP 236 CO 0.03 0.62 -0.28 0.00 -0.00 0.00 0.00 178.44 178.81 1fa0 h ALA 237 N 1.37 -0.79 -0.33 1.49 0.00 -0.13 -2.10 119.26 118.77 1fa0 h ALA 237 Ca 0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1fa0 h ALA 237 Cb 0.90 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1fa0 h ALA 237 CO 0.07 -0.92 0.14 0.52 0.00 0.00 0.00 179.25 179.06 1fa0 h MET 238 N -0.84 0.45 -0.37 0.00 2.86 -1.23 0.12 114.93 115.92 1fa0 h MET 238 Ca -0.08 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.43 1fa0 h MET 238 Cb 0.62 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 1fa0 h MET 238 CO 0.13 0.37 -0.11 1.25 1.06 0.00 0.00 176.91 179.61 1fa0 h LEU 239 N 0.45 0.62 0.10 1.22 5.85 -1.22 -0.03 115.31 122.30 1fa0 h LEU 239 Ca 0.12 -0.17 -0.29 0.00 0.84 0.00 0.00 57.88 58.37 1fa0 h LEU 239 Cb 0.08 -0.17 0.03 0.00 0.37 0.00 0.00 40.66 40.97 1fa0 h LEU 239 CO -0.01 0.77 -1.21 0.58 -0.34 0.00 0.00 178.44 178.22 1fa0 h VAL 240 N 0.59 1.28 -0.66 1.05 2.07 -0.65 -3.21 116.25 116.72 1fa0 h VAL 240 Ca 0.10 -2.43 0.09 0.00 0.82 0.00 0.00 66.70 65.29 1fa0 h VAL 240 Cb 0.53 2.64 -0.07 0.00 -1.52 0.00 0.00 31.29 32.87 1fa0 h VAL 240 CO 0.03 0.74 0.30 0.00 0.02 0.00 0.00 177.57 178.66 1fa0 h ALA 241 N 0.31 0.89 -0.11 1.67 0.00 -0.46 -0.77 119.26 120.79 1fa0 h ALA 241 Ca -0.18 0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1fa0 h ALA 241 Cb 1.88 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 1fa0 h ALA 241 CO 0.23 -0.10 -0.08 -0.09 0.00 0.00 0.00 179.25 179.21 1fa0 h ARG 242 N 0.52 -0.08 -0.58 0.00 9.65 -1.04 -1.33 114.38 121.53 1fa0 h ARG 242 Ca 0.33 0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 59.18 1fa0 h ARG 242 Cb 0.36 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.93 1fa0 h ARG 242 CO -0.27 -0.05 0.24 0.82 2.80 0.00 0.00 179.97 183.50 1fa0 h ILE 243 N -0.08 1.22 -0.58 1.20 1.08 -1.44 -2.21 117.51 116.69 1fa0 h ILE 243 Ca 0.07 -0.68 0.09 0.00 -0.39 0.00 0.00 64.86 63.95 1fa0 h ILE 243 Cb 0.18 0.59 -0.07 0.00 -3.07 0.00 0.00 36.82 34.45 1fa0 h ILE 243 CO -0.16 0.26 0.20 0.00 -0.69 0.00 0.00 178.15 177.77 1fa0 h GLN 245 N 0.38 0.43 0.00 0.00 4.20 -0.64 -1.54 115.11 117.94 1fa0 h GLN 245 Ca 0.29 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.89 1fa0 h GLN 245 Cb 0.36 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1fa0 h GLN 245 CO -0.31 0.29 -0.42 -0.07 -0.67 0.00 0.00 178.83 177.65 1fa0 h LEU 246 N 0.45 0.00 -6.45 1.46 3.38 -0.33 -3.36 115.31 110.45 1fa0 h LEU 246 Ca 0.31 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.69 1fa0 h LEU 246 Cb 0.63 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.98 1fa0 h LEU 246 CO -0.10 0.42 -0.86 -1.22 0.09 0.00 0.00 178.44 176.77 1fa0 n TYR 247 N -3.62 0.67 -0.35 1.13 4.02 -0.60 -1.32 117.16 117.09 1fa0 n TYR 247 Ca -0.01 -3.69 0.08 0.00 -0.01 0.00 0.00 57.90 54.27 1fa0 n TYR 247 Cb 0.52 -0.15 0.26 0.00 -0.02 0.00 0.00 39.34 39.95 1fa0 n TYR 247 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1fa0 h PRO 248 N 5.11 0.93 -0.51 -0.72 0.13 -1.67 -2.76 132.00 132.52 1fa0 h PRO 248 Ca 0.20 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.23 1fa0 h PRO 248 Cb 0.84 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 1fa0 h PRO 248 CO 0.52 0.62 0.04 0.09 -0.23 0.00 0.00 178.00 179.04 1fa0 n ASN 249 N -4.60 5.04 -4.56 1.44 3.02 -1.26 -4.58 115.26 109.76 1fa0 n ASN 249 Ca 0.18 -3.03 -0.29 0.00 -0.03 0.00 0.00 54.58 51.41 1fa0 n ASN 249 Cb 0.36 -0.66 0.14 0.00 -0.61 0.00 0.00 39.78 39.00 1fa0 n ASN 249 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fa0 s ALA 250 N -2.84 2.36 -0.13 5.41 0.00 -1.04 -3.14 121.76 122.37 1fa0 s ALA 250 Ca 0.51 -0.87 0.18 0.00 0.00 0.00 0.00 51.96 51.79 1fa0 s ALA 250 Cb 0.40 -2.89 -0.15 0.00 0.00 0.00 0.00 23.12 20.48 1fa0 s ALA 250 CO 0.13 -2.08 0.73 0.00 0.00 0.00 0.00 175.76 174.55 1fa0 n SER 252 N -2.78 0.00 -0.22 0.00 2.88 -1.26 -4.86 113.62 107.37 1fa0 n SER 252 Ca -0.10 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.37 1fa0 n SER 252 Cb 0.81 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.31 1fa0 n SER 252 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fa0 h ALA 253 N 0.00 0.81 -0.57 -1.46 0.00 -1.91 0.17 119.26 116.30 1fa0 h ALA 253 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1fa0 h ALA 253 Cb 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1fa0 h ALA 253 CO 0.00 0.37 0.18 0.28 0.00 0.00 0.00 179.25 180.08 1fa0 h VAL 254 N 0.86 1.22 -0.58 0.00 2.07 -1.91 -1.90 116.25 116.02 1fa0 h VAL 254 Ca 0.22 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1fa0 h VAL 254 Cb 0.11 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1fa0 h VAL 254 CO -0.03 0.29 0.28 0.40 0.02 0.00 0.00 177.57 178.53 1fa0 h ILE 255 N 0.84 1.21 -0.49 4.57 1.08 -1.66 -0.52 117.51 122.54 1fa0 h ILE 255 Ca 0.19 -0.60 -0.02 0.00 -0.39 0.00 0.00 64.86 64.04 1fa0 h ILE 255 Cb 0.24 0.53 -0.02 0.00 -3.07 0.00 0.00 36.82 34.50 1fa0 h ILE 255 CO -0.01 0.24 0.22 -0.07 -0.69 0.00 0.00 178.15 177.84 1fa0 h LEU 256 N 0.79 0.61 0.67 1.44 3.38 -0.44 0.20 115.31 121.96 1fa0 h LEU 256 Ca 0.20 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1fa0 h LEU 256 Cb 0.12 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.72 1fa0 h LEU 256 CO -0.02 0.54 -0.32 -1.13 0.09 0.00 0.00 178.44 177.59 1fa0 h ASN 257 N 0.68 -0.76 -0.83 -0.43 -0.00 -0.59 -2.91 115.58 110.75 1fa0 h ASN 257 Ca 0.17 0.02 0.09 0.00 -0.00 0.00 0.00 56.30 56.58 1fa0 h ASN 257 Cb 0.10 0.20 -0.06 0.00 -0.00 0.00 0.00 38.32 38.56 1fa0 h ASN 257 CO -0.02 -0.37 0.54 0.03 -0.00 0.00 0.00 177.43 177.61 1fa0 h ARG 258 N -1.24 0.80 -0.20 6.67 2.47 -1.02 -1.65 114.38 120.21 1fa0 h ARG 258 Ca -0.09 -0.05 0.03 0.00 -1.26 0.00 0.00 59.98 58.61 1fa0 h ARG 258 Cb 0.69 -0.18 -0.06 0.00 -1.65 0.00 0.00 29.97 28.77 1fa0 h ARG 258 CO 0.15 0.53 -0.48 0.35 0.56 0.00 0.00 179.97 181.08 1fa0 h PHE 259 N 0.82 -1.44 -0.73 3.04 3.57 -0.59 0.86 116.94 122.47 1fa0 h PHE 259 Ca 0.38 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.93 1fa0 h PHE 259 Cb 0.37 0.65 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 1fa0 h PHE 259 CO -0.00 -0.46 0.44 0.74 -2.23 0.00 0.00 178.31 176.80 1fa0 h PHE 260 N -0.45 0.95 0.06 0.41 -1.00 -1.17 -0.55 116.94 115.19 1fa0 h PHE 260 Ca 0.04 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.82 1fa0 h PHE 260 Cb 0.56 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 39.81 1fa0 h PHE 260 CO -0.62 0.63 -0.03 0.82 -1.61 0.00 0.00 178.31 177.50 1fa0 h ILE 261 N 1.00 1.27 -0.50 -0.55 2.04 -0.43 -2.99 117.51 117.36 1fa0 h ILE 261 Ca 0.26 -1.20 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 1fa0 h ILE 261 Cb -0.04 2.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1fa0 h ILE 261 CO -0.05 0.29 0.14 0.40 0.00 0.00 0.00 178.15 178.94 1fa0 h ILE 262 N -0.62 1.23 0.00 -0.67 2.04 0.83 -2.71 117.51 117.61 1fa0 h ILE 262 Ca -0.01 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 1fa0 h ILE 262 Cb 0.54 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1fa0 h ILE 262 CO 0.01 0.29 -0.11 -0.07 0.00 0.00 0.00 178.15 178.27 1fa0 h LEU 263 N 0.67 0.00 0.15 1.44 3.38 -1.22 -1.52 115.31 118.21 1fa0 h LEU 263 Ca 0.16 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.92 1fa0 h LEU 263 Cb 0.29 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.06 1fa0 h LEU 263 CO -0.00 0.11 -0.92 0.77 0.09 0.00 0.00 178.44 178.48 1fa0 h SER 264 N 0.00 0.51 0.67 -0.43 4.64 -1.50 -3.27 113.55 114.17 1fa0 h SER 264 Ca -0.00 -0.95 0.00 0.00 -0.47 0.00 0.00 61.79 60.37 1fa0 h SER 264 Cb 0.82 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1fa0 h SER 264 CO 0.01 1.44 0.00 -0.62 -0.87 0.00 0.00 176.83 176.79 1fa0 n GLU 265 N -4.07 0.25 -1.72 4.77 1.02 -1.02 -4.89 120.64 114.97 1fa0 n GLU 265 Ca -0.15 0.03 -0.43 0.00 -0.02 0.00 0.00 57.16 56.60 1fa0 n GLU 265 Cb 0.86 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.76 1fa0 n GLU 265 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1fa0 n TRP 266 N -1.37 2.67 -1.49 -0.32 -0.00 -0.58 -4.90 117.44 111.46 1fa0 n TRP 266 Ca 0.11 0.28 -0.40 0.00 -0.00 0.00 0.00 57.50 57.48 1fa0 n TRP 266 Cb 0.25 -2.57 -0.02 0.00 -0.00 0.00 0.00 31.31 28.98 1fa0 n TRP 266 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1fa0 n ASN 267 N 2.33 4.84 -4.73 5.87 4.05 -1.26 -4.99 115.26 121.38 1fa0 n ASN 267 Ca 0.10 -2.72 -0.36 0.00 0.45 0.00 0.00 54.58 52.04 1fa0 n ASN 267 Cb 0.35 -1.52 0.07 0.00 1.23 0.00 0.00 39.78 39.91 1fa0 n ASN 267 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1fa0 s TRP 268 N 3.24 2.07 -0.24 1.20 0.52 -1.26 -1.92 118.94 122.55 1fa0 s TRP 268 Ca 0.53 1.51 0.01 0.00 0.02 0.00 0.00 56.10 58.17 1fa0 s TRP 268 Cb 0.15 -3.64 0.26 0.00 -1.15 0.00 0.00 33.47 29.08 1fa0 s TRP 268 CO -0.05 -2.85 1.64 -0.35 0.02 0.00 0.00 176.95 175.36 1fa0 n PRO 269 N -2.09 1.63 -1.96 4.98 -0.04 -1.25 -5.08 135.00 131.17 1fa0 n PRO 269 Ca 0.15 -1.38 -0.42 0.00 -0.04 0.00 0.00 63.50 61.82 1fa0 n PRO 269 Cb 0.49 -1.54 -0.03 0.00 -0.04 0.00 0.00 33.50 32.38 1fa0 n PRO 269 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1fa0 s GLN 270 N -1.55 4.23 0.60 0.54 -0.21 -0.81 -4.51 119.66 117.96 1fa0 s GLN 270 Ca 0.27 2.34 -0.17 0.00 0.02 0.00 0.00 55.36 57.81 1fa0 s GLN 270 Cb 0.22 -3.13 -0.03 0.00 1.00 0.00 0.00 33.01 31.07 1fa0 s GLN 270 CO 0.03 -0.52 1.12 -1.25 -2.12 0.00 0.00 175.29 172.55 1fa0 s PRO 271 N 0.33 3.11 -0.40 2.91 0.04 -1.26 -4.60 135.00 135.13 1fa0 s PRO 271 Ca 0.64 1.51 -0.16 0.00 0.04 0.00 0.00 61.00 63.03 1fa0 s PRO 271 Cb -0.43 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.14 1fa0 s PRO 