#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ioi s LYS 2 N 0.00 1.34 -0.09 0.03 1.02 -1.26 -2.15 119.74 118.63 1ioi s LYS 2 Ca 0.00 -0.49 -0.00 0.00 0.02 0.00 0.00 55.97 55.49 1ioi s LYS 2 Cb 0.00 -1.23 0.02 0.00 -0.52 0.00 0.00 37.83 36.10 1ioi s LYS 2 CO 0.00 0.23 -0.05 0.08 -0.92 0.00 0.00 175.35 174.69 1ioi s VAL 3 N -0.05 0.76 -0.02 3.17 1.01 -0.07 -0.72 120.40 124.48 1ioi s VAL 3 Ca -0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 1ioi s VAL 3 Cb -0.09 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 1ioi s VAL 3 CO 0.01 0.31 0.37 -0.22 0.00 0.00 0.00 175.10 175.57 1ioi s LEU 4 N 1.63 4.46 -0.03 3.92 0.20 -0.75 0.31 118.68 128.40 1ioi s LEU 4 Ca 0.02 0.88 -0.01 0.00 0.69 0.00 0.00 54.13 55.71 1ioi s LEU 4 Cb -0.13 -2.51 0.03 0.00 -0.43 0.00 0.00 46.19 43.15 1ioi s LEU 4 CO -0.05 0.33 0.04 -0.69 -0.29 0.00 0.00 176.35 175.69 1ioi s VAL 5 N -1.02 -0.03 0.26 1.68 1.01 -0.20 -1.10 120.40 121.00 1ioi s VAL 5 Ca 0.22 0.31 0.11 0.00 0.00 0.00 0.00 61.98 62.62 1ioi s VAL 5 Cb -0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 1ioi s VAL 5 CO 0.12 0.15 -0.11 0.42 0.00 0.00 0.00 175.10 175.68 1ioi s THR 6 N 1.68 2.93 0.23 3.92 -4.23 -0.35 -0.34 115.64 119.48 1ioi s THR 6 Ca -0.01 -2.14 -0.08 0.00 -1.18 0.00 0.00 61.69 58.28 1ioi s THR 6 Cb -0.12 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 1ioi s THR 6 CO -0.03 -0.36 0.34 -0.83 -0.54 0.00 0.00 174.62 173.20 1ioi s GLY 7 N -3.50 0.91 0.16 3.99 0.00 -0.31 -2.14 107.32 106.43 1ioi s GLY 7 Ca 0.30 -1.21 0.10 0.00 0.00 0.00 0.00 44.72 43.91 1ioi s GLY 7 CO 0.17 -0.93 -0.18 -1.36 0.00 0.00 0.00 173.10 170.80 1ioi s PHE 8 N -4.05 2.47 0.87 1.90 0.40 -1.26 -0.29 117.98 118.02 1ioi s PHE 8 Ca 0.29 -0.29 -0.10 0.00 -0.60 0.00 0.00 56.93 56.22 1ioi s PHE 8 Cb 0.02 -1.25 0.12 0.00 0.51 0.00 0.00 43.02 42.42 1ioi s PHE 8 CO 0.10 0.46 1.11 -1.83 0.70 0.00 0.00 175.22 175.77 1ioi s GLU 9 N -2.54 1.43 0.44 0.44 -1.05 -1.16 -2.60 118.70 113.66 1ioi s GLU 9 Ca 0.21 1.29 -0.25 0.00 -0.15 0.00 0.00 54.97 56.06 1ioi s GLU 9 Cb -0.09 -1.79 -0.08 0.00 -0.44 0.00 0.00 34.13 31.72 1ioi s GLU 9 CO 0.11 -2.26 1.42 -1.25 0.95 0.00 0.00 175.26 174.23 1ioi s PRO 10 N -4.77 3.73 0.28 -4.83 0.04 -1.26 -4.78 135.00 123.40 1ioi s PRO 10 Ca 0.64 2.39 0.02 0.00 0.04 0.00 0.00 61.00 64.10 1ioi s PRO 10 Cb -0.20 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 1ioi s PRO 10 CO 0.57 -0.77 0.13 -0.59 0.04 0.00 0.00 177.00 176.38 1ioi s PHE 11 N -1.21 1.54 -0.89 0.56 -0.71 -1.26 -4.92 117.98 111.08 1ioi s PHE 11 Ca 0.60 -1.29 -0.06 0.00 -1.04 0.00 0.00 56.93 55.15 1ioi s PHE 11 Cb -0.43 -0.86 0.06 0.00 -1.21 0.00 0.00 43.02 40.58 1ioi s PHE 11 CO 0.56 -0.45 0.15 0.41 -1.34 0.00 0.00 175.22 174.55 1ioi n GLY 12 N -0.51 -0.13 1.61 1.99 0.00 -1.26 -1.17 105.19 105.72 1ioi n GLY 12 Ca 0.01 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1ioi n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ioi n GLY 13 N -1.34 0.77 3.74 -0.02 0.00 -1.26 -5.02 105.19 102.06 1ioi n GLY 13 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1ioi n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ioi s GLU 14 N -0.45 4.62 0.32 1.61 0.41 -0.32 -4.91 118.70 119.98 1ioi s GLU 14 Ca 0.00 1.72 0.17 0.00 -0.41 0.00 0.00 54.97 56.45 1ioi s GLU 14 Cb 0.00 -3.26 0.29 0.00 -1.78 0.00 0.00 34.13 29.39 1ioi s GLU 14 CO 0.00 0.13 1.55 -0.22 -0.49 0.00 0.00 175.26 176.23 1ioi h LYS 15 N 4.76 0.00 -3.07 1.61 3.11 -1.95 -3.39 116.57 117.63 1ioi h LYS 15 Ca -0.45 0.00 -0.12 0.00 -2.81 0.00 0.00 60.65 57.27 1ioi h LYS 15 Cb 1.21 0.00 -0.21 0.00 -1.00 0.00 0.00 32.23 32.24 1ioi h LYS 15 CO 0.71 0.44 -0.30 -1.50 -2.81 0.00 0.00 179.45 175.99 1ioi s ILE 16 N -3.17 0.05 -0.24 2.00 1.10 -1.26 -4.90 121.20 114.79 1ioi s ILE 16 Ca 0.03 -0.45 0.01 0.00 -0.51 0.00 0.00 60.65 59.73 1ioi s ILE 16 Cb 0.08 -0.58 0.06 0.00 0.15 0.00 0.00 42.46 42.18 1ioi s ILE 16 CO 0.72 -0.25 -0.05 0.21 -2.11 0.00 0.00 174.94 173.47 1ioi s ASN 17 N -1.19 3.85 0.49 4.50 3.84 -1.26 -4.72 114.94 120.45 1ioi s ASN 17 Ca -0.12 -1.20 0.21 0.00 0.21 0.00 0.00 52.86 51.96 1ioi s ASN 17 Cb -0.05 -1.17 1.15 0.00 -0.55 0.00 0.00 41.25 40.63 1ioi s ASN 17 CO 0.04 -0.24 1.60 1.55 -2.79 0.00 0.00 