271 CO 0.38 -1.03 0.36 0.08 0.04 0.00 0.00 177.00 176.83 1fa0 s VAL 272 N -2.03 5.18 -0.11 -0.36 1.01 0.15 -5.00 120.40 119.25 1fa0 s VAL 272 Ca 0.70 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.34 1fa0 s VAL 272 Cb -0.22 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 1fa0 s VAL 272 CO 0.34 -0.29 -0.22 -0.63 0.00 0.00 0.00 175.10 174.29 1fa0 s ILE 273 N 1.93 2.23 -0.53 2.22 1.09 -1.26 -2.21 121.20 124.66 1fa0 s ILE 273 Ca 0.09 -0.96 0.24 0.00 -1.10 0.00 0.00 60.65 58.92 1fa0 s ILE 273 Cb -0.18 -1.86 0.03 0.00 -1.06 0.00 0.00 42.46 39.39 1fa0 s ILE 273 CO 0.12 0.55 1.24 -0.07 -0.10 0.00 0.00 174.94 176.68 1fa0 h LEU 274 N 6.71 0.00 -7.00 2.97 3.38 -1.94 -3.43 115.31 116.00 1fa0 h LEU 274 Ca -0.20 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.65 1fa0 h LEU 274 Cb 1.24 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.76 1fa0 h LEU 274 CO 0.48 0.08 0.48 -1.59 0.09 0.00 0.00 178.44 177.98 1fa0 s LYS 275 N -3.22 0.68 0.22 1.13 -2.85 -1.26 -4.55 119.74 109.88 1fa0 s LYS 275 Ca 0.04 0.19 -0.31 0.00 -1.00 0.00 0.00 55.97 54.89 1fa0 s LYS 275 Cb 0.12 0.32 -0.15 0.00 -2.06 0.00 0.00 37.83 36.07 1fa0 s LYS 275 CO 0.74 -0.21 1.22 -2.30 0.10 0.00 0.00 175.35 174.91 1fa0 n PRO 276 N 0.83 1.50 -1.97 1.78 -0.02 -1.26 -4.89 135.00 130.96 1fa0 n PRO 276 Ca -0.12 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 1fa0 n PRO 276 Cb 0.58 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 31.96 1fa0 n PRO 276 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1fa0 s ILE 277 N -0.30 2.65 0.37 4.25 1.01 -1.26 -5.01 121.20 122.92 1fa0 s ILE 277 Ca 0.69 0.50 0.07 0.00 0.00 0.00 0.00 60.65 61.91 1fa0 s ILE 277 Cb -0.75 -3.32 -0.01 0.00 0.01 0.00 0.00 42.46 38.39 1fa0 s ILE 277 CO 0.53 0.06 0.47 -1.61 0.00 0.00 0.00 174.94 174.39 1fa0 s GLU 278 N 0.46 2.90 0.34 2.79 2.02 -1.26 -5.11 118.70 120.83 1fa0 s GLU 278 Ca 0.65 -1.19 0.07 0.00 0.02 0.00 0.00 54.97 54.52 1fa0 s GLU 278 Cb -0.43 -2.70 -0.02 0.00 0.10 0.00 0.00 34.13 31.09 1fa0 s GLU 278 CO 0.37 -0.08 0.41 -0.51 0.02 0.00 0.00 175.26 175.47 1fa0 s ASP 279 N -4.21 5.73 0.00 -0.19 1.01 -1.26 -4.83 116.67 112.91 1fa0 s ASP 279 Ca 0.48 -0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.44 1fa0 s ASP 279 Cb -0.08 -1.13 0.00 0.00 1.01 0.00 0.00 42.92 42.71 1fa0 s ASP 279 CO 0.31 -0.41 0.00 0.61 0.21 0.00 0.00 175.17 175.89 1fa0 n GLY 280 N -1.55 -0.72 0.00 0.21 0.00 -1.26 -5.01 105.19 96.86 1fa0 n GLY 280 Ca -0.01 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.37 1fa0 n GLY 280 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fa0 n PRO 281 N 0.00 0.58 -2.67 1.61 -0.04 -1.26 -3.49 135.00 129.73 1fa0 n PRO 281 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1fa0 n PRO 281 Cb 0.00 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 1fa0 n PRO 281 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1fa0 n LEU 282 N -1.00 1.54 -0.06 1.53 4.77 -1.26 -4.96 117.00 117.55 1fa0 n LEU 282 Ca 0.14 -3.67 0.24 0.00 -0.03 0.00 0.00 56.01 52.70 1fa0 n LEU 282 Cb 0.06 0.41 0.72 0.00 -2.33 0.00 0.00 43.42 42.28 1fa0 n LEU 282 CO 0.10 1.52 1.22 -0.61 -1.33 0.00 0.00 177.39 178.29 1fa0 h GLN 283 N 2.94 0.00 0.00 3.23 5.75 -1.97 -1.93 115.11 123.13 1fa0 h GLN 283 Ca -0.09 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 1fa0 h GLN 283 Cb 1.19 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.74 1fa0 h GLN 283 CO 0.47 0.00 0.00 -0.39 -2.65 0.00 0.00 178.83 176.26 1fa0 h VAL 284 N 0.00 0.00 -0.01 2.39 -1.51 -1.93 -2.75 116.25 112.44 1fa0 h VAL 284 Ca 0.32 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 1fa0 h VAL 284 Cb 1.39 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1fa0 h VAL 284 CO -0.00 0.00 -0.26 0.54 -1.23 0.00 0.00 177.57 176.61 1fa0 n ARG 285 N -2.54 1.09 -2.49 5.19 1.74 -0.73 -4.90 116.66 114.03 1fa0 n ARG 285 Ca 0.02 -0.73 -0.41 0.00 -0.77 0.00 0.00 57.85 55.95 1fa0 n ARG 285 Cb 0.26 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.17 1fa0 n ARG 285 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1fa0 s VAL 286 N -2.41 3.93 0.33 1.55 1.01 -1.04 -4.73 120.40 119.03 1fa0 s VAL 286 Ca 0.25 1.57 -0.29 0.00 0.00 0.00 0.00 61.98 63.51 1fa0 s VAL 286 Cb 0.19 -4.00 -0.12 0.00 0.00 0.00 0.00 36.38 32.45 1fa0 s VAL 286 CO 0.50 0.23 1.43 1.87 0.00 0.00 0.00 175.10 179.12 1fa0 n TRP 287 N 2.83 2.58 -3.13 5.22 -0.00 0.10 -4.97 117.44 120.07 1fa0 n TRP 287 Ca 0.04 0.44 0.04 0.00 -0.00 0.00 0.00 57.50 58.03 1fa0 n TRP 287 Cb 0.46 -2.49 -0.00 0.00 -0.00 0.00 0.00 31.31 29.28 1fa0 n TRP 287 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1fa0 s ASN 288 N -0.00 -1.08 0.61 5.87 3.04 -1.26 -5.00 114.94 117.12 1fa0 s ASN 288 Ca 0.59 0.05 0.38 0.00 0.04 0.00 0.00 52.86 53.92 1fa0 s ASN 288 Cb -0.54 1.65 1.98 0.00 -1.54 0.00 0.00 41.25 42.80 1fa0 s ASN 288 CO 0.58 -0.19 2.23 1.55 -3.04 0.00 0.00 177.10 178.23 1fa0 h PRO 289 N 7.51 0.00 0.04 0.43 0.13 -1.85 -1.23 132.00 137.03 1fa0 h PRO 289 Ca -0.04 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.83 1fa0 h PRO 289 Cb 1.19 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.33 1fa0 h PRO 289 CO 0.04 0.02 -1.08 0.87 -0.23 0.00 0.00 178.00 177.62 1fa0 h LYS 290 N 0.00 0.55 0.15 0.86 6.56 -1.97 -3.37 116.57 119.35 1fa0 h LYS 290 Ca -0.00 -0.65 -0.35 0.00 -1.06 0.00 0.00 60.65 58.59 1fa0 h LYS 290 Cb 0.17 0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 32.02 1fa0 h LYS 290 CO 0.00 1.26 -1.81 0.82 -2.06 0.00 0.00 179.45 177.66 1fa0 h ILE 291 N 0.28 0.85 -3.50 1.86 2.04 -1.89 -3.45 117.51 113.70 1fa0 h ILE 291 Ca -0.13 -2.50 -0.67 0.00 1.00 0.00 0.00 64.86 62.56 1fa0 h ILE 291 Cb 1.74 2.65 -0.29 0.00 -0.74 0.00 0.00 36.82 40.18 1fa0 h ILE 291 CO 0.20 0.85 -0.70 -0.31 0.00 0.00 0.00 178.15 178.19 1fa0 s TYR 292 N -2.58 3.05 0.24 1.37 1.51 -0.50 -4.98 117.35 115.46 1fa0 s TYR 292 Ca -0.17 -1.17 -0.06 0.00 -1.01 0.00 0.00 57.07 54.67 1fa0 s TYR 292 Cb 0.06 -2.13 0.35 0.00 -0.11 0.00 0.00 41.96 40.13 1fa0 s TYR 292 CO 0.82 -0.62 1.82 0.00 -1.11 0.00 0.00 175.55 176.46 1fa0 h ALA 293 N 8.11 1.11 -0.80 3.71 0.00 -1.87 -1.34 119.26 128.18 1fa0 h ALA 293 Ca -0.36 0.02 0.13 0.00 0.00 0.00 0.00 54.91 54.71 1fa0 h ALA 293 Cb 1.13 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 1fa0 h ALA 293 CO 0.59 0.13 0.39 0.37 0.00 0.00 0.00 179.25 180.73 1fa0 h GLN 294 N 0.81 0.56 -0.23 0.00 4.15 -1.93 0.19 115.11 118.66 1fa0 h GLN 294 Ca 0.37 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.68 1fa0 h GLN 294 Cb 0.27 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1fa0 h GLN 294 CO -0.21 0.37 -0.18 -0.44 -1.93 0.00 0.00 178.83 176.43 1fa0 h ASP 295 N 0.58 0.39 0.59 -0.69 3.45 -1.57 -2.63 116.42 116.54 1fa0 h ASP 295 Ca 0.43 -0.11 -0.05 0.00 0.43 0.00 0.00 57.03 57.73 1fa0 h ASP 295 Cb 0.59 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 1fa0 h ASP 295 CO -0.35 0.59 -0.22 -0.09 -1.57 0.00 0.00 179.24 177.60 1fa0 h ARG 296 N 0.37 0.00 0.00 3.56 2.43 -0.12 -3.04 114.38 117.57 1fa0 h ARG 296 Ca 0.06 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1fa0 h ARG 296 Cb 0.54 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1fa0 h ARG 296 CO 0.04 0.22 -0.10 0.66 -1.51 0.00 0.00 179.97 179.27 1fa0 h SER 297 N 0.00 0.00 -2.07 -3.80 4.64 -0.90 -3.45 113.55 107.97 1fa0 h SER 297 Ca -0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 1fa0 h SER 297 Cb 0.58 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.73 1fa0 h SER 297 CO 0.03 0.10 0.59 1.41 -0.87 0.00 0.00 176.83 178.10 1fa0 n HIS 298 N -3.14 1.88 -0.00 4.77 8.25 -1.15 -4.90 115.22 120.92 1fa0 n HIS 298 Ca 0.03 0.47 -0.11 0.00 -0.26 0.00 0.00 57.72 57.85 1fa0 n HIS 298 Cb 0.53 -2.43 -0.14 0.00 1.12 0.00 0.00 29.99 29.07 1fa0 n HIS 298 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fa0 h ARG 299 N 4.94 0.06 -2.40 -0.41 3.08 -1.87 -3.42 114.38 114.35 1fa0 h ARG 299 Ca -0.46 -0.10 -0.59 0.00 0.07 0.00 0.00 59.98 58.91 1fa0 h ARG 299 Cb 1.30 0.04 -0.39 0.00 0.08 0.00 0.00 29.97 30.99 1fa0 h ARG 299 CO 0.81 0.70 -0.94 -1.33 -1.07 0.00 0.00 179.97 178.14 1fa0 n MET 300 N -3.17 0.51 -2.20 0.04 2.81 -1.26 -3.95 117.12 109.89 1fa0 n MET 300 Ca -0.17 -3.38 -0.42 0.00 -1.81 0.00 0.00 57.70 51.92 1fa0 n MET 300 Cb 1.04 -1.70 -0.03 0.00 -0.71 0.00 0.00 33.22 31.82 1fa0 n MET 300 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 1fa0 s PRO 301 N -0.35 4.24 -0.25 0.03 0.02 -1.26 -4.71 135.00 132.72 1fa0 s PRO 301 Ca 0.32 1.96 -0.00 0.00 0.02 0.00 0.00 61.00 63.30 1fa0 s PRO 301 Cb 0.05 -3.75 0.07 0.00 0.02 0.00 0.00 34.50 30.89 1fa0 s PRO 301 CO -0.18 -0.70 0.01 0.08 -0.33 0.00 0.00 177.00 175.88 1fa0 s VAL 302 N 3.20 1.20 -0.08 3.83 1.01 -1.26 0.35 120.40 128.66 1fa0 s VAL 302 Ca 0.65 -1.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.46 1fa0 s VAL 302 Cb -0.30 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1fa0 s VAL 302 CO 0.24 -0.27 -0.04 0.27 0.00 0.00 0.00 175.10 175.30 1fa0 s ILE 303 N 1.52 3.91 0.47 2.22 -0.00 -0.94 -0.26 121.20 128.12 1fa0 s ILE 303 Ca -0.00 -0.40 -0.23 0.00 -0.00 0.00 0.00 60.65 60.01 1fa0 s ILE 303 Cb -0.18 -2.62 -0.07 0.00 -0.00 0.00 0.00 42.46 39.59 1fa0 s ILE 303 CO -0.10 0.60 1.25 0.42 -0.00 0.00 0.00 174.94 177.11 1fa0 s THR 304 N -0.82 2.69 0.09 8.37 -4.23 0.20 -4.51 115.64 117.44 1fa0 s THR 304 Ca 0.12 0.55 0.02 0.00 -1.18 0.00 0.00 61.69 61.21 1fa0 s THR 304 Cb -0.11 -3.29 -0.24 0.00 1.34 0.00 0.00 72.50 70.19 1fa0 s THR 304 CO 0.02 0.02 1.19 1.55 -0.54 0.00 0.00 174.62 176.86 1fa0 h PRO 305 N 2.07 0.12 -6.70 3.99 0.13 -1.91 -3.35 132.00 126.35 1fa0 h PRO 305 Ca -0.50 -0.20 -0.53 0.00 -0.87 0.00 0.00 66.00 63.91 1fa0 h PRO 305 Cb 1.26 0.07 0.05 0.00 0.13 0.00 0.00 31.00 32.51 1fa0 h PRO 305 CO 0.60 1.08 0.74 0.00 -0.23 0.00 0.00 178.00 180.18 1fa0 s ALA 306 N -2.68 3.61 0.27 -0.56 0.00 -1.26 -4.71 121.76 116.43 1fa0 s ALA 306 Ca -0.02 1.25 -0.30 0.00 0.00 0.00 0.00 51.96 52.90 1fa0 s ALA 306 Cb 0.09 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.57 1fa0 s ALA 306 CO 0.85 -0.68 1.41 -0.47 0.00 0.00 0.00 175.76 176.87 1fa0 s TYR 307 N 0.21 3.01 -0.05 0.00 5.04 -1.26 -3.06 117.35 121.24 1fa0 s TYR 307 Ca 0.60 1.13 -0.19 0.00 -2.44 0.00 0.00 57.07 56.17 1fa0 s TYR 307 Cb -0.40 -3.79 -0.05 0.00 0.35 0.00 0.00 41.96 38.07 1fa0 s TYR 307 CO 0.40 -2.47 0.52 -1.25 -1.34 0.00 0.00 175.55 171.41 1fa0 s PRO 308 N -0.77 4.27 0.23 4.97 0.04 -1.26 -5.05 135.00 137.43 1fa0 s PRO 308 Ca 0.57 0.57 -0.32 0.00 0.04 0.00 0.00 61.00 61.86 1fa0 s PRO 308 Cb -0.41 -3.36 -0.13 0.00 0.04 0.00 0.00 34.50 30.64 1fa0 s PRO 308 CO 0.46 0.32 1.61 0.43 0.04 0.00 0.00 177.00 179.87 1fa0 n SER 309 N 3.00 3.57 -4.14 6.66 7.64 -1.17 -4.84 113.62 124.34 1fa0 n SER 309 Ca -0.08 1.10 -0.10 0.00 1.01 0.00 0.00 58.87 60.80 1fa0 n SER 309 Cb 0.51 -1.53 -0.10 0.00 -1.01 0.00 0.00 64.21 62.09 1fa0 n SER 309 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1fa0 s MET 310 N 0.41 0.75 -0.01 1.43 -1.94 -1.26 0.03 119.30 118.71 1fa0 s MET 310 Ca 0.72 -1.22 -0.28 0.00 -1.71 0.00 0.00 55.69 53.20 1fa0 s MET 310 Cb -0.56 -0.16 -0.03 0.00 2.01 0.00 0.00 34.83 36.08 1fa0 s MET 310 CO 0.41 -0.02 0.90 0.00 -0.01 0.00 0.00 175.02 176.30 1fa0 n ALA 312 N 3.78 3.01 -2.03 0.00 0.00 0.64 -4.29 120.51 121.63 1fa0 n ALA 312 Ca 0.04 -0.32 -0.31 0.00 0.00 0.00 0.00 53.44 52.85 1fa0 n ALA 312 Cb 0.51 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.93 1fa0 n ALA 312 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fa0 n THR 313 N -2.19 2.97 -0.30 0.00 -2.24 -1.26 -4.80 114.28 106.46 1fa0 n THR 313 Ca 0.02 -4.26 -0.04 0.00 -2.27 0.00 0.00 64.05 57.49 1fa0 n THR 313 Cb 0.47 -1.22 0.07 0.00 -2.10 0.00 0.00 70.33 67.56 1fa0 n THR 313 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1fa0 h HIS 314 N 2.52 1.06 0.00 4.78 6.17 -1.92 -3.19 115.15 124.57 1fa0 h HIS 314 Ca 0.44 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.53 1fa0 h HIS 314 Cb 0.77 -0.35 0.00 0.00 2.52 0.00 0.00 27.41 30.35 1fa0 h HIS 314 CO 1.04 0.69 0.00 -0.91 0.71 0.00 0.00 177.93 179.46 1fa0 h ASN 315 N 1.12 0.00 -1.99 3.26 2.35 -1.88 -3.47 115.58 114.97 1fa0 h ASN 315 Ca 0.30 0.00 -0.64 0.00 -0.55 0.00 0.00 56.30 55.41 1fa0 h ASN 315 Cb -0.08 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.36 1fa0 h ASN 315 CO -0.06 0.00 0.48 -0.38 -1.65 0.00 0.00 177.43 175.82 1fa0 n ILE 316 N -2.42 0.38 -3.50 2.81 5.41 -1.21 -4.44 119.36 116.39 1fa0 n ILE 316 Ca 0.01 -0.09 -0.23 0.00 1.00 0.00 0.00 62.75 63.44 1fa0 n ILE 316 Cb 0.20 -1.04 0.02 0.00 -0.71 0.00 0.00 39.64 38.11 1fa0 n ILE 316 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1fa0 s THR 317 N 0.30 1.96 0.38 1.39 -4.23 -1.26 -4.70 115.64 109.47 1fa0 s THR 317 Ca 0.78 -1.27 0.14 0.00 -1.18 0.00 0.00 61.69 60.15 1fa0 s THR 317 Cb -0.84 -2.23 0.11 0.00 1.34 0.00 0.00 72.50 70.89 1fa0 s THR 317 CO 0.47 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 176.33 1fa0 h GLU 318 N 0.54 0.00 0.26 3.99 4.57 -1.95 -2.11 114.58 119.88 1fa0 h GLU 318 Ca -0.34 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.82 1fa0 h GLU 318 Cb 1.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1fa0 h GLU 318 CO 0.50 0.34 -0.12 0.77 -1.18 0.00 0.00 179.01 179.32 1fa0 h SER 319 N 0.00 -0.29 -0.55 1.04 0.02 -1.93 -3.00 113.55 108.83 1fa0 h SER 319 Ca -0.00 -0.10 0.13 0.00 -0.84 0.00 0.00 61.79 60.98 1fa0 h SER 319 Cb 0.61 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.20 1fa0 h SER 319 CO 0.04 0.20 0.39 0.71 -1.14 0.00 0.00 176.83 177.03 1fa0 h THR 320 N -1.05 0.79 -0.55 -2.27 1.35 -1.85 0.20 112.91 109.54 1fa0 h THR 320 Ca -0.04 -0.05 -0.06 0.00 -0.55 0.00 0.00 66.41 65.72 1fa0 h THR 320 Cb 0.38 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 67.40 1fa0 h THR 320 CO 0.06 0.03 0.11 0.50 -0.25 0.00 0.00 175.52 175.97 1fa0 h LYS 321 N 0.15 0.89 -0.02 4.72 3.64 -1.44 -0.56 116.57 123.94 1fa0 h LYS 321 Ca 0.26 -0.23 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1fa0 h LYS 321 Cb 0.84 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 1fa0 h LYS 321 CO -0.04 0.85 -0.03 0.87 -2.27 0.00 0.00 179.45 178.84 1fa0 h LYS 322 N 0.79 -0.04 0.08 1.90 1.57 -0.48 0.33 116.57 120.73 1fa0 h LYS 322 Ca 0.17 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1fa0 h LYS 322 Cb 0.37 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 1fa0 h LYS 322 CO 0.01 -0.02 -0.48 0.28 -0.57 0.00 0.00 179.45 178.67 1fa0 h VAL 323 N -0.04 0.00 -0.60 0.50 2.07 -1.11 0.36 116.25 117.43 1fa0 h VAL 323 Ca 0.02 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.66 1fa0 h VAL 323 Cb 0.07 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.72 1fa0 h VAL 323 CO -0.05 0.00 -0.19 0.40 0.02 0.00 0.00 177.57 177.76 1fa0 h ILE 324 N -0.65 0.34 0.00 4.57 2.04 -0.93 0.43 117.51 123.30 1fa0 h ILE 324 Ca -0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1fa0 h ILE 324 Cb 0.67 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1fa0 h ILE 324 CO -0.28 0.00 -0.11 -0.07 0.00 0.00 0.00 178.15 177.70 1fa0 h LEU 325 N -0.04 0.00 -0.04 1.44 3.38 -0.24 -0.40 115.31 119.41 1fa0 h LEU 325 Ca 0.28 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 1fa0 h LEU 325 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1fa0 h LEU 325 CO -0.64 0.11 -0.11 1.56 0.09 0.00 0.00 178.44 179.45 1fa0 h GLN 326 N 0.00 0.15 -0.08 1.13 4.20 0.39 -2.67 115.11 118.22 1fa0 h GLN 326 Ca -0.00 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 1fa0 h GLN 326 Cb 0.22 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1fa0 h GLN 326 CO 0.01 0.71 -0.05 0.93 -0.67 0.00 0.00 178.83 179.76 1fa0 h GLU 327 N -0.39 0.12 -0.21 1.46 4.39 -0.41 -1.95 114.58 117.58 1fa0 h GLU 327 Ca -0.00 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1fa0 h GLU 327 Cb 0.71 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 1fa0 h GLU 327 CO 0.02 0.18 0.02 0.74 -1.16 0.00 0.00 179.01 178.81 1fa0 h PHE 328 N 0.12 0.38 -0.38 4.33 0.05 -1.01 -0.68 116.94 119.75 1fa0 h PHE 328 Ca 0.03 -0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.76 1fa0 h PHE 328 Cb 0.17 -0.10 -0.02 0.00 2.00 0.00 0.00 35.95 38.00 1fa0 h PHE 328 CO 0.00 0.52 0.24 0.28 -0.18 0.00 0.00 178.31 179.17 1fa0 h VAL 329 N 0.14 1.11 -0.56 -0.55 2.07 -1.09 -0.28 116.25 117.08 1fa0 h VAL 329 Ca 0.06 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 67.46 1fa0 h VAL 329 Cb 0.35 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.62 1fa0 h VAL 329 CO 0.01 0.11 0.16 -0.09 0.02 0.00 0.00 177.57 177.77 1fa0 h ARG 330 N 0.51 0.31 -0.64 1.57 2.43 -1.25 0.16 114.38 117.46 1fa0 h ARG 330 Ca 0.14 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 1fa0 h ARG 330 Cb -0.04 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 1fa0 h ARG 330 CO -0.03 0.20 0.42 0.78 -1.51 0.00 0.00 179.97 179.84 1fa0 h GLY 331 N 0.31 0.79 1.57 2.80 0.00 0.13 0.17 103.07 108.84 1fa0 h GLY 331 Ca 0.28 -0.25 -0.18 0.00 0.00 0.00 0.00 47.33 47.18 1fa0 h GLY 331 CO -0.33 0.19 -0.72 -2.08 0.00 0.00 0.00 176.54 173.59 1fa0 h VAL 332 N 0.62 1.37 0.00 4.60 2.07 0.87 -2.43 116.25 123.37 1fa0 h VAL 332 Ca 0.28 -2.12 -0.00 0.00 0.82 0.00 0.00 66.70 65.68 1fa0 h VAL 332 Cb 0.29 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1fa0 h VAL 332 CO -0.09 0.64 -0.00 1.56 0.02 0.00 0.00 177.57 179.70 1fa0 h GLN 333 N 0.29 -0.01 -0.02 1.57 4.20 0.30 -2.63 115.11 118.82 1fa0 h GLN 333 Ca -0.03 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1fa0 h GLN 333 Cb 1.30 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.08 1fa0 h GLN 333 CO 0.13 0.58 0.00 0.82 -0.67 0.00 0.00 178.83 179.69 1fa0 h ILE 334 N -0.60 1.19 0.00 2.54 2.04 -0.80 -2.31 117.51 119.58 1fa0 h ILE 334 Ca -0.00 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.26 1fa0 h ILE 334 Cb 0.59 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1fa0 h ILE 334 CO 0.00 0.15 -0.13 0.71 0.00 0.00 0.00 178.15 178.88 1fa0 h THR 335 N -0.21 0.41 -0.28 -0.27 1.35 -1.57 0.77 112.91 113.11 1fa0 h THR 335 Ca 0.01 -0.73 -0.16 0.00 -0.55 0.00 0.00 66.41 64.97 1fa0 h THR 335 Cb 0.24 1.52 -0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1fa0 h THR 335 CO 0.00 0.13 -0.48 0.78 -0.25 0.00 0.00 175.52 175.70 1fa0 h ASN 336 N 0.00 0.82 -0.41 5.36 -0.26 -1.33 -2.08 115.58 117.68 1fa0 h ASN 336 Ca -0.00 -0.41 -0.13 0.00 -0.56 0.00 0.00 56.30 55.20 1fa0 h ASN 336 Cb 0.51 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.53 1fa0 h ASN 336 CO 0.02 1.16 -0.26 0.44 -1.06 0.00 0.00 177.43 177.73 1fa0 h ASP 337 N 0.60 0.93 -0.12 5.81 3.32 -0.73 -2.44 116.42 123.79 1fa0 h ASP 337 Ca 0.03 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.65 1fa0 h ASP 337 Cb 1.05 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1fa0 h ASP 337 CO 0.10 1.16 0.07 0.40 -1.72 0.00 0.00 179.24 179.25 1fa0 h ILE 338 N 0.72 1.05 0.00 0.35 2.04 -0.74 0.52 117.51 121.45 1fa0 h ILE 338 Ca 0.08 -0.15 -0.12 0.00 1.00 0.00 0.00 64.86 65.67 1fa0 h ILE 338 Cb 0.83 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1fa0 h ILE 338 CO 0.07 0.06 -0.56 -0.26 0.00 0.00 0.00 178.15 177.46 1fa0 h PHE 339 N 0.19 0.00 -0.59 1.37 -1.00 -1.13 -2.98 116.94 112.81 1fa0 h PHE 339 Ca 0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 