177.10 177.25 1ioi h PRO 18 N 7.96 0.00 0.00 0.43 0.13 -1.93 -2.67 132.00 135.92 1ioi h PRO 18 Ca -0.17 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.74 1ioi h PRO 18 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 1ioi h PRO 18 CO 0.41 0.00 -1.15 1.79 -0.23 0.00 0.00 178.00 178.82 1ioi h THR 19 N 0.00 1.26 0.33 1.56 1.35 -1.93 -1.48 112.91 114.00 1ioi h THR 19 Ca 0.00 -2.94 -0.00 0.00 -0.55 0.00 0.00 66.41 62.92 1ioi h THR 19 Cb 0.62 2.60 -0.01 0.00 -1.73 0.00 0.00 68.15 69.63 1ioi h THR 19 CO 0.00 0.72 -0.27 -0.08 -0.25 0.00 0.00 175.52 175.64 1ioi h GLU 20 N 0.00 -0.58 -0.31 4.72 4.81 -1.21 -0.19 114.58 121.82 1ioi h GLU 20 Ca -0.09 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 1ioi h GLU 20 Cb 1.76 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 31.26 1ioi h GLU 20 CO 0.10 -0.39 0.06 -0.09 -0.73 0.00 0.00 179.01 177.96 1ioi h ARG 21 N -0.60 0.46 -0.55 1.92 2.43 -1.64 -1.95 114.38 114.44 1ioi h ARG 21 Ca -0.02 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 58.99 1ioi h ARG 21 Cb 0.53 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1ioi h ARG 21 CO -0.02 0.44 0.01 0.82 -1.51 0.00 0.00 179.97 179.71 1ioi h ILE 22 N 0.45 1.26 -0.39 1.20 2.04 -1.07 -1.77 117.51 119.23 1ioi h ILE 22 Ca 0.11 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1ioi h ILE 22 Cb 0.20 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1ioi h ILE 22 CO -0.00 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.75 1ioi h ALA 23 N 1.12 0.50 0.00 1.87 0.00 -0.58 -2.02 119.26 120.15 1ioi h ALA 23 Ca 0.16 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1ioi h ALA 23 Cb 0.51 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ioi h ALA 23 CO 0.02 0.02 -0.50 0.87 0.00 0.00 0.00 179.25 179.67 1ioi h LYS 24 N 0.50 0.00 0.00 0.00 1.57 -1.37 -2.18 116.57 115.09 1ioi h LYS 24 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1ioi h LYS 24 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1ioi h LYS 24 CO -0.02 0.50 -0.56 -0.44 -0.57 0.00 0.00 179.45 178.35 1ioi h ASP 25 N 0.00 0.00 -0.01 0.86 3.45 -1.04 -3.26 116.42 116.41 1ioi h ASP 25 Ca -0.00 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.43 1ioi h ASP 25 Cb 0.91 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.68 1ioi h ASP 25 CO 0.06 0.01 -0.20 0.18 -1.57 0.00 0.00 179.24 177.73 1ioi n LEU 26 N -2.74 2.47 -4.68 1.55 4.77 -0.78 -4.86 117.00 112.74 1ioi n LEU 26 Ca 0.02 -0.85 -0.42 0.00 -0.03 0.00 0.00 56.01 54.72 1ioi n LEU 26 Cb 0.52 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1ioi n LEU 26 CO 0.37 0.43 1.03 -0.62 -1.33 0.00 0.00 177.39 177.27 1ioi s ASP 27 N -2.21 6.98 0.00 -1.43 3.68 -0.85 -2.69 116.67 120.15 1ioi s ASP 27 Ca 0.25 1.82 0.00 0.00 2.13 0.00 0.00 52.55 56.75 1ioi s ASP 27 Cb 0.19 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 39.11 1ioi s ASP 27 CO 0.42 -0.67 0.00 0.61 0.13 0.00 0.00 175.17 175.66 1ioi n GLY 28 N 3.51 0.69 3.99 2.66 0.00 -0.09 -4.90 105.19 111.04 1ioi n GLY 28 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1ioi n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ioi s ILE 29 N -2.32 2.20 -0.01 -0.61 -5.25 -1.09 -4.86 121.20 109.25 1ioi s ILE 29 Ca 0.00 -0.57 0.01 0.00 -0.99 0.00 0.00 60.65 59.10 1ioi s ILE 29 Cb 0.00 -2.62 0.01 0.00 2.95 0.00 0.00 42.46 42.79 1ioi s ILE 29 CO 0.00 0.00 -0.03 -0.54 -1.79 0.00 0.00 174.94 172.58 1ioi s LYS 30 N -5.12 0.37 -0.61 0.37 1.02 -1.26 -1.73 119.74 112.79 1ioi s LYS 30 Ca 0.65 -0.09 -0.03 0.00 0.02 0.00 0.00 55.97 56.53 1ioi s LYS 30 Cb -0.06 -0.41 0.16 0.00 -0.52 0.00 0.00 37.83 37.00 1ioi s LYS 30 CO 0.44 0.02 0.42 0.42 -0.92 0.00 0.00 175.35 175.72 1ioi s ILE 31 N 0.27 3.65 0.00 2.17 -1.09 -0.57 -4.93 121.20 120.69 1ioi s ILE 31 Ca -0.03 -2.90 0.00 0.00 -2.23 0.00 0.00 60.65 55.49 1ioi s ILE 31 Cb -0.06 -3.39 0.00 0.00 -1.58 0.00 0.00 42.46 37.43 1ioi s ILE 31 CO -0.00 -0.86 0.00 0.61 -1.23 0.00 0.00 174.94 173.45 1ioi n GLY 32 N 3.56 2.68 0.36 6.18 0.00 -1.26 -2.16 105.19 114.55 1ioi n GLY 32 Ca 0.07 -0.28 0.09 0.00 0.00 0.00 0.00 46.02 45.90 1ioi n GLY 32 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1ioi h ASP 33 N 0.00 0.57 -3.35 1.61 2.03 -2.00 -3.45 116.42 111.83 1ioi h ASP 33 Ca 0.00 0.01 -0.56 0.00 -0.73 0.00 0.00 57.03 55.75 1ioi h ASP 33 Cb 0.00 -0.11 -0.05 0.00 -0.83 0.00 0.00 39.33 38.35 1ioi h ASP 33 CO 0.00 0.35 0.29 0.00 -1.03 0.00 0.00 179.24 178.85 1ioi s ALA 34 N -5.58 3.33 0.02 4.15 0.00 -0.92 -4.46 121.76 118.32 1ioi s ALA 34 Ca -0.09 0.25 -0.24 0.00 0.00 0.00 0.00 51.96 51.89 1ioi s ALA 34 Cb 0.20 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 1ioi s ALA 34 CO 0.77 -0.33 0.72 -1.14 0.00 0.00 0.00 175.76 175.78 1ioi s GLN 35 N 1.32 4.44 -0.09 0.00 -0.44 -0.92 -1.52 119.66 122.46 1ioi s GLN 35 Ca 0.43 0.96 -0.00 0.00 -2.50 0.00 0.00 55.36 54.26 1ioi s GLN 35 Cb -0.18 -3.36 -0.03 0.00 -1.64 0.00 0.00 33.01 27.79 1ioi s GLN 35 CO 0.20 0.29 -0.07 0.08 0.50 0.00 0.00 175.29 176.29 1ioi s VAL 36 N -0.02 3.71 -0.06 1.34 1.01 -0.70 -0.89 120.40 124.79 1ioi s VAL 36 Ca 0.36 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.91 1ioi s VAL 36 Cb -0.20 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1ioi s VAL 36 CO 0.21 0.58 -0.17 -0.36 0.00 0.00 0.00 175.10 175.36 1ioi s PHE 37 N -0.56 1.79 -0.14 5.22 0.40 0.15 -0.92 117.98 123.93 1ioi s PHE 37 Ca 0.08 -0.63 0.02 0.00 -0.60 0.00 0.00 56.93 55.81 1ioi s PHE 37 Cb -0.12 -1.24 0.01 0.00 0.51 0.00 0.00 43.02 42.19 1ioi s PHE 37 CO 0.02 -0.26 -0.20 0.20 0.70 0.00 0.00 175.22 175.68 1ioi s GLY 38 N 0.35 1.28 0.00 4.36 0.00 -1.26 -1.04 107.32 111.02 1ioi s GLY 38 Ca -0.11 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 43.61 1ioi s GLY 38 CO 0.04 0.11 -0.07 0.50 0.00 0.00 0.00 173.10 173.68 1ioi s ARG 39 N 0.96 0.53 -0.25 2.90 1.81 0.54 -4.67 118.95 120.77 1ioi s ARG 39 Ca -0.04 -0.33 -0.09 0.00 -1.72 0.00 0.00 55.73 53.54 1ioi s ARG 39 Cb -0.15 -0.48 -0.04 0.00 -0.45 0.00 0.00 34.95 33.83 1ioi s ARG 39 CO -0.04 0.12 0.13 0.08 -0.68 0.00 0.00 175.30 174.92 1ioi s VAL 40 N -0.38 4.96 0.23 3.52 1.01 -1.26 -1.16 120.40 127.32 1ioi s VAL 40 Ca 0.00 0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.94 1ioi s VAL 40 Cb -0.04 -3.33 -0.07 0.00 0.00 0.00 0.00 36.38 32.95 1ioi s VAL 40 CO -0.00 0.32 0.54 -0.76 0.00 0.00 0.00 175.10 175.20 1ioi s LEU 41 N 1.41 4.16 0.55 3.92 1.43 0.60 -4.92 118.68 125.84 1ioi s LEU 41 Ca 0.06 0.88 -0.21 0.00 -1.03 0.00 0.00 54.13 53.83 1ioi s LEU 41 Cb -0.15 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.38 1ioi s LEU 41 CO 0.06 -0.08 1.28 -2.16 0.23 0.00 0.00 176.35 175.68 1ioi s PRO 42 N -2.88 3.15 -1.17 1.29 0.04 -1.26 -2.99 135.00 131.18 1ioi s PRO 42 Ca 0.47 2.03 -0.07 0.00 0.04 0.00 0.00 61.00 63.46 1ioi s PRO 42 Cb -0.11 -2.16 0.24 0.00 0.04 0.00 0.00 34.50 32.51 1ioi s PRO 42 CO 0.22 -1.12 1.58 0.28 0.04 0.00 0.00 177.00 178.01 1ioi n VAL 43 N -1.16 4.79 -3.47 -0.36 0.31 -1.26 -4.44 118.33 112.74 1ioi n VAL 43 Ca 0.11 -5.20 -0.10 0.00 -0.01 0.00 0.00 64.34 59.14 1ioi n VAL 43 Cb 0.47 -2.27 -0.09 0.00 -0.91 0.00 0.00 33.84 31.04 1ioi n VAL 43 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ioi s VAL 44 N -1.05 -0.59 0.40 2.52 1.01 -1.26 0.79 120.40 122.22 1ioi s VAL 44 Ca 0.35 0.03 -0.26 0.00 0.00 0.00 0.00 61.98 62.10 1ioi s VAL 44 Cb 0.04 -0.73 -0.10 0.00 0.00 0.00 0.00 36.38 35.59 1ioi s VAL 44 CO 0.04 -0.05 1.34 0.49 0.00 0.00 0.00 175.10 176.92 1ioi n PHE 45 N 5.37 2.40 0.00 5.22 3.01 -1.26 -0.55 117.46 131.65 1ioi n PHE 45 Ca -0.05 0.49 0.00 0.00 1.01 0.00 0.00 57.45 58.90 1ioi n PHE 45 Cb 0.50 -2.43 0.00 0.00 -0.01 0.00 0.00 39.48 37.54 1ioi n PHE 45 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ioi n GLY 46 N 0.70 2.04 0.31 1.37 0.00 -1.26 -4.56 105.19 103.78 1ioi n GLY 46 Ca 0.05 -0.40 0.05 0.00 0.00 0.00 0.00 46.02 45.71 1ioi n GLY 46 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ioi h LYS 47 N 0.00 0.70 -0.69 1.61 3.64 -1.96 -1.02 116.57 118.86 1ioi h LYS 47 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1ioi h LYS 47 Cb 0.00 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.63 1ioi h LYS 47 CO 0.00 0.47 0.39 0.00 -2.27 0.00 0.00 179.45 178.04 1ioi h ALA 48 N 1.50 1.40 -0.33 5.00 0.00 -1.04 -1.08 119.26 124.72 1ioi h ALA 48 Ca 0.42 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1ioi h ALA 48 Cb 0.48 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ioi h ALA 48 CO -0.29 0.50 0.08 -0.22 0.00 