1fa0 h PHE 339 Cb 0.02 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.58 1fa0 h PHE 339 CO 0.00 0.56 0.00 -1.13 -1.61 0.00 0.00 178.31 176.13 1fa0 n SER 340 N -3.24 3.21 -1.93 2.17 3.41 -0.55 -4.93 113.62 111.76 1fa0 n SER 340 Ca 0.02 -2.03 -0.19 0.00 -0.26 0.00 0.00 58.87 56.41 1fa0 n SER 340 Cb 0.76 -0.40 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 1fa0 n SER 340 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1fa0 n ASN 341 N 1.20 -5.47 0.05 4.04 4.13 0.25 -4.90 115.26 114.56 1fa0 n ASN 341 Ca 0.20 0.17 0.03 0.00 1.68 0.00 0.00 54.58 56.66 1fa0 n ASN 341 Cb 0.51 -4.58 -0.06 0.00 -1.54 0.00 0.00 39.78 34.12 1fa0 n ASN 341 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1fa0 h LYS 342 N 0.00 0.00 0.00 3.52 1.57 -0.34 -3.48 116.57 117.83 1fa0 h LYS 342 Ca -0.44 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 57.96 1fa0 h LYS 342 Cb 1.31 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.53 1fa0 h LYS 342 CO 0.56 0.22 -0.34 1.63 -0.57 0.00 0.00 179.45 180.95 1fa0 n LYS 343 N -2.85 0.49 -4.35 3.15 5.02 -1.19 -4.94 118.16 113.50 1fa0 n LYS 343 Ca -0.07 -2.50 -0.18 0.00 -2.02 0.00 0.00 58.31 53.54 1fa0 n LYS 343 Cb 0.77 1.69 -0.10 0.00 -0.02 0.00 0.00 35.03 37.37 1fa0 n LYS 343 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1fa0 s SER 344 N -2.78 2.28 0.23 4.39 1.04 -1.26 -4.26 113.70 113.34 1fa0 s SER 344 Ca 0.22 -1.12 -0.06 0.00 0.48 0.00 0.00 55.95 55.47 1fa0 s SER 344 Cb 0.01 -0.08 0.38 0.00 0.10 0.00 0.00 66.02 66.43 1fa0 s SER 344 CO 0.16 -0.34 1.75 -0.50 0.98 0.00 0.00 173.24 175.29 1fa0 h TRP 345 N 2.50 0.56 -0.08 5.02 -0.00 -1.96 0.20 115.95 122.20 1fa0 h TRP 345 Ca -0.38 0.03 0.02 0.00 -0.00 0.00 0.00 58.89 58.56 1fa0 h TRP 345 Cb 1.22 -0.14 -0.00 0.00 -0.00 0.00 0.00 29.16 30.23 1fa0 h TRP 345 CO 0.66 0.15 0.11 0.00 -0.00 0.00 0.00 178.44 179.35 1fa0 h ALA 346 N 1.48 1.55 -0.01 1.49 0.00 -1.97 -1.04 119.26 120.75 1fa0 h ALA 346 Ca 0.37 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1fa0 h ALA 346 Cb 0.48 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1fa0 h ALA 346 CO -0.33 -0.14 -0.01 -0.91 0.00 0.00 0.00 179.25 177.86 1fa0 h ASN 347 N 0.00 0.03 -0.60 0.00 -0.26 -1.36 -2.96 115.58 110.43 1fa0 h ASN 347 Ca 0.04 -0.41 0.17 0.00 -0.56 0.00 0.00 56.30 55.53 1fa0 h ASN 347 Cb 0.25 -0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.47 1fa0 h ASN 347 CO -0.00 0.44 0.43 0.25 -1.06 0.00 0.00 177.43 177.49 1fa0 h LEU 348 N -0.38 0.03 -1.85 1.61 5.85 -1.13 -1.54 115.31 117.90 1fa0 h LEU 348 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1fa0 h LEU 348 Cb 0.43 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1fa0 h LEU 348 CO 0.00 0.01 0.00 0.49 -0.34 0.00 0.00 178.44 178.61 1fa0 n PHE 349 N -4.37 0.51 -1.73 1.25 0.99 -1.07 -4.87 117.46 108.17 1fa0 n PHE 349 Ca 0.11 -0.25 -0.42 0.00 -0.00 0.00 0.00 57.45 56.89 1fa0 n PHE 349 Cb 0.66 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 39.12 1fa0 n PHE 349 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1fa0 n GLU 350 N 1.01 2.61 -0.81 -1.08 1.02 -0.58 -4.85 120.64 117.96 1fa0 n GLU 350 Ca 0.18 0.93 -0.33 0.00 -0.02 0.00 0.00 57.16 57.92 1fa0 n GLU 350 Cb 0.47 -2.69 0.12 0.00 -0.02 0.00 0.00 31.44 29.32 1fa0 n GLU 350 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1fa0 n LYS 351 N 2.10 -0.31 -2.65 3.49 4.81 -1.26 -4.66 118.16 119.68 1fa0 n LYS 351 Ca 0.09 -0.05 -0.22 0.00 -0.87 0.00 0.00 58.31 57.25 1fa0 n LYS 351 Cb 0.36 -1.79 0.03 0.00 0.02 0.00 0.00 35.03 33.66 1fa0 n LYS 351 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1fa0 s ASN 352 N -1.94 5.34 -0.41 3.14 2.20 -0.87 -4.96 114.94 117.44 1fa0 s ASN 352 Ca 0.55 0.10 0.05 0.00 -0.94 0.00 0.00 52.86 52.63 1fa0 s ASN 352 Cb -0.21 -1.04 0.44 0.00 -2.00 0.00 0.00 41.25 38.45 1fa0 s ASN 352 CO 0.69 -1.10 1.28 -0.90 -2.94 0.00 0.00 177.10 174.12 1fa0 n ASP 353 N -2.36 5.24 -0.15 3.54 5.68 -1.26 -4.87 116.55 122.37 1fa0 n ASP 353 Ca 0.07 -3.75 -0.07 0.00 -0.50 0.00 0.00 54.79 50.54 1fa0 n ASP 353 Cb 0.59 -0.48 -0.01 0.00 -1.14 0.00 0.00 41.12 40.08 1fa0 n ASP 353 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1fa0 h PHE 354 N 2.37 -0.89 0.00 2.11 3.57 -1.98 -1.03 116.94 121.09 1fa0 h PHE 354 Ca 0.38 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.94 1fa0 h PHE 354 Cb 1.15 0.46 0.00 0.00 2.79 0.00 0.00 35.95 40.35 1fa0 h PHE 354 CO 0.91 -0.38 0.00 1.19 -2.23 0.00 0.00 178.31 177.80 1fa0 n PHE 355 N -5.42 0.00 -0.02 0.41 3.01 -1.26 -3.29 117.46 110.88 1fa0 n PHE 355 Ca 0.02 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.44 1fa0 n PHE 355 Cb 0.34 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.79 1fa0 n PHE 355 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1fa0 n PHE 356 N -0.63 0.00 -0.33 1.38 3.01 -0.48 -4.80 117.46 115.60 1fa0 n PHE 356 Ca 0.04 0.00 0.35 0.00 1.01 0.00 0.00 57.45 58.84 1fa0 n PHE 356 Cb 0.02 -0.16 0.73 0.00 -0.01 0.00 0.00 39.48 40.05 1fa0 n PHE 356 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 1fa0 h ARG 357 N -0.12 0.04 -6.24 -1.08 0.11 -1.31 -3.42 114.38 102.35 1fa0 h ARG 357 Ca -0.11 -0.00 -0.60 0.00 0.10 0.00 0.00 59.98 59.37 1fa0 h ARG 357 Cb 1.11 -0.01 -0.09 0.00 1.11 0.00 0.00 29.97 32.10 1fa0 h ARG 357 CO -0.06 0.02 -0.60 0.71 0.10 0.00 0.00 179.97 180.15 1fa0 s TYR 358 N -5.00 3.07 -0.59 4.08 4.12 -1.26 -5.02 117.35 116.76 1fa0 s TYR 358 Ca -0.05 -0.04 0.24 0.00 0.02 0.00 0.00 57.07 57.24 1fa0 s TYR 358 Cb 0.23 -1.50 0.31 0.00 -1.52 0.00 0.00 41.96 39.49 1fa0 s TYR 358 CO 0.81 0.52 1.30 0.87 0.02 0.00 0.00 175.55 179.06 1fa0 h LYS 359 N 2.68 0.00 -3.52 -0.62 1.57 -1.83 -3.41 116.57 111.44 1fa0 h LYS 359 Ca -0.47 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.12 1fa0 h LYS 359 Cb 1.19 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.25 1fa0 h LYS 359 CO 0.62 0.00 -0.57 -0.06 -0.57 0.00 0.00 179.45 178.87 1fa0 s PHE 360 N -3.19 -0.05 0.16 -1.35 0.40 -1.24 -1.60 117.98 111.11 1fa0 s PHE 360 Ca 0.05 0.13 0.04 0.00 -0.60 0.00 0.00 56.93 56.55 1fa0 s PHE 360 Cb 0.13 -0.00 -0.05 0.00 0.51 0.00 0.00 43.02 43.61 1fa0 s PHE 360 CO 0.73 -0.12 -0.08 0.71 0.70 0.00 0.00 175.22 177.15 1fa0 s TYR 361 N -0.41 1.30 -0.15 0.36 1.51 -0.49 -1.02 117.35 118.44 1fa0 s TYR 361 Ca -0.05 -0.80 -0.00 0.00 -1.01 0.00 0.00 57.07 55.21 1fa0 s TYR 361 Cb -0.03 -0.69 0.03 0.00 -0.11 0.00 0.00 41.96 41.16 1fa0 s TYR 361 CO 0.00 0.04 -0.09 -1.17 -1.11 0.00 0.00 175.55 173.22 1fa0 s LEU 362 N -3.19 1.64 -0.03 -1.29 2.96 -0.33 -1.26 118.68 117.17 1fa0 s LEU 362 Ca 0.19 -0.57 -0.20 0.00 -0.22 0.00 0.00 54.13 53.33 1fa0 s LEU 362 Cb 0.03 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.66 1fa0 s LEU 362 CO 0.02 -0.13 0.59 -1.61 -1.32 0.00 0.00 176.35 173.90 1fa0 s GLU 363 N 1.57 4.33 -0.21 1.98 2.02 0.11 -2.09 118.70 126.41 1fa0 s GLU 363 Ca 0.03 0.70 0.00 0.00 0.02 0.00 0.00 54.97 55.72 1fa0 s GLU 363 Cb -0.14 -3.37 0.02 0.00 0.10 0.00 0.00 34.13 30.74 1fa0 s GLU 363 CO -0.09 0.29 -0.14 0.42 0.02 0.00 0.00 175.26 175.76 1fa0 s ILE 364 N 0.10 2.37 -0.06 -1.63 1.01 -0.85 -0.99 121.20 121.15 1fa0 s ILE 364 Ca 0.31 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 59.97 1fa0 s ILE 364 Cb -0.18 -2.11 0.02 0.00 0.01 0.00 0.00 42.46 40.20 1fa0 s ILE 364 CO 0.16 0.38 -0.09 -0.89 0.00 0.00 0.00 174.94 174.50 1fa0 s THR 365 N 1.29 0.86 -0.24 2.92 2.01 0.72 -1.61 115.64 121.59 1fa0 s THR 365 Ca 0.02 -0.31 -0.06 0.00 0.31 0.00 0.00 61.69 61.65 1fa0 s THR 365 Cb -0.15 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 1fa0 s THR 365 CO -0.09 0.30 0.03 0.00 -0.69 0.00 0.00 174.62 174.17 1fa0 s ALA 366 N 0.81 3.04 -0.12 7.40 0.00 -0.74 -0.25 121.76 131.89 1fa0 s ALA 366 Ca -0.12 -1.16 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 1fa0 s ALA 366 Cb -0.15 -1.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.98 1fa0 s ALA 366 CO 0.02 -0.49 0.01 0.71 0.00 0.00 0.00 175.76 176.01 1fa0 s TYR 367 N 1.56 3.17 -0.12 0.00 1.51 0.38 -2.60 117.35 121.26 1fa0 s TYR 367 Ca 0.06 0.08 0.00 0.00 -1.01 0.00 0.00 57.07 56.20 1fa0 s TYR 367 Cb -0.15 -1.90 0.02 0.00 -0.11 0.00 0.00 41.96 39.83 1fa0 s TYR 367 CO 0.01 0.31 -0.10 0.99 -1.11 0.00 0.00 175.55 175.65 1fa0 s THR 368 N -0.35 1.21 -0.95 -0.71 2.01 -0.73 -1.30 115.64 114.82 1fa0 s THR 368 Ca 0.07 -0.41 -0.13 0.00 0.31 0.00 0.00 61.69 61.53 1fa0 s THR 368 Cb -0.12 -1.18 0.23 0.00 0.01 0.00 0.00 72.50 71.43 1fa0 s THR 368 CO 0.02 0.40 0.95 0.00 -0.69 0.00 0.00 174.62 175.30 1fa0 s ARG 369 N 1.55 3.82 0.00 4.92 1.70 0.21 -0.79 118.95 130.37 1fa0 s ARG 369 Ca 0.03 -2.64 0.00 0.00 -0.47 0.00 0.00 55.73 52.65 1fa0 s ARG 369 Cb -0.13 -4.55 0.00 0.00 -0.57 0.00 0.00 34.95 29.70 1fa0 s ARG 369 CO -0.08 -1.35 0.00 0.41 -1.08 0.00 0.00 175.30 173.20 1fa0 n GLY 370 N 3.72 -0.40 3.95 3.88 0.00 -1.18 -4.72 105.19 110.44 1fa0 n GLY 370 Ca 0.19 0.35 -0.20 0.00 0.00 0.00 0.00 46.02 46.36 1fa0 n GLY 370 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fa0 s SER 371 N -4.00 5.16 0.03 1.61 1.04 -1.26 -4.40 113.70 111.88 1fa0 s SER 371 Ca 0.00 -0.75 -0.30 0.00 0.48 0.00 0.00 55.95 55.37 1fa0 s SER 371 Cb 0.00 -0.28 -0.17 0.00 0.10 0.00 0.00 66.02 65.67 1fa0 s SER 371 CO 0.00 -0.88 1.31 0.44 0.98 0.00 0.00 173.24 175.08 1fa0 h ASP 372 N 0.72 -0.87 -0.78 7.02 5.19 -1.99 0.28 116.42 126.00 1fa0 h ASP 372 Ca -0.38 0.01 0.12 0.00 -0.62 0.00 0.00 57.03 56.17 1fa0 h ASP 372 Cb 1.28 0.22 -0.05 0.00 0.18 0.00 0.00 39.33 40.96 1fa0 h ASP 372 CO 0.51 -0.52 0.51 -0.33 -3.12 0.00 0.00 179.24 176.29 1fa0 h GLU 373 N -1.21 0.56 0.00 3.56 5.08 -1.98 0.73 114.58 121.33 1fa0 