0.00 0.00 179.25 179.32 1ioi h LYS 49 N 0.95 0.52 0.70 0.00 3.64 -1.47 0.60 116.57 121.51 1ioi h LYS 49 Ca 0.25 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1ioi h LYS 49 Cb -0.01 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1ioi h LYS 49 CO -0.04 0.59 -0.34 1.49 -2.27 0.00 0.00 179.45 178.88 1ioi h GLU 50 N 0.37 -0.90 -0.76 1.90 4.81 -1.17 0.21 114.58 119.03 1ioi h GLU 50 Ca 0.10 0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.54 1ioi h GLU 50 Cb 0.30 0.21 -0.10 0.00 0.63 0.00 0.00 28.75 29.79 1ioi h GLU 50 CO 0.00 -0.60 0.29 0.28 -0.73 0.00 0.00 179.01 178.25 1ioi h VAL 51 N -0.95 0.62 -0.14 0.32 2.07 -1.25 -1.20 116.25 115.72 1ioi h VAL 51 Ca -0.10 -0.14 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 1ioi h VAL 51 Cb 0.72 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1ioi h VAL 51 CO 0.16 0.08 -0.40 0.25 0.02 0.00 0.00 177.57 177.67 1ioi h LEU 52 N 0.42 0.32 0.06 2.57 7.12 -0.67 -2.68 115.31 122.46 1ioi h LEU 52 Ca 0.43 -0.14 -0.28 0.00 0.13 0.00 0.00 57.88 58.02 1ioi h LEU 52 Cb 0.67 -0.09 0.02 0.00 -0.53 0.00 0.00 40.66 40.74 1ioi h LEU 52 CO -0.43 0.70 -1.18 -0.33 -0.13 0.00 0.00 178.44 177.07 1ioi h GLU 53 N 0.26 0.59 -0.25 1.25 5.08 0.20 -2.06 114.58 119.66 1ioi h GLU 53 Ca 0.02 -0.75 0.06 0.00 -1.00 0.00 0.00 59.36 57.69 1ioi h GLU 53 Cb 0.83 0.24 -0.07 0.00 0.50 0.00 0.00 28.75 30.25 1ioi h GLU 53 CO 0.07 1.33 -0.21 0.87 -1.00 0.00 0.00 179.01 180.06 1ioi h LYS 54 N 0.28 -0.20 -0.29 2.33 1.57 -1.27 -0.52 116.57 118.46 1ioi h LYS 54 Ca -0.16 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1ioi h LYS 54 Cb 1.85 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 34.19 1ioi h LYS 54 CO 0.22 -0.14 0.17 1.15 -0.57 0.00 0.00 179.45 180.28 1ioi h THR 55 N -0.21 1.03 -0.40 -0.16 2.02 -1.48 0.98 112.91 114.69 1ioi h THR 55 Ca 0.14 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 1ioi h THR 55 Cb 0.42 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1ioi h THR 55 CO -0.37 0.06 0.02 -0.07 0.37 0.00 0.00 175.52 175.53 1ioi h LEU 56 N 0.34 0.59 0.08 2.58 3.38 -1.24 0.51 115.31 121.54 1ioi h LEU 56 Ca 0.11 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ioi h LEU 56 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1ioi h LEU 56 CO -0.06 0.65 -0.04 -0.08 0.09 0.00 0.00 178.44 179.01 1ioi h GLU 57 N 0.60 -0.10 -0.14 1.13 4.57 -0.30 0.29 114.58 120.63 1ioi h GLU 57 Ca 0.13 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.29 1ioi h GLU 57 Cb 0.35 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1ioi h GLU 57 CO 0.01 0.14 0.01 1.49 -1.18 0.00 0.00 179.01 179.48 1ioi h GLU 58 N -0.33 0.24 0.05 1.92 4.22 -0.76 -3.32 114.58 116.60 1ioi h GLU 58 Ca -0.01 -0.07 -0.29 0.00 0.08 0.00 0.00 59.36 59.07 1ioi h GLU 58 Cb 0.29 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1ioi h GLU 58 CO 0.02 0.46 -1.57 0.82 -2.18 0.00 0.00 179.01 176.55 1ioi h ILE 59 N -0.01 1.05 -6.76 2.32 2.04 -1.00 -3.49 117.51 111.66 1ioi h ILE 59 Ca 0.04 -2.80 -0.56 0.00 1.00 0.00 0.00 64.86 62.54 1ioi h ILE 59 Cb 0.34 2.60 -0.04 0.00 -0.74 0.00 0.00 36.82 38.98 1ioi h ILE 59 CO 0.01 0.71 -0.97 0.29 0.00 0.00 0.00 178.15 178.19 1ioi n LYS 60 N -3.27 -1.07 -1.68 2.37 5.02 0.10 -4.93 118.16 114.70 1ioi n LYS 60 Ca -0.16 0.20 -0.32 0.00 -2.02 0.00 0.00 58.31 56.01 1ioi n LYS 60 Cb 1.03 -3.39 0.05 0.00 -0.02 0.00 0.00 35.03 32.70 1ioi n LYS 60 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ioi s PRO 61 N -7.00 2.76 0.13 1.97 0.04 -1.26 -4.93 135.00 126.71 1ioi s PRO 61 Ca 0.30 1.29 0.10 0.00 0.04 0.00 0.00 61.00 62.74 1ioi s PRO 61 Cb -0.15 -1.95 -0.14 0.00 0.04 0.00 0.00 34.50 32.29 1ioi s PRO 61 CO 0.94 -1.26 1.19 -0.44 0.04 0.00 0.00 177.00 177.47 1ioi h ASP 62 N -0.20 0.00 -3.47 6.66 3.32 -1.28 -3.35 116.42 118.10 1ioi h ASP 62 Ca -0.46 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.21 1ioi h ASP 62 Cb 1.24 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.45 1ioi h ASP 62 CO 0.54 0.85 -0.76 -0.63 -1.72 0.00 0.00 179.24 177.52 1ioi s ILE 63 N -2.77 0.37 -0.08 0.35 1.01 -1.16 -0.89 121.20 118.03 1ioi s ILE 63 Ca 0.01 -0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.68 1ioi s ILE 63 Cb 0.09 -0.43 -0.00 0.00 0.01 0.00 0.00 42.46 42.13 1ioi s ILE 63 CO 0.80 0.19 -0.22 0.00 0.00 0.00 0.00 174.94 175.71 1ioi s ALA 64 N 1.01 1.99 -0.15 9.38 0.00 0.20 -1.82 121.76 132.38 1ioi s ALA 64 Ca -0.10 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 1ioi s ALA 64 Cb -0.14 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.29 1ioi s ALA 64 CO -0.01 0.29 -0.06 0.42 0.00 0.00 0.00 175.76 176.40 1ioi s ILE 65 N 0.28 1.10 -0.15 0.00 -1.09 -0.26 -2.83 121.20 118.25 1ioi s ILE 65 Ca -0.15 -0.54 -0.04 0.00 -2.23 0.00 0.00 60.65 57.69 1ioi s ILE 65 Cb -0.16 -1.23 -0.03 0.00 -1.58 0.00 0.00 42.46 39.46 1ioi s ILE 65 CO 0.07 0.20 0.00 -1.00 -1.23 0.00 0.00 174.94 172.98 1ioi s HIS 66 N 1.65 3.13 -0.01 3.97 3.76 0.35 -1.22 115.29 126.92 1ioi s HIS 66 Ca 0.02 -0.07 0.05 0.00 -0.15 0.00 0.00 55.06 54.91 1ioi s HIS 66 Cb -0.14 -1.96 -0.01 0.00 1.11 0.00 0.00 32.58 31.57 1ioi s HIS 66 CO -0.08 0.14 -0.17 0.08 -0.85 0.00 0.00 174.74 173.86 1ioi s VAL 67 N 0.09 1.32 0.04 -0.90 1.01 -0.91 -0.59 120.40 120.46 1ioi s VAL 67 Ca 0.02 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 1ioi s VAL 67 Cb -0.13 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1ioi s VAL 67 CO 0.02 0.36 0.24 -0.83 0.00 0.00 0.00 175.10 174.89 1ioi s GLY 68 N -0.42 -0.04 -0.23 4.51 0.00 0.43 -4.19 107.32 107.39 1ioi s GLY 68 Ca 0.06 -0.12 -0.29 0.00 0.00 0.00 0.00 44.72 44.37 1ioi s GLY 68 CO -0.01 -0.32 1.37 -2.27 0.00 0.00 0.00 173.10 171.88 1ioi s LEU 69 N -1.99 3.99 -0.90 0.66 0.20 -1.26 -0.05 118.68 119.34 1ioi s LEU 69 Ca -0.06 1.48 -0.01 0.00 0.69 0.00 0.00 54.13 56.23 1ioi s LEU 69 Cb -0.02 -3.54 0.23 0.00 -0.43 0.00 0.00 46.19 42.44 1ioi s LEU 69 CO -0.03 -1.02 0.86 0.00 -0.29 0.00 0.00 176.35 175.87 1ioi n ALA 70 N 7.48 3.97 -1.65 5.97 0.00 0.01 -4.88 120.51 131.40 1ioi n ALA 70 Ca 0.15 -4.64 -0.54 0.00 0.00 0.00 0.00 53.44 48.41 1ioi n ALA 70 Cb 0.46 -1.70 -0.06 0.00 0.00 0.00 0.00 19.45 18.14 1ioi n ALA 70 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ioi n PRO 71 N 2.07 1.23 0.00 0.00 -0.02 -1.26 -1.83 135.00 135.19 1ioi n PRO 71 Ca 0.23 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1ioi n PRO 71 Cb 0.37 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1ioi n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ioi n GLY 72 N 3.43 2.22 3.76 -1.23 0.00 -1.26 -5.01 105.19 107.10 1ioi n GLY 72 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1ioi n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ioi s ARG 73 N -0.65 4.56 0.00 1.61 3.00 -0.76 -4.64 118.95 122.07 1ioi s ARG 73 Ca 0.00 1.82 0.23 0.00 0.00 0.00 0.00 55.73 57.78 1ioi s ARG 73 Cb 0.00 -3.11 0.04 0.00 0.00 0.00 0.00 34.95 31.88 1ioi s ARG 73 CO 0.00 0.13 1.11 -1.13 0.00 0.00 0.00 175.30 175.41 1ioi n SER 74 N 1.02 1.65 -3.98 0.23 3.41 -1.26 -4.35 113.62 110.35 1ioi n SER 74 Ca -0.00 -1.30 -0.09 0.00 -0.26 0.00 0.00 58.87 57.21 1ioi n SER 74 Cb 0.45 0.55 -0.06 0.00 -0.26 0.00 0.00 64.21 64.89 1ioi n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ioi s ALA 75 N -2.61 -0.15 -0.03 7.33 0.00 -1.26 -4.93 121.76 120.11 1ioi s ALA 75 Ca 0.16 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 1ioi s ALA 75 Cb 0.18 1.02 -0.06 0.00 0.00 0.00 0.00 23.12 24.26 1ioi s ALA 75 CO 0.64 -0.78 1.62 0.42 0.00 0.00 0.00 175.76 177.66 1ioi s ILE 76 N -4.00 3.52 -0.25 0.00 1.01 -0.92 -4.21 121.20 116.34 1ioi s ILE 76 Ca 0.21 0.72 -0.04 0.00 0.00 0.00 0.00 60.65 61.54 1ioi s ILE 76 Cb 0.01 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 39.02 1ioi s ILE 76 CO 0.06 -0.05 -0.00 -0.94 0.00 0.00 0.00 174.94 174.01 1ioi s SER 77 N 3.02 4.61 -0.41 3.58 1.04 0.12 -0.12 113.70 125.54 1ioi s SER 77 Ca 0.72 -0.59 -0.22 0.00 0.48 0.00 0.00 55.95 56.35 1ioi s SER 77 Cb -0.34 -1.78 0.02 0.00 0.10 0.00 0.00 66.02 64.02 1ioi s SER 77 CO 0.29 -0.10 0.70 -0.63 0.98 0.00 0.00 173.24 174.49 1ioi s ILE 78 N 1.46 4.77 0.01 -1.02 1.01 0.10 -0.62 121.20 126.92 1ioi s ILE 78 Ca 0.04 0.42 -0.30 0.00 0.00 0.00 0.00 60.65 60.80 1ioi s ILE 78 Cb -0.16 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 38.04 1ioi s ILE 78 CO -0.01 -0.55 1.51 -1.61 0.00 0.00 0.00 174.94 174.28 1ioi s GLU 79 N 2.98 4.24 0.00 2.79 0.41 -0.61 -0.35 118.70 128.15 1ioi s GLU 79 Ca 0.26 2.11 -0.08 0.00 -0.41 0.00 0.00 54.97 56.85 1ioi s GLU 79 Cb -0.13 -3.64 -0.30 0.00 -1.78 0.00 0.00 34.13 28.27 1ioi s GLU 79 CO 0.19 -0.67 0.86 -0.09 -0.49 0.00 0.00 175.26 175.06 1ioi h ARG 80 N 8.22 0.35 -3.75 1.61 2.43 -1.25 -3.42 114.38 118.58 1ioi h ARG 80 Ca -0.39 -0.61 -0.36 0.00 -0.81 0.00 0.00 59.98 57.81 1ioi h ARG 80 Cb 1.18 0.23 -0.35 0.00 -0.42 0.00 0.00 29.97 30.61 1ioi h ARG 80 CO 0.92 1.25 -0.75 0.96 -1.51 0.00 0.00 179.97 180.84 1ioi s ILE 81 N -2.61 0.24 -0.08 1.20 -4.36 -1.26 -1.58 121.20 112.74 1ioi s ILE 81 Ca -0.10 0.07 -0.10 0.00 -0.26 0.00 0.00 60.65 60.25 1ioi s ILE 81 Cb 0.06 -0.33 -0.05 0.00 1.25 0.00 0.00 42.46 43.39 1ioi s ILE 81 CO 0.88 0.17 0.25 0.00 0.24 0.00 0.00 174.94 176.47 1ioi s ALA 82 N 1.13 3.79 0.10 2.27 0.00 0.56 -4.40 121.76 125.20 1ioi s ALA 82 Ca -0.08 -0.48 0.09 0.00 0.00 0.00 0.00 51.96 51.49 1ioi s ALA 82 Cb -0.13 -2.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 1ioi s ALA 82 CO -0.02 0.52 -0.24 0.14 0.00 0.00 0.00 175.76 176.16 1ioi s VAL 83 N -0.88 1.94 -1.22 0.00 -7.23 -1.26 -1.28 120.40 110.46 1ioi s VAL 83 Ca 0.18 -1.56 -0.13 0.00 -1.81 0.00 0.00 61.98 58.66 1ioi s VAL 83 Cb -0.14 -1.72 -0.06 0.00 0.56 0.00 0.00 36.38 35.02 1ioi s VAL 83 CO 0.07 0.06 2.33 -3.20 -0.31 0.00 0.00 175.10 174.05 1ioi n ASN 84 N 1.18 5.09 -3.60 4.85 2.85 0.12 -4.82 115.26 120.93 1ioi n ASN 84 Ca -0.18 -2.61 -0.13 0.00 -0.11 0.00 0.00 54.58 51.54 1ioi n ASN 84 Cb 0.53 -1.38 -0.06 0.00 1.24 0.00 0.00 39.78 40.11 1ioi n ASN 84 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1ioi s ALA 85 N 3.38 -1.86 -0.07 5.20 0.00 -1.26 -3.61 121.76 123.54 1ioi s ALA 85 Ca 0.53 1.74 0.04 0.00 0.00 0.00 0.00 51.96 54.27 1ioi s ALA 85 Cb 0.14 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 1ioi s ALA 85 CO -0.02 -0.31 -0.19 0.42 0.00 0.00 0.00 175.76 175.65 1ioi s ILE 86 N -0.32 2.58 -0.44 0.00 1.09 0.44 -4.72 121.20 119.82 1ioi s ILE 86 Ca -0.02 -0.88 0.05 0.00 -1.10 0.00 0.00 60.65 58.71 1ioi s ILE 86 Cb -0.03 -1.99 0.17 0.00 -1.06 0.00 0.00 42.46 39.55 1ioi s ILE 86 CO 0.01 0.57 0.52 -0.62 -0.10 0.00 0.00 174.94 175.32 1ioi s ASP 87 N -0.26 0.03 -0.12 3.58 3.68 -0.52 -1.77 116.67 121.30 1ioi s ASP 87 Ca 0.00 -2.03 -0.30 0.00 2.13 0.00 0.00 52.55 52.36 1ioi s ASP 87 Cb -0.13 0.88 -0.01 0.00 -1.45 0.00 0.00 42.92 42.21 1ioi s ASP 87 CO 0.03 -0.15 1.03 0.00 0.13 0.00 0.00 175.17 176.22 1ioi s ALA 88 N 0.84 3.45 -0.00 3.66 0.00 0.32 -4.61 121.76 125.41 1ioi s ALA 88 Ca 0.27 0.38 -0.22 0.00 0.00 0.00 0.00 51.96 52.38 1ioi s ALA 88 Cb -0.03 -3.46 -0.20 0.00 0.00 0.00 0.00 23.12 19.43 1ioi s ALA 88 CO -0.09 -0.68 1.17 -0.09 0.00 0.00 0.00 175.76 176.07 1ioi h ARG 89 N 7.19 0.28 -6.20 0.00 1.12 -1.90 -3.40 114.38 111.47 1ioi h ARG 89 Ca -0.30 -0.22 -0.49 0.00 -1.11 0.00 0.00 59.98 57.86 1ioi h ARG 89 Cb 1.14 0.04 -0.04 0.00 -0.01 0.00 0.00 29.97 31.10 1ioi h ARG 89 CO 0.87 0.86 -0.49 0.96 -3.11 0.00 0.00 179.97 179.07 1ioi s ILE 90 N -3.65 4.49 0.42 1.20 -0.00 -1.26 -5.06 121.20 117.34 1ioi s ILE 90 Ca -0.15 -1.30 -0.25 0.00 -0.00 0.00 0.00 60.65 58.96 1ioi s ILE 90 Cb 0.03 -3.47 -0.08 0.00 -0.00 0.00 0.00 42.46 38.94 1ioi s ILE 90 CO 0.76 -0.32 1.19 -2.16 -0.00 0.00 0.00 174.94 174.41 1ioi s PRO 91 N -3.90 3.96 1.24 0.37 0.04 -1.26 -4.67 135.00 130.77 1ioi s PRO 91 Ca 0.35 1.87 -0.16 0.00 0.04 0.00 0.00 61.00 63.10 1ioi s PRO 91 Cb -0.08 -2.62 0.31 0.00 0.04 0.00 0.00 34.50 32.15 1ioi s PRO 91 CO 0.26 -0.41 1.01 0.16 0.04 0.00 0.00 177.00 178.06 1ioi s ASP 92 N -1.13 0.44 0.00 6.66 3.84 -0.21 -4.81 116.67 121.46 1ioi s ASP 92 Ca 0.59 1.24 0.00 0.00 -0.00 0.00 0.00 52.55 54.38 1ioi s ASP 92 Cb -0.31 -1.89 0.00 0.00 -1.38 0.00 0.00 42.92 39.34 1ioi s ASP 92 CO 0.39 -4.49 0.68 0.59 -0.00 0.00 0.00 175.17 172.33 1ioi n ASN 93 N -5.09 0.00 -0.15 2.11 5.03 0.24 -1.18 115.26 116.21 1ioi n ASN 93 Ca 0.06 0.20 0.08 0.00 0.87 0.00 0.00 54.58 55.79 1ioi n ASN 93 Cb 0.56 -0.20 -0.06 0.00 -1.02 0.00 0.00 39.78 39.07 1ioi n ASN 93 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1ioi n GLU 94 N -1.18 1.58 0.00 3.52 1.02 -1.26 -4.98 120.64 119.34 1ioi n GLU 94 Ca 0.00 -0.34 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 1ioi n GLU 94 Cb 0.02 