h GLU 373 Ca -0.10 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.12 1fa0 h GLU 373 Cb 0.80 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1fa0 h GLU 373 CO 0.17 0.37 -0.48 0.37 -1.00 0.00 0.00 179.01 178.45 1fa0 h GLN 374 N 0.58 0.00 0.02 2.33 4.15 -1.92 -3.00 115.11 117.27 1fa0 h GLN 374 Ca 0.37 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 59.50 1fa0 h GLN 374 Cb 0.65 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.30 1fa0 h GLN 374 CO -0.14 0.48 -1.67 1.25 -1.93 0.00 0.00 178.83 176.82 1fa0 h HIS 375 N 0.00 0.08 -0.01 3.99 2.76 0.17 -3.29 115.15 118.86 1fa0 h HIS 375 Ca -0.00 -0.06 -0.04 0.00 -2.20 0.00 0.00 60.37 58.06 1fa0 h HIS 375 Cb 0.90 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.85 1fa0 h HIS 375 CO 0.00 1.11 -0.21 1.25 -1.30 0.00 0.00 177.93 178.79 1fa0 h LEU 376 N 0.01 0.01 -0.02 0.26 5.85 0.33 0.14 115.31 121.90 1fa0 h LEU 376 Ca -0.28 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 1fa0 h LEU 376 Cb 2.00 -0.00 0.01 0.00 0.37 0.00 0.00 40.66 43.03 1fa0 h LEU 376 CO 0.09 0.22 -0.37 0.11 -0.34 0.00 0.00 178.44 178.15 1fa0 h LYS 377 N 0.01 0.28 0.27 1.25 6.56 -1.66 -1.17 116.57 122.11 1fa0 h LYS 377 Ca -0.00 -0.28 -0.01 0.00 -1.06 0.00 0.00 60.65 59.30 1fa0 h LYS 377 Cb 0.37 0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 1fa0 h LYS 377 CO 0.03 0.97 -0.13 2.35 -2.06 0.00 0.00 179.45 180.61 1fa0 h TRP 378 N -0.30 -0.34 -0.62 -1.35 -0.00 -1.56 -1.44 115.95 110.34 1fa0 h TRP 378 Ca -0.04 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.89 58.75 1fa0 h TRP 378 Cb 1.08 0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 30.33 1fa0 h TRP 378 CO 0.16 -0.03 0.03 0.66 -0.00 0.00 0.00 178.44 179.25 1fa0 h SER 379 N -0.65 1.04 -0.88 2.65 4.64 -0.86 -2.44 113.55 117.06 1fa0 h SER 379 Ca -0.04 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 1fa0 h SER 379 Cb 0.46 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 62.23 1fa0 h SER 379 CO 0.06 1.08 0.51 1.23 -0.87 0.00 0.00 176.83 178.85 1fa0 h GLY 380 N 0.97 1.29 2.00 -0.77 0.00 -1.23 0.07 103.07 105.40 1fa0 h GLY 380 Ca 0.18 -0.55 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 1fa0 h GLY 380 CO 0.03 0.53 -0.22 -2.00 0.00 0.00 0.00 176.54 174.88 1fa0 h LEU 381 N 1.22 0.00 0.08 3.11 6.46 -1.02 -3.03 115.31 122.14 1fa0 h LEU 381 Ca 0.31 0.00 -0.29 0.00 -0.12 0.00 0.00 57.88 57.79 1fa0 h LEU 381 Cb -0.02 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 1fa0 h LEU 381 CO -0.06 0.22 -1.53 0.58 -0.62 0.00 0.00 178.44 177.03 1fa0 h VAL 382 N 0.00 0.88 0.00 1.05 2.07 -0.80 -3.30 116.25 116.15 1fa0 h VAL 382 Ca -0.00 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.20 1fa0 h VAL 382 Cb 0.58 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1fa0 h VAL 382 CO 0.03 0.65 0.00 -1.84 0.02 0.00 0.00 177.57 176.43 1fa0 n GLU 383 N -3.95 0.07 0.02 1.57 0.28 -0.09 -2.63 120.64 115.91 1fa0 n GLU 383 Ca -0.29 0.46 -0.01 0.00 -0.16 0.00 0.00 57.16 57.16 1fa0 n GLU 383 Cb 0.88 -1.67 -0.00 0.00 1.43 0.00 0.00 31.44 32.07 1fa0 n GLU 383 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1fa0 h SER 384 N 0.00 -0.06 0.00 -1.84 4.64 -1.63 -3.32 113.55 111.34 1fa0 h SER 384 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fa0 h SER 384 Cb 0.12 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1fa0 h SER 384 CO 0.00 0.07 0.07 0.29 -0.87 0.00 0.00 176.83 176.39 1fa0 n LYS 385 N -2.81 0.00 -0.19 4.77 4.01 -1.08 -2.94 118.16 119.92 1fa0 n LYS 385 Ca -0.01 0.27 0.18 0.00 -0.51 0.00 0.00 58.31 58.24 1fa0 n LYS 385 Cb 0.03 -1.57 0.52 0.00 -0.51 0.00 0.00 35.03 33.50 1fa0 n LYS 385 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1fa0 h VAL 386 N 0.00 0.73 -0.32 -0.18 2.07 -1.63 0.25 116.25 117.17 1fa0 h VAL 386 Ca 0.00 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1fa0 h VAL 386 Cb 0.15 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1fa0 h VAL 386 CO 0.00 0.07 0.19 -0.09 0.02 0.00 0.00 177.57 177.75 1fa0 h ARG 387 N 0.38 0.37 -0.71 1.57 2.43 -1.76 -2.07 114.38 114.60 1fa0 h ARG 387 Ca 0.41 -0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.70 1fa0 h ARG 387 Cb 1.03 -0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.41 1fa0 h ARG 387 CO -0.14 0.24 0.23 -0.07 -1.51 0.00 0.00 179.97 178.73 1fa0 h LEU 388 N 0.38 0.15 -0.35 3.80 4.07 -0.75 -2.16 115.31 120.44 1fa0 h LEU 388 Ca 0.13 0.12 -0.04 0.00 0.08 0.00 0.00 57.88 58.17 1fa0 h LEU 388 Cb 0.01 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 1fa0 h LEU 388 CO -0.06 0.05 0.07 0.25 -1.08 0.00 0.00 178.44 177.67 1fa0 h LEU 389 N 0.36 0.55 -0.94 1.67 5.85 -1.22 -2.73 115.31 118.85 1fa0 h LEU 389 Ca 0.39 -0.25 0.18 0.00 0.84 0.00 0.00 57.88 59.04 1fa0 h LEU 389 Cb 0.60 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.38 1fa0 h LEU 389 CO -0.42 0.66 0.52 0.58 -0.34 0.00 0.00 178.44 179.44 1fa0 h VAL 390 N 0.42 0.69 -0.65 1.05 2.07 -0.75 -1.04 116.25 118.05 1fa0 h VAL 390 Ca 0.11 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1fa0 h VAL 390 Cb 0.33 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 1fa0 h VAL 390 CO 0.00 0.12 0.27 0.24 0.02 0.00 0.00 177.57 178.23 1fa0 h MET 391 N 0.67 0.96 0.24 1.57 2.86 -1.17 0.11 114.93 120.16 1fa0 h MET 391 Ca 0.54 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 58.00 1fa0 h MET 391 Cb 0.83 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1fa0 h MET 391 CO -0.39 0.80 -0.11 0.87 1.06 0.00 0.00 176.91 179.13 1fa0 h LYS 392 N 0.91 -0.31 -0.82 1.72 1.57 -1.23 -3.21 116.57 115.20 1fa0 h LYS 392 Ca 0.22 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 59.13 1fa0 h LYS 392 Cb 0.19 0.07 -0.13 0.00 0.08 0.00 0.00 32.23 32.44 1fa0 h LYS 392 CO -0.02 -0.21 -0.35 1.28 -0.57 0.00 0.00 179.45 179.59 1fa0 n LEU 393 N -3.14 -0.59 0.30 2.94 4.32 -0.47 -1.25 117.00 119.11 1fa0 n LEU 393 Ca -0.04 1.43 0.17 0.00 -0.02 0.00 0.00 56.01 57.55 1fa0 n LEU 393 Cb 0.13 -0.30 0.97 0.00 -1.62 0.00 0.00 43.42 42.59 1fa0 n LEU 393 CO 0.10 -1.26 1.13 1.05 -1.22 0.00 0.00 177.39 177.18 1fa0 h GLU 394 N 0.00 0.00 0.00 3.23 4.11 -0.86 -3.15 114.58 117.91 1fa0 h GLU 394 Ca 0.26 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.59 1fa0 h GLU 394 Cb 0.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1fa0 h GLU 394 CO -0.80 0.01 -1.99 1.55 0.07 0.00 0.00 179.01 177.84 1fa0 n VAL 395 N -3.67 0.44 -1.81 -1.06 3.14 -0.38 -4.82 118.33 110.16 1fa0 n VAL 395 Ca -0.03 -0.60 -0.29 0.00 -2.96 0.00 0.00 64.34 60.46 1fa0 n VAL 395 Cb 0.09 -0.17 0.12 0.00 -1.06 0.00 0.00 33.84 32.81 1fa0 n VAL 395 CO 0.00 0.00 0.00 -1.48 -6.46 0.00 0.00 176.83 168.89 1fa0 s LEU 396 N -4.88 2.39 0.00 6.55 0.05 -1.15 -4.96 118.68 116.68 1fa0 s LEU 396 Ca -0.08 0.74 0.00 0.00 0.05 0.00 0.00 54.13 54.84 1fa0 s LEU 396 Cb 0.11 -3.11 0.00 0.00 -2.05 0.00 0.00 46.19 41.14 1fa0 s LEU 396 CO 0.88 -2.21 0.00 0.00 -0.55 0.00 0.00 176.35 174.47 1fa0 n ALA 397 N -3.51 0.00 -1.73 1.48 0.00 -1.26 -2.98 120.51 112.51 1fa0 n ALA 397 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.28 1fa0 n ALA 397 Cb 0.60 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.12 1fa0 n ALA 397 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fa0 n GLY 398 N 0.00 6.04 3.60 0.00 0.00 -1.26 -4.99 105.19 108.59 1fa0 n GLY 398 Ca 0.00 -2.36 -0.43 0.00 0.00 0.00 0.00 46.02 43.23 1fa0 n GLY 398 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fa0 s ILE 399 N -4.50 4.03 0.39 -0.61 1.09 -1.16 -0.63 121.20 119.81 1fa0 s ILE 399 Ca 0.55 1.06 0.13 0.00 -1.10 0.00 0.00 60.65 61.29 1fa0 s ILE 399 Cb 0.44 -4.32 0.12 0.00 -1.06 0.00 0.00 42.46 37.63 1fa0 s ILE 399 CO 0.02 -0.80 1.87 0.50 -0.10 0.00 0.00 174.94 176.43 1fa0 h LYS 400 N 10.08 0.00 -1.13 2.79 3.64 -1.46 -3.46 116.57 127.03 1fa0 h LYS 400 Ca -0.26 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.34 1fa0 h LYS 400 Cb 1.09 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 32.64 1fa0 h LYS 400 CO 1.09 0.32 0.90 -1.50 -2.27 0.00 0.00 179.45 177.99 1fa0 s ILE 401 N -4.29 0.00 -0.52 2.00 2.07 -1.15 -5.01 121.20 114.29 1fa0 s ILE 401 Ca -0.03 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.28 1fa0 s ILE 401 Cb 0.15 -1.00 0.27 0.00 0.13 0.00 0.00 42.46 42.01 1fa0 s ILE 401 CO 0.72 0.00 0.69 0.00 -1.91 0.00 0.00 174.94 174.44 1fa0 n ALA 402 N 0.56 3.38 -1.75 1.50 0.00 -1.26 -2.85 120.51 120.09 1fa0 n ALA 402 Ca -0.02 -4.16 -0.42 0.00 0.00 0.00 0.00 53.44 48.84 1fa0 n ALA 402 Cb 0.59 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 1fa0 n ALA 402 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1fa0 s HIS 403 N -2.15 1.43 0.04 0.00 2.46 -0.84 -4.82 115.29 111.42 1fa0 s HIS 403 Ca 0.39 -0.04 -0.21 0.00 0.47 0.00 0.00 55.06 55.67 1fa0 s HIS 403 Cb 0.19 -4.10 -0.06 0.00 -0.13 0.00 0.00 32.58 28.48 1fa0 s HIS 403 CO -0.07 -4.73 0.62 -2.14 -2.47 0.00 0.00 174.74 165.95 1fa0 s PRO 404 N 4.86 4.31 0.28 2.88 0.02 -1.26 0.37 135.00 146.47 1fa0 s PRO 404 Ca 0.87 0.80 -0.23 0.00 0.02 0.00 0.00 61.00 62.46 1fa0 s PRO 404 Cb -0.37 -3.30 -0.09 0.00 0.02 0.00 0.00 34.50 30.75 1fa0 s PRO 404 CO 0.37 0.47 0.84 0.12 -0.33 0.00 0.00 177.00 178.47 1fa0 s PHE 405 N -0.57 3.66 -1.40 6.54 5.36 0.47 -4.94 117.98 127.10 1fa0 s PHE 405 Ca 0.31 1.60 0.23 0.00 -0.96 0.00 0.00 56.93 58.11 1fa0 s PHE 405 Cb -0.19 -2.78 1.13 0.00 -0.34 0.00 0.00 43.02 40.84 1fa0 s PHE 405 CO 0.19 0.26 1.74 0.25 -1.46 0.00 0.00 175.22 176.20 1fa0 n THR 406 N 0.59 0.30 -4.15 0.12 -2.24 -1.26 -4.72 114.28 102.92 1fa0 n THR 406 Ca 0.00 0.07 -0.14 0.00 -2.27 0.00 0.00 64.05 61.71 1fa0 n THR 406 Cb 0.51 -0.70 -0.11 0.00 -2.10 0.00 0.00 70.33 67.93 1fa0 n THR 406 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1fa0 s LYS 407 N -2.60 0.78 -0.07 -0.78 3.01 -1.26 -4.91 119.74 113.91 1fa0 s LYS 407 Ca 0.21 -1.07 -0.03 0.00 -1.01 0.00 0.00 55.97 54.07 1fa0 s LYS 407 Cb 0.15 -0.50 -0.04 0.00 -1.01 0.00 0.00 37.83 36.43 1fa0 s LYS 407 CO 0.35 0.08 0.08 -1.25 0.51 0.00 0.00 175.35 175.12 1fa0 s PRO 408 N -2.50 3.18 -0.32 -1.68 0.04 -1.26 -4.56 135.00 127.90 1fa0 s PRO 408 Ca 0.02 -0.33 -0.12 0.00 0.04 0.00 0.00 61.00 60.61 1fa0 s PRO 408 Cb -0.05 -2.96 -0.02 0.00 0.04 0.00 0.00 34.50 31.51 1fa0 s PRO 408 CO 0.00 0.71 0.21 -0.06 0.04 0.00 0.00 177.00 177.90 1fa0 s PHE 409 N -1.04 3.21 0.07 0.56 0.40 0.11 -4.86 117.98 116.43 1fa0 s PHE 409 Ca 0.17 -0.19 0.07 0.00 -0.60 0.00 0.00 56.93 56.38 1fa0 s PHE 409 Cb -0.12 -2.43 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 1fa0 s PHE 409 CO 0.07 -0.33 -0.14 -1.21 0.70 0.00 0.00 175.22 174.31 1fa0 s GLU 410 N 1.71 2.10 -0.05 0.44 2.02 -1.26 -1.01 118.70 122.65 1fa0 s GLU 410 Ca 0.06 -0.99 -0.30 0.00 0.02 0.00 0.00 54.97 53.76 1fa0 s GLU 410 Cb -0.17 -2.25 0.08 0.00 0.10 0.00 0.00 34.13 31.89 1fa0 s GLU 410 CO 0.10 0.53 0.74 -1.54 0.02 0.00 0.00 175.26 175.11 1fa0 s SER 411 N -1.78 -0.58 0.11 -0.19 1.04 -0.79 -5.00 113.70 106.51 1fa0 s SER 411 Ca 0.17 0.57 0.03 0.00 0.48 0.00 0.00 55.95 57.20 1fa0 s SER 411 Cb -0.11 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 1fa0 s SER 411 CO 0.09 -0.59 -0.09 -0.94 0.98 0.00 0.00 173.24 172.69 1fa0 s SER 412 N -1.36 1.41 0.11 7.02 1.04 -1.26 -0.67 113.70 119.99 1fa0 s SER 412 Ca -0.08 -0.91 -0.00 0.00 0.48 0.00 0.00 55.95 55.45 1fa0 s SER 412 Cb -0.00 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 1fa0 s SER 412 CO 0.06 -0.34 0.00 -0.31 0.98 0.00 0.00 173.24 173.63 1fa0 s TYR 413 N -2.97 0.82 -0.41 5.02 1.51 -0.79 -1.48 117.35 119.05 1fa0 s TYR 413 Ca 0.09 -1.10 -0.22 0.00 -1.01 0.00 0.00 57.07 54.83 1fa0 s TYR 413 Cb 0.01 -0.49 0.02 0.00 -0.11 0.00 0.00 41.96 41.38 1fa0 s TYR 413 CO -0.01 -0.37 0.75 0.00 -1.11 0.00 0.00 175.55 174.81 1fa0 n PRO 416 N 4.06 0.00 -4.21 0.00 -0.02 -1.26 -4.69 135.00 128.88 1fa0 n PRO 416 Ca 0.07 0.61 -0.25 0.00 -2.02 0.00 0.00 63.50 61.91 1fa0 n PRO 416 Cb 0.43 -1.31 -0.08 0.00 -0.02 0.00 0.00 33.50 32.52 1fa0 n PRO 416 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1fa0 s THR 417 N -2.25 2.36 -1.25 3.45 -1.32 -1.26 -5.01 115.64 110.35 1fa0 s THR 417 Ca 0.00 -1.77 0.14 0.00 -1.21 0.00 0.00 61.69 58.85 1fa0 s THR 417 Cb 0.00 -2.97 0.19 0.00 -1.51 0.00 0.00 72.50 68.21 1fa0 s THR 417 CO 0.00 -0.04 1.41 -1.84 -2.21 0.00 0.00 174.62 171.94 1fa0 n GLU 418 N -1.16 0.12 -0.04 7.08 0.28 -1.26 -2.19 120.64 123.46 1fa0 n GLU 418 Ca -0.02 0.20 -0.13 0.00 -0.16 0.00 0.00 57.16 57.05 1fa0 n GLU 418 Cb 0.64 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.93 1fa0 n GLU 418 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1fa0 h ASP 419 N 0.00 0.23 -0.52 -1.84 3.32 -1.98 -2.92 116.42 112.71 1fa0 h ASP 419 Ca 0.00 -0.48 0.01 0.00 0.02 0.00 0.00 57.03 56.58 1fa0 h ASP 419 Cb 0.18 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1fa0 h ASP 419 CO 0.00 0.67 0.33 0.44 -1.72 0.00 0.00 179.24 178.96 1fa0 h ASP 420 N -0.20 0.56 -0.52 6.45 3.32 -1.85 -2.83 116.42 121.35 1fa0 h ASP 420 Ca 0.01 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.15 1fa0 h ASP 420 Cb 0.60 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 39.95 1fa0 h ASP 420 CO 0.02 0.40 0.10 0.22 -1.72 0.00 0.00 179.24 178.26 1fa0 h TYR 421 N 0.67 0.15 0.00 4.55 3.20 -1.54 0.52 116.97 124.52 1fa0 h TYR 421 Ca 0.20 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1fa0 h TYR 421 Cb -0.04 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 1fa0 h TYR 421 CO -0.05 -0.02 -0.01 1.49 -1.64 0.00 0.00 178.16 177.93 1fa0 h GLU 422 N 0.23 0.00 0.15 1.82 4.57 -1.30 -2.27 114.58 117.77 1fa0 h GLU 422 Ca 0.26 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.23 1fa0 h GLU 422 Cb 0.37 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.98 1fa0 h GLU 422 CO -0.35 0.01 -0.92 1.98 -1.18 0.00 0.00 179.01 178.55 1fa0 h MET 423 N 0.00 0.37 -0.88 1.92 4.05 -0.86 -3.22 114.93 116.31 1fa0 h MET 423 Ca -0.00 -0.59 0.13 0.00 -0.28 0.00 0.00 59.70 58.96 1fa0 h MET 423 Cb 0.04 0.21 -0.07 0.00 -0.80 0.00 0.00 31.60 30.99 1fa0 h MET 423 CO 0.00 1.27 0.57 0.82 0.23 0.00 0.00 176.91 179.80 1fa0 h ILE 424 N -0.23 0.88 -0.55 1.77 2.04 -0.73 0.18 117.51 120.86 1fa0 h ILE 424 Ca -0.16 -0.25 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 1fa0 h ILE 424 Cb 1.71 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1fa0 h ILE 424 CO 0.17 0.13 -0.08 1.56 0.00 0.00 0.00 178.15 179.94 1fa0 h GLN 425 N 0.74 1.02 0.00 2.37 4.20 -1.56 -2.01 115.11 119.87 1fa0 h GLN 425 Ca 0.43 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1fa0 h GLN 425 Cb 0.62 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1fa0 h GLN 425 CO -0.19 1.05 -1.10 -0.40 -0.67 0.00 0.00 178.83 177.52 1fa0 n ASP 426 N -4.15 0.60 0.00 1.46 5.75 -0.84 -4.22 116.55 115.16 1fa0 n ASP 426 Ca 0.02 -0.04 0.11 0.00 -0.01 0.00 0.00 54.79 54.86 1fa0 n ASP 426 Cb 0.39 0.80 -0.10 0.00 -1.03 0.00 0.00 41.12 41.17 1fa0 n ASP 426 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1fa0 n LYS 427 N -2.16 0.32 -3.36 0.11 4.76 -0.01 -4.91 118.16 112.91 1fa0 n LYS 427 Ca 0.01 -0.07 -0.38 0.00 -2.87 0.00 0.00 58.31 55.00 1fa0 n LYS 427 Cb 0.48 -1.54 -0.06 0.00 -1.84 0.00 0.00 35.03 32.07 1fa0 n LYS 427 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1fa0 s TYR 428 N -3.24 3.68 0.00 2.13 5.04 -0.76 -2.07 117.35 122.13 1fa0 s TYR 428 Ca 0.01 1.06 0.00 0.00 -2.44 0.00 0.00 57.07 55.70 1fa0 s TYR 428 Cb 0.15 -2.45 0.00 0.00 0.35 0.00 0.00 41.96 40.01 1fa0 s TYR 428 CO 0.87 0.46 0.00 0.41 -1.34 0.00 0.00 175.55 175.95 1fa0 n GLY 429 N 2.27 3.42 3.74 8.97 0.00 -1.26 -4.92 105.19 117.41 1fa0 n GLY 429 Ca -0.10 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 1fa0 n GLY 429 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fa0 s SER 430 N 0.00 4.83 0.28 1.61 1.04 -1.26 -4.08 113.70 116.11 1fa0 s SER 430 Ca 0.00 -0.66 0.14 0.00 0.48 0.00 0.00 55.95 55.91 1fa0 s SER 430 Cb 0.00 -0.85 0.28 0.00 0.10 0.00 0.00 66.02 65.55 1fa0 s SER 430 CO 0.00 -0.22 1.55 -0.74 0.98 0.00 0.00 173.24 174.80 1fa0 h HIS 431 N 1.56 0.00 0.10 5.02 2.76 -1.54 -0.58 115.15 122.47 1fa0 h HIS 431 Ca -0.44 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 57.73 1fa0 h HIS 431 Cb 1.25 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.19 1fa0 h HIS 431 CO 0.62 0.59 -0.14 0.87 -1.30 0.00 0.00 177.93 178.57 1fa0 h LYS 432 N 0.00 -0.27 0.00 5.26 6.56 -1.95 -3.24 116.57 122.93 1fa0 h LYS 432 Ca -0.01 0.02 -0.18 0.00 -1.06 0.00 0.00 60.65 59.43 1fa0 h LYS 432 Cb 1.24 0.06 -0.03 0.00 -0.57 0.00 0.00 32.23 32.93 1fa0 h LYS 432 CO 0.08 -0.18 -1.56 0.25 -2.06 0.00 0.00 179.45 175.97 1fa0 n THR 433 N -5.26 1.12 -0.21 -0.16 -2.24 -1.24 -4.57 114.28 101.71 1fa0 n THR 433 Ca -0.07 -0.69 0.05 0.00 -2.27 0.00 0.00 64.05 61.06 1fa0 n THR 433 Cb 0.18 -0.65 0.10 0.00 -2.10 0.00 0.00 70.33 67.86 1fa0 n THR 433 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1fa0 n GLU 434 N -2.82 -0.05 0.15 -0.78 2.13 -0.23 0.67 120.64 119.71 1fa0 n GLU 434 Ca -0.12 0.92 0.11 0.00 0.66 0.00 0.00 57.16 58.73 1fa0 n GLU 434 Cb 0.85 -1.40 0.55 0.00 0.27 0.00 0.00 31.44 31.72 1fa0 n GLU 434 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1fa0 n THR 435 N -4.93 1.06 -0.04 6.31 -2.24 -1.26 -2.06 114.28 111.11 1fa0 n THR 435 Ca 0.10 0.67 0.01 0.00 -2.27 0.00 0.00 64.05 62.56 1fa0 n THR 435 Cb 0.33 -1.66 0.32 0.00 -2.10 0.00 0.00 70.33 67.21 1fa0 n THR 435 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fa0 h ALA 436 N 2.03 1.47 0.00 6.98 0.00 -0.06 -2.29 119.26 127.38 1fa0 h ALA 436 Ca 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1fa0 h ALA 436 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1fa0 h ALA 436 CO 0.00 0.41 -0.31 -0.07 0.00 0.00 0.00 179.25 179.28 1fa0 h LEU 437 N 0.61 0.00 -1.44 0.00 4.07 -1.59 -3.02 115.31 113.93 1fa0 h LEU 437 Ca 0.15 0.00 0.25 0.00 0.08 0.00 0.00 57.88 58.36 1fa0 h LEU 437 Cb 0.15 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.86 1fa0 h LEU 437 CO -0.01 0.31 0.95 0.78 -1.08 0.00 0.00 178.44 179.39 1fa0 h ASN 438 N 0.00 0.00 0.30 -0.43 2.35 -1.57 -1.49 115.58 114.73 1fa0 h ASN 438 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1fa0 h ASN 438 Cb 0.59 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 1fa0 h ASN 438 CO 0.04 0.00 -0.22 0.00 -1.65 0.00 0.00 177.43 175.60 1fa0 h ALA 439 N 0.91 -1.01 -2.96 -0.83 0.00 -1.72 -3.43 119.26 110.21 1fa0 h ALA 439 Ca 0.41 -0.10 -0.56 0.00 0.00 0.00 0.00 54.91 54.66 1fa0 h ALA 439 Cb 2.31 0.38 0.15 0.00 0.00 0.00 0.00 17.79 20.62 1fa0 h ALA 439 CO -0.00 -1.00 0.49 1.28 0.00 0.00 0.00 179.25 180.02 1fa0 n LEU 440 N -3.65 5.11 -4.62 0.00 4.32 -0.56 -4.87 117.00 112.72 1fa0 n LEU 440 Ca -0.06 0.94 -0.43 0.00 -0.02 0.00 0.00 56.01 56.45 1fa0 n LEU 440 Cb 0.21 -1.53 -0.03 0.00 -1.62 0.00 0.00 43.42 40.45 1fa0 n LEU 440 CO 0.14 -0.87 1.61 -1.59 -1.22 0.00 0.00 177.39 175.46 1fa0 s LYS 441 N -2.85 3.56 -0.53 3.23 0.00 -1.26 -4.89 119.74 117.00 1fa0 s LYS 441 Ca 0.73 1.94 -0.27 0.00 0.00 0.00 0.00 55.97 58.36 1fa0 s LYS 441 Cb -0.42 -4.20 -0.01 0.00 0.00 0.00 0.00 37.83 33.19 1fa0 s LYS 441 CO 0.49 -1.60 1.77 -1.17 0.00 0.00 0.00 175.35 174.84 1fa0 s LEU 442 N 6.40 3.37 -0.61 2.77 2.96 -1.26 -2.14 118.68 130.17 1fa0 s LEU 442 Ca 0.86 0.58 -0.27 0.00 -0.22 0.00 0.00 54.13 55.08 