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1ioi n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ioi n GLY 95 N 1.32 0.74 3.51 0.62 0.00 -0.32 -5.08 105.19 105.97 1ioi n GLY 95 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1ioi n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ioi s LYS 96 N -0.52 3.28 -0.25 1.61 1.02 -1.25 -4.79 119.74 118.84 1ioi s LYS 96 Ca 0.00 -0.42 -0.14 0.00 0.02 0.00 0.00 55.97 55.42 1ioi s LYS 96 Cb 0.00 -4.00 -0.04 0.00 -0.52 0.00 0.00 37.83 33.26 1ioi s LYS 96 CO 0.00 -1.18 0.33 0.21 -0.92 0.00 0.00 175.35 173.79 1ioi s LYS 97 N 3.09 4.07 -0.23 1.68 2.20 -1.26 -1.05 119.74 128.24 1ioi s LYS 97 Ca 0.24 0.01 -0.01 0.00 -0.36 0.00 0.00 55.97 55.85 1ioi s LYS 97 Cb -0.15 -3.60 0.02 0.00 -1.51 0.00 0.00 37.83 32.59 1ioi s LYS 97 CO 0.18 -0.15 -0.08 0.42 -0.36 0.00 0.00 175.35 175.36 1ioi s ILE 98 N 1.66 2.79 -0.17 5.43 1.01 -1.26 -4.95 121.20 125.72 1ioi s ILE 98 Ca 0.14 -0.96 -0.06 0.00 0.00 0.00 0.00 60.65 59.77 1ioi s ILE 98 Cb -0.15 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 1ioi s ILE 98 CO 0.09 0.27 0.03 -1.61 0.00 0.00 0.00 174.94 173.71 1ioi s GLU 99 N 1.33 3.84 -1.16 2.79 0.41 -1.26 -0.52 118.70 124.12 1ioi s GLU 99 Ca 0.01 -0.40 -0.26 0.00 -0.41 0.00 0.00 54.97 53.91 1ioi s GLU 99 Cb -0.16 -3.10 0.01 0.00 -1.78 0.00 0.00 34.13 29.11 1ioi s GLU 99 CO -0.06 0.28 0.76 -0.25 -0.49 0.00 0.00 175.26 175.50 1ioi n ASP 100 N 3.47 -4.94 -4.57 -0.19 8.00 -0.80 -4.94 116.55 112.58 1ioi n ASP 100 Ca -0.17 -1.12 -0.32 0.00 0.71 0.00 0.00 54.79 53.90 1ioi n ASP 100 Cb 0.52 -2.77 -0.11 0.00 -0.02 0.00 0.00 41.12 38.75 1ioi n ASP 100 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1ioi s GLU 101 N -6.48 2.45 0.52 -1.24 2.56 -0.73 -4.94 118.70 110.84 1ioi s GLU 101 Ca 0.48 -0.78 -0.18 0.00 0.00 0.00 0.00 54.97 54.50 1ioi s GLU 101 Cb -0.21 -2.44 -0.07 0.00 2.00 0.00 0.00 34.13 33.42 1ioi s GLU 101 CO 0.90 0.59 1.01 -1.25 -0.56 0.00 0.00 175.26 175.95 1ioi s PRO 102 N -1.44 3.77 -0.07 4.30 0.04 -1.26 -0.42 135.00 139.92 1ioi s PRO 102 Ca 0.17 1.12 -0.00 0.00 0.04 0.00 0.00 61.00 62.33 1ioi s PRO 102 Cb -0.11 -2.10 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 1ioi s PRO 102 CO 0.07 -0.43 0.02 0.82 0.04 0.00 0.00 177.00 177.52 1ioi h ILE 103 N 1.02 0.00 -3.72 0.56 2.04 -1.88 -3.43 117.51 112.10 1ioi h ILE 103 Ca -0.48 -0.70 -0.68 0.00 1.00 0.00 0.00 64.86 64.00 1ioi h ILE 103 Cb 1.20 0.00 -0.36 0.00 -0.74 0.00 0.00 36.82 36.93 1ioi h ILE 103 CO 0.60 0.00 -0.70 -0.69 0.00 0.00 0.00 178.15 177.36 1ioi s VAL 104 N -1.44 2.72 -0.28 1.67 1.01 -1.26 -5.06 120.40 117.76 1ioi s VAL 104 Ca -0.00 -1.77 -0.38 0.00 0.00 0.00 0.00 61.98 59.83 1ioi s VAL 104 Cb 0.00 -2.72 -0.14 0.00 0.00 0.00 0.00 36.38 33.52 1ioi s VAL 104 CO 0.01 -0.30 1.92 -2.65 0.00 0.00 0.00 175.10 174.07 1ioi n PRO 105 N 4.50 1.26 0.00 2.72 -0.02 -1.26 -0.57 135.00 141.62 1ioi n PRO 105 Ca -0.08 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1ioi n PRO 105 Cb 0.42 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1ioi n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ioi n GLY 106 N 5.08 3.07 3.85 -1.23 0.00 -1.26 -5.03 105.19 109.66 1ioi n GLY 106 Ca 0.31 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.02 1ioi n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ioi s ALA 107 N -2.21 2.95 0.55 4.61 0.00 0.27 -4.98 121.76 122.94 1ioi s ALA 107 Ca 0.00 0.03 -0.18 0.00 0.00 0.00 0.00 51.96 51.81 1ioi s ALA 107 Cb 0.00 -3.12 -0.11 0.00 0.00 0.00 0.00 23.12 19.89 1ioi s ALA 107 CO 0.00 -0.79 0.32 -2.30 0.00 0.00 0.00 175.76 173.00 1ioi n PRO 108 N -2.65 0.35 -0.04 0.00 -0.02 -1.26 -4.91 135.00 126.46 1ioi n PRO 108 Ca 0.07 0.14 -0.08 0.00 -2.02 0.00 0.00 63.50 61.60 1ioi n PRO 108 Cb 0.54 -1.48 -0.02 0.00 -0.02 0.00 0.00 33.50 32.52 1ioi n PRO 108 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1ioi h THR 109 N 0.17 0.74 -3.67 3.45 2.02 -1.94 -3.39 112.91 110.29 1ioi h THR 109 Ca -0.44 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 66.64 1ioi h THR 109 Cb 1.42 0.74 -0.15 0.00 -1.74 0.00 0.00 68.15 68.41 1ioi h THR 109 CO 0.45 0.00 -0.37 0.00 0.37 0.00 0.00 175.52 175.98 1ioi s ALA 110 N -6.20 -0.32 -0.07 6.16 0.00 -1.26 0.11 121.76 120.18 1ioi s ALA 