1fa0 s LEU 442 Cb -0.31 -2.87 -0.11 0.00 0.50 0.00 0.00 46.19 43.40 1fa0 s LEU 442 CO 0.34 -2.10 2.48 0.52 -1.32 0.00 0.00 176.35 176.28 1fa0 n VAL 443 N 7.21 -0.07 1.94 1.68 0.31 -0.55 -4.99 118.33 123.86 1fa0 n VAL 443 Ca 0.20 -0.62 0.15 0.00 -0.01 0.00 0.00 64.34 64.06 1fa0 n VAL 443 Cb 0.50 -2.26 0.84 0.00 -0.91 0.00 0.00 33.84 32.01 1fa0 n VAL 443 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1fa0 n THR 444 N 7.89 0.00 -0.24 2.52 -2.24 -1.26 -4.56 114.28 116.40 1fa0 n THR 444 Ca 0.44 -0.03 -0.09 0.00 -2.27 0.00 0.00 64.05 62.10 1fa0 n THR 444 Cb 0.43 -0.36 -0.01 0.00 -2.10 0.00 0.00 70.33 68.28 1fa0 n THR 444 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1fa0 n PRO 457 N -0.84 0.00 -4.55 -0.78 -0.02 -1.26 -5.20 135.00 122.35 1fa0 n PRO 457 Ca 0.22 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.44 1fa0 n PRO 457 Cb 0.13 -0.22 -0.10 0.00 -0.02 0.00 0.00 33.50 33.29 1fa0 n PRO 457 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1fa0 s LYS 458 N 0.19 1.85 -0.02 -0.52 1.02 -1.26 -0.55 119.74 120.45 1fa0 s LYS 458 Ca 0.15 -2.08 -0.07 0.00 0.02 0.00 0.00 55.97 53.99 1fa0 s LYS 458 Cb -0.20 -1.11 0.01 0.00 -0.52 0.00 0.00 37.83 36.00 1fa0 s LYS 458 CO 0.10 -0.23 0.15 0.00 -0.92 0.00 0.00 175.35 174.46 1fa0 s ALA 459 N -3.08 -0.37 0.16 5.17 0.00 -0.47 -3.11 121.76 120.06 1fa0 s ALA 459 Ca 0.30 0.08 0.10 0.00 0.00 0.00 0.00 51.96 52.43 1fa0 s ALA 459 Cb 0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 1fa0 s ALA 459 CO 0.14 -0.17 -0.22 0.71 0.00 0.00 0.00 175.76 176.22 1fa0 s TYR 460 N -0.91 2.09 -0.05 0.00 1.51 0.03 -1.89 117.35 118.14 1fa0 s TYR 460 Ca -0.10 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1fa0 s TYR 460 Cb -0.05 -1.07 0.01 0.00 -0.11 0.00 0.00 41.96 40.73 1fa0 s TYR 460 CO 0.01 0.39 -0.13 -0.51 -1.11 0.00 0.00 175.55 174.21 1fa0 s LEU 461 N -2.48 1.76 -0.10 -1.29 1.02 0.15 -1.77 118.68 115.98 1fa0 s LEU 461 Ca 0.16 -0.28 -0.00 0.00 0.02 0.00 0.00 54.13 54.03 1fa0 s LEU 461 Cb -0.08 -0.78 0.02 0.00 0.02 0.00 0.00 46.19 45.38 1fa0 s LEU 461 CO 0.08 0.08 -0.06 -0.44 0.02 0.00 0.00 176.35 176.03 1fa0 s SER 462 N 0.33 1.95 -0.05 2.29 0.01 -1.07 -1.89 113.70 115.27 1fa0 s SER 462 Ca -0.08 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 56.97 1fa0 s SER 462 Cb -0.12 -0.72 0.01 0.00 0.21 0.00 0.00 66.02 65.39 1fa0 s SER 462 CO 0.02 -0.13 -0.14 -0.89 0.41 0.00 0.00 173.24 172.51 1fa0 s THR 463 N 1.68 1.25 -0.05 1.44 2.01 -0.18 -1.80 115.64 119.99 1fa0 s THR 463 Ca 0.03 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.47 1fa0 s THR 463 Cb -0.13 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1fa0 s THR 463 CO -0.06 0.37 -0.09 -0.04 -0.69 0.00 0.00 174.62 174.11 1fa0 s MET 464 N 0.36 2.62 -0.14 4.92 -1.94 -0.63 0.07 119.30 124.55 1fa0 s MET 464 Ca -0.09 -0.64 -0.02 0.00 -1.71 0.00 0.00 55.69 53.23 1fa0 s MET 464 Cb -0.13 -2.50 -0.02 0.00 2.01 0.00 0.00 34.83 34.19 1fa0 s MET 464 CO 0.03 0.64 -0.09 0.71 -0.01 0.00 0.00 175.02 176.30 1fa0 s TYR 465 N -0.83 2.90 -0.32 -0.03 1.51 -1.26 -2.01 117.35 117.32 1fa0 s TYR 465 Ca 0.13 -0.50 -0.02 0.00 -1.01 0.00 0.00 57.07 55.67 1fa0 s TYR 465 Cb -0.11 -1.89 0.06 0.00 -0.11 0.00 0.00 41.96 39.91 1fa0 s TYR 465 CO 0.02 -0.14 0.04 0.42 -1.11 0.00 0.00 175.55 174.78 1fa0 s ILE 466 N 0.34 3.11 0.40 2.71 1.01 -0.89 -0.40 121.20 127.49 1fa0 s ILE 466 Ca -0.08 -1.43 -0.26 0.00 0.00 0.00 0.00 60.65 58.87 1fa0 s ILE 466 Cb -0.15 -2.83 -0.09 0.00 0.01 0.00 0.00 42.46 39.40 1fa0 s ILE 466 CO 0.05 -0.18 1.29 -0.83 0.00 0.00 0.00 174.94 175.27 1fa0 s GLY 467 N 1.33 2.93 -0.04 6.18 0.00 0.16 -1.19 107.32 116.68 1fa0 s GLY 467 Ca -0.03 1.22 0.02 0.00 0.00 0.00 0.00 44.72 45.93 1fa0 s GLY 467 CO -0.01 1.80 -0.10 1.08 0.00 0.00 0.00 173.10 175.88 1fa0 s LEU 468 N -2.37 1.66 -0.14 0.66 1.43 -0.19 -1.99 118.68 117.74 1fa0 s LEU 468 Ca 0.56 -0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 53.42 1fa0 s LEU 468 Cb -0.38 -0.65 0.04 0.00 0.03 0.00 0.00 46.19 45.24 1fa0 s LEU 468 CO 0.49 0.04 0.01 -0.62 0.23 0.00 0.00 176.35 176.49 1fa0 s ASP 469 N 0.47 2.33 0.78 2.29 2.15 -1.13 -3.66 116.67 119.90 1fa0 s ASP 469 Ca -0.09 -0.48 -0.10 0.00 0.43 0.00 0.00 52.55 52.31 1fa0 s ASP 469 Cb -0.12 -0.57 0.08 0.00 -0.30 0.00 0.00 42.92 42.01 1fa0 s ASP 469 CO 0.02 -0.24 1.12 -0.36 -0.17 0.00 0.00 175.17 175.54 1fa0 s PHE 470 N 1.88 2.81 -0.37 -5.34 0.40 -1.26 -1.36 117.98 114.74 1fa0 s PHE 470 Ca 0.02 0.58 0.01 0.00 -0.60 0.00 0.00 56.93 56.94 1fa0 s PHE 470 Cb -0.15 -3.42 0.12 0.00 0.51 0.00 0.00 43.02 40.08 1fa0 s PHE 470 CO -0.07 -1.70 0.16 1.21 0.70 0.00 0.00 175.22 175.52 1fa0 s ASN 471 N -4.58 3.93 -0.91 1.36 3.84 0.20 -4.55 114.94 114.23 1fa0 s ASN 471 Ca 0.62 -2.13 -0.25 0.00 0.21 0.00 0.00 52.86 51.32 1fa0 s ASN 471 Cb -0.10 -1.01 -0.07 0.00 -0.55 0.00 0.00 41.25 39.52 1fa0 s ASN 471 CO 0.48 -0.35 2.02 0.27 -2.79 0.00 0.00 177.10 176.72 1fa0 s ILE 472 N 0.99 3.39 0.00 -5.21 -5.25 -1.26 -4.82 121.20 109.03 1fa0 s ILE 472 Ca 0.13 -0.35 0.00 0.00 -0.99 0.00 0.00 60.65 59.44 1fa0 s ILE 472 Cb -0.21 -3.90 0.00 0.00 2.95 0.00 0.00 42.46 41.30 1fa0 s ILE 472 CO -0.12 -0.80 0.00 1.33 -1.79 0.00 0.00 174.94 173.56 1fa0 n VAL 479 N 8.02 0.00 -2.64 8.37 0.24 -1.26 -5.24 118.33 125.83 1fa0 n VAL 479 Ca 0.41 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.28 1fa0 n VAL 479 Cb 0.46 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 1fa0 n VAL 479 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1fa0 s ASP 480 N 0.00 6.92 0.00 -1.34 3.84 -1.26 -4.86 116.67 119.96 1fa0 s ASP 480 Ca 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 52.55 53.57 1fa0 s ASP 480 Cb 0.00 -2.54 0.00 0.00 -1.38 0.00 0.00 42.92 39.00 1fa0 s ASP 480 CO 0.00 -0.90 0.00 -0.38 -0.00 0.00 0.00 175.17 173.89 1fa0 n ILE 481 N 5.92 0.00 -0.32 2.11 5.41 -1.26 -4.76 119.36 126.45 1fa0 n ILE 481 Ca 0.12 0.00 0.21 0.00 1.00 0.00 0.00 62.75 64.08 1fa0 n ILE 481 Cb 0.47 0.41 0.42 0.00 -0.71 0.00 0.00 39.64 40.24 1fa0 n ILE 481 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 1fa0 h HIS 482 N 0.00 0.60 0.09 1.39 2.76 -2.01 -2.62 115.15 115.37 1fa0 h HIS 482 Ca 0.00 0.05 0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1fa0 h HIS 482 Cb 0.03 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 28.86 1fa0 h HIS 482 CO 0.00 -0.29 -0.34 0.82 -1.30 0.00 0.00 177.93 176.82 1fa0 h ILE 483 N 0.17 0.00 -0.54 6.26 5.03 -2.01 -2.63 117.51 123.79 1fa0 h ILE 483 Ca 0.69 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 65.41 1fa0 h ILE 483 Cb 1.59 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 35.35 1fa0 h ILE 483 CO -0.71 0.00 0.24 1.55 -0.68 0.00 0.00 178.15 178.55 1fa0 h PRO 484 N -0.49 0.79 -0.91 2.37 0.13 -1.82 -3.07 132.00 129.00 1fa0 h PRO 484 Ca -0.01 -0.13 0.15 0.00 -0.87 0.00 0.00 66.00 65.14 1fa0 h PRO 484 Cb 0.49 -0.14 -0.09 0.00 0.13 0.00 0.00 31.00 31.39 1fa0 h PRO 484 CO -0.17 0.67 0.52 0.00 -0.23 0.00 0.00 178.00 178.78 1fa0 h THR 486 N 0.74 1.23 -0.40 0.00 1.35 -1.38 -2.15 112.91 112.30 1fa0 h THR 486 Ca 0.49 -0.79 -0.03 0.00 -0.55 0.00 0.00 66.41 65.54 1fa0 h THR 486 Cb 0.66 0.72 -0.02 0.00 -1.73 0.00 0.00 68.15 67.78 1fa0 h THR 486 CO -0.34 0.29 0.14 -0.33 -0.25 0.00 0.00 175.52 175.03 1fa0 h GLU 487 N 0.75 0.58 -0.71 4.72 5.08 -1.30 0.35 114.58 124.05 1fa0 h GLU 487 Ca 0.18 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1fa0 h GLU 487 Cb 0.27 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1fa0 h GLU 487 CO -0.01 0.50 0.43 0.35 -1.00 0.00 0.00 179.01 179.28 1fa0 h PHE 488 N 0.57 0.94 -0.08 4.33 3.57 -0.69 0.30 116.94 125.88 1fa0 h PHE 488 Ca 0.14 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.52 1fa0 h PHE 488 Cb 0.16 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1fa0 h PHE 488 CO 0.01 0.64 -0.38 0.28 -2.23 0.00 0.00 178.31 176.62 1fa0 h VAL 489 N 0.97 1.40 -0.23 1.41 2.07 -0.78 -1.01 116.25 120.08 1fa0 h VAL 489 Ca 0.25 -1.76 0.07 0.00 0.82 0.00 0.00 66.70 66.09 1fa0 h VAL 489 Cb -0.03 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1fa0 h VAL 489 CO -0.05 0.51 0.21 0.78 0.02 0.00 0.00 177.57 179.05 1fa0 h ASN 490 N -0.05 0.00 0.00 0.57 4.21 0.00 -1.33 115.58 118.99 1fa0 h ASN 490 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 1fa0 h ASN 490 Cb 1.03 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.23 1fa0 h ASN 490 CO 0.08 0.00 -0.02 0.25 -1.29 0.00 0.00 177.43 176.45 1fa0 h LEU 491 N 0.00 0.00 -0.97 1.61 5.85 -0.13 -3.37 115.31 118.29 1fa0 h LEU 491 Ca 0.11 0.00 0.24 0.00 0.84 0.00 0.00 57.88 59.07 1fa0 h LEU 491 Cb 0.54 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.44 1fa0 h LEU 491 CO -0.00 0.36 0.54 0.00 -0.34 0.00 0.00 178.44 179.00 1fa0 n ARG 493 N -4.93 0.01 0.00 0.00 1.74 -0.52 -4.55 116.66 108.42 1fa0 n ARG 493 Ca 0.26 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.79 1fa0 n ARG 493 Cb 0.72 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 1fa0 n ARG 493 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1fa0 n SER 494 N -1.57 0.00 0.00 0.55 2.88 0.75 -4.60 113.62 111.64 1fa0 n SER 494 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 1fa0 n SER 494 Cb 0.05 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1fa0 n SER 494 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1fa0 n PHE 495 N 0.00 0.00 -2.61 0.66 3.01 -1.26 -4.55 117.46 112.71 1fa0 n PHE 495 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.10 1fa0 n PHE 495 Cb 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 1fa0 n PHE 495 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1fa0 s ASN 496 N -4.00 6.91 0.34 4.37 0.01 -1.26 -4.95 114.94 116.35 1fa0 s ASN 496 Ca 0.00 1.98 0.26 0.00 -0.71 0.00 0.00 52.86 54.40 1fa0 s ASN 496 Cb 0.00 -2.58 0.88 0.00 0.41 0.00 0.00 41.25 39.96 1fa0 s ASN 496 CO 0.00 -0.38 1.77 -0.33 -1.51 0.00 0.00 177.10 176.65 1fa0 h GLU 497 N 2.65 0.00 -0.04 -0.60 3.07 -1.86 -2.79 114.58 115.00 1fa0 h GLU 497 Ca -0.48 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.34 1fa0 h GLU 497 Cb 1.21 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.11 1fa0 h GLU 497 CO 0.63 0.00 -0.15 -0.44 -1.40 0.00 0.00 179.01 177.65 1fa0 h ASP 498 N 0.00 0.06 0.00 1.42 3.45 -1.92 -2.13 116.42 117.31 1fa0 h ASP 498 Ca 0.00 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.45 1fa0 h ASP 498 Cb 0.63 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.39 1fa0 h ASP 498 CO 0.00 0.22 0.00 -1.22 -1.57 0.00 0.00 179.24 176.67 1fa0 n TYR 499 N -4.32 0.00 -1.33 4.55 0.53 -1.05 -1.10 117.16 114.43 1fa0 n TYR 499 Ca -0.02 -0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.86 1fa0 n TYR 499 Cb 0.24 -0.04 0.00 0.00 -1.03 0.00 0.00 39.34 38.51 1fa0 n TYR 499 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1fa0 n GLY 500 N 0.32 -1.84 0.24 2.72 0.00 -0.80 -4.63 105.19 101.20 1fa0 n GLY 500 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1fa0 n GLY 500 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1fa0 h ASP 501 N 0.00 0.78 0.00 1.61 -0.00 -1.25 -3.46 116.42 114.10 1fa0 h ASP 501 Ca 0.00 -0.37 0.00 0.00 -0.00 0.00 0.00 57.03 56.66 1fa0 h ASP 501 Cb 1.12 -0.22 0.00 0.00 -0.00 0.00 0.00 39.33 40.22 1fa0 h ASP 501 CO 0.00 1.11 0.00 1.41 -0.00 0.00 0.00 179.24 181.76 1fa0 n HIS 502 N -4.02 0.00 1.18 0.28 8.25 -1.14 -4.51 115.22 115.26 1fa0 n HIS 502 Ca -0.02 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.58 1fa0 n HIS 502 Cb 0.56 -0.20 0.61 0.00 1.12 0.00 0.00 29.99 32.08 1fa0 n HIS 502 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1fa0 n LYS 503 N -0.86 0.23 0.00 -0.41 4.01 -1.26 -4.36 118.16 115.51 1fa0 n LYS 503 Ca 0.00 -0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.76 1fa0 n LYS 503 Cb 0.00 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.02 1fa0 n LYS 503 CO 0.00 0.00 0.00 1.55 -1.11 0.00 0.00 177.40 177.84 1fa0 n VAL 504 N -1.35 0.00 -4.73 -0.18 3.14 -1.26 -4.82 118.33 109.12 1fa0 n VAL 504 Ca 0.10 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.15 1fa0 n VAL 504 Cb 0.30 -0.32 -0.12 0.00 -1.06 0.00 0.00 33.84 32.64 1fa0 n VAL 504 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 1fa0 s PHE 505 N -1.52 2.83 -0.05 1.45 0.08 -1.26 0.68 117.98 120.19 1fa0 s PHE 505 Ca 0.00 -0.15 -0.10 0.00 0.12 0.00 0.00 56.93 56.80 1fa0 s PHE 505 Cb 0.00 -1.71 0.02 0.00 -0.57 0.00 0.00 43.02 40.76 1fa0 s PHE 505 CO 0.00 0.18 0.24 -0.80 -0.10 0.00 0.00 175.22 174.74 1fa0 s ASN 506 N -0.55 -0.18 -0.15 1.36 0.01 -0.42 -2.88 114.94 112.13 1fa0 s ASN 506 Ca 0.08 0.24 0.02 0.00 -0.71 0.00 0.00 52.86 52.48 1fa0 s ASN 506 Cb -0.12 0.39 0.01 0.00 0.41 0.00 0.00 41.25 41.95 1fa0 s ASN 506 CO 0.02 -0.24 -0.21 -0.22 -1.51 0.00 0.00 177.10 174.93 1fa0 s LEU 507 N -0.59 2.11 -0.06 0.60 1.98 -1.26 -0.47 118.68 120.99 1fa0 s LEU 507 Ca -0.07 -0.62 0.03 0.00 -2.89 0.00 0.00 54.13 50.58 1fa0 s LEU 507 Cb -0.04 -1.45 0.01 0.00 0.66 0.00 0.00 46.19 45.37 1fa0 s LEU 507 CO 0.02 0.05 -0.14 0.00 -1.89 0.00 0.00 176.35 174.38 1fa0 s ALA 508 N 1.01 1.38 -0.27 5.97 0.00 0.65 -4.99 121.76 125.50 1fa0 s ALA 508 Ca -0.02 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.44 1fa0 s ALA 508 Cb -0.15 -0.55 0.07 0.00 0.00 0.00 0.00 23.12 22.49 1fa0 s ALA 508 CO -0.06 0.17 -0.08 -0.51 0.00 0.00 0.00 175.76 175.28 1fa0 s LEU 509 N 0.44 3.61 -0.21 0.00 1.02 -1.26 -0.20 118.68 122.08 1fa0 s LEU 509 Ca -0.11 -1.50 -0.03 0.00 0.02 0.00 0.00 54.13 52.50 1fa0 s LEU 509 Cb -0.14 -1.55 -0.00 0.00 0.02 0.00 0.00 46.19 44.52 1fa0 s LEU 509 CO 0.04 -0.22 -0.07 -0.60 0.02 0.00 0.00 176.35 175.52 1fa0 s ARG 510 N 1.08 3.32 -0.03 1.70 3.52 -0.16 -4.94 118.95 123.44 1fa0 s ARG 510 Ca -0.06 -0.66 -0.28 0.00 -0.13 0.00 0.00 55.73 54.60 1fa0 s ARG 510 Cb -0.20 -2.94 -0.03 0.00 -1.56 0.00 0.00 34.95 30.22 1fa0 s ARG 510 CO -0.06 -0.19 0.93 0.12 -0.81 0.00 0.00 175.30 175.29 1fa0 s PHE 511 N 1.43 3.61 0.14 5.12 5.36 -1.26 -0.71 117.98 131.67 1fa0 s PHE 511 Ca 0.05 1.58 0.01 0.00 -0.96 0.00 0.00 56.93 57.62 1fa0 s PHE 511 Cb -0.14 -3.07 -0.04 0.00 -0.34 0.00 0.00 43.02 39.43 1fa0 s PHE 511 CO -0.05 -0.03 -0.01 0.14 -1.46 0.00 0.00 175.22 173.81 1fa0 s VAL 512 N 1.16 0.56 0.39 3.12 -7.23 -0.39 -4.99 120.40 113.03 1fa0 s VAL 512 Ca 0.48 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 1fa0 s VAL 512 Cb -0.20 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.77 1fa0 s VAL 512 CO 0.24 -0.61 0.57 -0.54 -0.31 0.00 0.00 175.10 174.45 1fa0 s LYS 513 N -3.92 3.09 0.07 4.82 1.02 -1.26 -1.40 119.74 122.17 1fa0 s LYS 513 Ca 0.20 -0.75 -0.20 0.00 0.02 0.00 0.00 55.97 55.24 1fa0 s LYS 513 Cb 0.06 -2.69 -0.07 0.00 -0.52 0.00 0.00 37.83 34.60 1fa0 s LYS 513 CO 0.01 -0.10 1.33 0.78 -0.92 0.00 0.00 175.35 176.45 1fa0 h GLY 514 N 0.65 -1.32 1.78 -3.33 0.00 -1.54 -2.23 103.07 97.09 1fa0 h GLY 514 Ca -0.46 0.71 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1fa0 h GLY 514 CO 0.55 -0.36 0.00 1.58 0.00 0.00 0.00 176.54 178.31 1fa0 n TYR 515 N -4.30 0.00 0.80 5.60 0.18 -1.26 -2.26 117.16 115.92 1fa0 n TYR 515 Ca -0.03 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.87 1fa0 n TYR 515 Cb 0.22 -0.39 0.20 0.00 -0.38 0.00 0.00 39.34 38.99 1fa0 n TYR 515 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 1fa0 n ASP 516 N -1.39 2.94 -4.76 9.48 4.64 -0.85 -4.80 116.55 121.81 1fa0 n ASP 516 Ca 0.03 -1.93 -0.41 0.00 -1.38 0.00 0.00 54.79 51.10 1fa0 n ASP 516 Cb 0.09 -0.10 -0.01 0.00 -1.04 0.00 0.00 41.12 40.05 1fa0 n ASP 516 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1fa0 s LEU 517 N -1.77 4.36 0.57 -2.67 1.43 -0.96 -1.58 118.68 118.06 1fa0 s LEU 517 Ca 0.33 2.86 -0.20 0.00 -1.03 0.00 0.00 54.13 56.10 1fa0 s LEU 517 Cb 0.21 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.73 1fa0 s LEU 517 CO 0.31 -0.79 1.04 -2.65 0.23 0.00 0.00 176.35 174.49 1fa0 n PRO 518 N 1.58 1.09 0.15 1.29 -0.02 -1.26 -4.59 135.00 133.24 1fa0 n PRO 518 Ca 0.05 0.41 0.05 0.00 -2.02 0.00 0.00 63.50 61.99 1fa0 n PRO 518 Cb 0.39 -2.23 0.50 0.00 -0.02 0.00 0.00 33.50 32.14 1fa0 n PRO 518 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1fa0 h ASP 519 N 0.78 0.18 -0.33 2.55 3.32 -1.94 -2.72 116.42 118.26 1fa0 h ASP 519 Ca -0.48 -0.02 0.10 0.00 0.02 0.00 0.00 57.03 56.65 1fa0 h ASP 519 Cb 1.35 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 1fa0 h ASP 519 CO 0.53 0.21 0.48 1.05 -1.72 0.00 0.00 179.24 179.79 1fa0 h GLU 520 N 0.20 0.00 0.00 3.56 4.11 -2.00 -0.93 114.58 119.53 1fa0 h GLU 520 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1fa0 h GLU 520 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1fa0 h GLU 520 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 179.01 179.36 1fa0 n VAL 521 N -3.44 0.32 -3.44 -1.06 0.31 -1.03 -4.91 118.33 105.09 1fa0 n VAL 521 Ca 0.06 -0.06 -0.20 0.00 -0.01 0.00 0.00 64.34 64.12 1fa0 n VAL 521 Cb 0.62 -0.60 -0.01 0.00 -0.91 0.00 0.00 33.84 32.93 1fa0 n VAL 521 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1fa0 s PHE 522 N -3.05 2.52 0.98 3.52 0.40 -0.35 -4.97 117.98 117.03 1fa0 s PHE 522 Ca 0.12 -0.52 -0.15 0.00 -0.60 0.00 0.00 56.93 55.77 1fa0 s PHE 522 Cb 0.15 -2.19 0.19 0.00 0.51 0.00 0.00 43.02 41.68 1fa0 s PHE 522 CO 0.52 -0.30 1.21 -0.51 0.70 0.00 0.00 175.22 176.84 1fa0 s ASP 523 N -4.23 2.93 0.04 1.36 1.01 -1.26 -4.92 116.67 111.60 1fa0 s ASP 523 Ca 0.49 0.60 -0.22 0.00 0.71 0.00 0.00 52.55 54.13 1fa0 s ASP 523 Cb -0.05 -0.89 -0.14 0.00 1.01 0.00 0.00 42.92 42.85 1fa0 s ASP 523 CO 0.29 -2.88 1.46 1.05 0.21 0.00 0.00 175.17 175.31 1fa0 h GLU 524 N -1.73 0.18 -1.98 8.23 4.11 -2.00 -2.44 114.58 118.95 1fa0 h GLU 524 Ca -0.46 -0.06 -0.41 0.00 0.07 0.00 0.00 59.36 58.50 1fa0 h GLU 524 Cb 1.29 -0.02 -0.15 0.00 0.50 0.00 0.00 28.75 30.37 1fa0 h GLU 524 CO 0.47 0.44 0.18 0.27 0.07 0.00 0.00 179.01 180.45 1fa0 n ASN 525 N -4.81 6.13 -3.62 3.06 6.94 -1.26 -4.93 115.26 116.78 1fa0 n ASN 525 Ca -0.06 -3.00 0.00 0.00 -0.02 0.00 0.00 54.58 51.50 1fa0 n ASN 525 Cb 0.20 -1.27 0.00 0.00 -2.36 0.00 0.00 39.78 36.35 1fa0 n ASN 525 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1fa0 n GLU 526 N 1.29 0.71 0.00 -3.83 0.28 -0.92 -5.06 120.64 113.11 1fa0 n GLU 526 Ca 0.46 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.46 1fa0 n GLU 526 Cb 0.65 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.52 1fa0 n GLU 526 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 1fa0 n LYS 527 N -0.20 0.00 -0.83 3.44 2.85 -1.26 -4.99 118.16 117.17 1fa0 n LYS 527 Ca 0.00 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.98 1fa0 n LYS 527 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 1fa0 n LYS 527 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1fa0 n ARG 528 N 0.00 0.00 -1.03 -1.58 0.63 -1.26 -4.89 116.66 108.53 1fa0 n ARG 528 Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 1fa0 n ARG 528 Cb 0.00 -0.60 0.16 0.00 0.45 0.00 0.00 32.46 32.47 1fa0 n ARG 528 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1fa0 s PRO 529 N -0.60 0.83 0.00 -0.14 0.02 -1.26 -5.07 135.00 128.78 1fa0 s PRO 529 Ca 0.38 0.91 0.03 0.00 0.02 0.00 0.00 61.00 62.34 1fa0 s PRO 529 Cb -0.53 -1.75 0.02 0.00 0.02 0.00 0.00 34.50 32.26 1fa0 s PRO 529 CO 0.34 -2.56 0.59 -1.13 -0.33 0.00 0.00 177.00 173.91