110 Ca -0.14 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.40 1ioi s ALA 110 Cb 0.11 0.40 0.02 0.00 0.00 0.00 0.00 23.12 23.64 1ioi s ALA 110 CO 0.69 -0.45 -0.08 0.71 0.00 0.00 0.00 175.76 176.63 1ioi s TYR 111 N -3.27 1.22 0.41 0.00 1.51 -0.40 -5.03 117.35 111.79 1ioi s TYR 111 Ca 0.00 -0.47 -0.24 0.00 -1.01 0.00 0.00 57.07 55.36 1ioi s TYR 111 Cb 0.02 -0.98 -0.08 0.00 -0.11 0.00 0.00 41.96 40.81 1ioi s TYR 111 CO -0.08 -0.31 1.11 -0.06 -1.11 0.00 0.00 175.55 175.10 1ioi s PHE 112 N 1.05 3.12 0.31 2.71 2.99 -1.26 -0.32 117.98 126.58 1ioi s PHE 112 Ca -0.08 1.60 -0.29 0.00 0.00 0.00 0.00 56.93 58.16 1ioi s PHE 112 Cb -0.14 -3.26 -0.10 0.00 0.00 0.00 0.00 43.02 39.52 1ioi s PHE 112 CO -0.01 -1.01 1.24 0.45 -0.00 0.00 0.00 175.22 175.89 1ioi s SER 113 N -1.41 6.94 0.03 1.36 0.15 -0.62 -4.91 113.70 115.24 1ioi s SER 113 Ca 0.59 2.55 0.24 0.00 0.70 0.00 0.00 55.95 60.03 1ioi s SER 113 Cb -0.26 -2.64 0.30 0.00 -1.71 0.00 0.00 66.02 61.71 1ioi s SER 113 CO 0.32 -0.40 1.26 0.35 1.20 0.00 0.00 173.24 175.97 1ioi n THR 114 N 0.92 0.08 -1.86 6.45 -2.24 -0.08 -4.94 114.28 112.61 1ioi n THR 114 Ca -0.00 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.31 1ioi n THR 114 Cb 0.43 0.28 0.03 0.00 -2.10 0.00 0.00 70.33 68.97 1ioi n THR 114 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1ioi s LEU 115 N -3.35 3.86 -0.92 3.22 1.43 -0.65 -4.65 118.68 117.62 1ioi s LEU 115 Ca 0.09 2.67 -0.21 0.00 -1.03 0.00 0.00 54.13 55.65 1ioi s LEU 115 Cb 0.16 -4.29 -0.12 0.00 0.03 0.00 0.00 46.19 41.97 1ioi s LEU 115 CO 0.74 -1.49 1.96 -0.81 0.23 0.00 0.00 176.35 176.98 1ioi n PRO 116 N -1.00 1.72 0.00 1.29 -0.04 -1.26 -4.82 135.00 130.90 1ioi n PRO 116 Ca 0.10 -2.06 0.03 0.00 -0.04 0.00 0.00 63.50 61.53 1ioi n PRO 116 Cb 0.46 -3.09 0.38 0.00 -0.04 0.00 0.00 33.50 31.21 1ioi n PRO 116 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 1ioi h ILE 117 N 4.69 1.14 -0.00 0.52 3.07 -1.93 -0.65 117.51 124.34 1ioi h ILE 117 Ca 0.41 -0.40 -0.18 0.00 1.55 0.00 0.00 64.86 66.24 1ioi h ILE 117 Cb 0.71 0.66 -0.02 0.00 -0.27 0.00 0.00 36.82 37.90 1ioi h ILE 117 CO 1.84 0.16 -0.83 0.11 -1.05 0.00 0.00 178.15 178.38 1ioi h LYS 118 N 0.53 0.14 -0.06 0.16 1.79 -1.98 -1.33 116.57 115.82 1ioi h LYS 118 Ca 0.13 -0.14 -0.14 0.00 -2.18 0.00 0.00 60.65 58.32 1ioi h LYS 118 Cb 0.07 0.04 0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1ioi h LYS 118 CO -0.02 0.88 -0.50 0.87 -1.08 0.00 0.00 179.45 179.61 1ioi h LYS 119 N 0.08 0.44 -0.03 3.15 6.56 -1.77 0.18 116.57 125.18 1ioi h LYS 119 Ca -0.03 -0.40 0.02 0.00 -1.06 0.00 0.00 60.65 59.19 1ioi h LYS 119 Cb 1.44 0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 33.16 1ioi h LYS 119 CO 0.12 1.04 -0.11 0.82 -2.06 0.00 0.00 179.45 179.26 1ioi h ILE 120 N -0.02 0.71 -0.90 1.86 2.04 -1.19 0.20 117.51 120.21 1ioi h ILE 120 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 1ioi h ILE 120 Cb 1.17 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 1ioi h ILE 120 CO 0.10 0.00 0.54 -0.03 0.00 0.00 0.00 178.15 178.76 1ioi h MET 121 N -0.17 1.22 -0.16 2.37 4.05 -1.12 -0.08 114.93 121.04 1ioi h MET 121 Ca 0.05 -0.11 -0.10 0.00 -0.28 0.00 0.00 59.70 59.26 1ioi h MET 121 Cb 0.24 -0.25 -0.01 0.00 -0.80 0.00 0.00 31.60 30.78 1ioi h MET 121 CO -0.14 0.86 -0.34 -0.22 0.23 0.00 0.00 176.91 177.31 1ioi h LYS 122 N 1.24 0.32 -0.12 0.39 3.64 -0.01 -2.04 116.57 119.99 1ioi h LYS 122 Ca 0.32 -0.14 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 1ioi h LYS 122 Cb -0.04 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1ioi h LYS 122 CO -0.06 0.63 -0.27 -0.22 -2.27 0.00 0.00 179.45 177.25 1ioi h LYS 123 N 0.28 0.40 -0.76 1.90 1.63 -0.46 -1.64 116.57 117.92 1ioi h LYS 123 Ca 0.03 -0.27 0.11 0.00 -0.85 0.00 0.00 60.65 59.67 1ioi h LYS 123 Cb 0.74 0.04 -0.08 0.00 -0.60 0.00 0.00 32.23 32.33 1ioi h LYS 123 CO 0.06 0.87 0.39 -0.07 -3.45 0.00 0.00 179.45 177.25 1ioi h LEU 124 N -0.03 0.50 -0.57 5.20 3.38 -0.91 -1.48 115.31 121.40 1ioi h LEU 124 Ca -0.00 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1ioi h LEU 124 Cb 0.88 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1ioi h LEU 124 CO 0.06 0.27 0.28 0.45 0.09 0.00 0.00 178.44 179.59 1ioi h HIS 125 N 0.63 0.82 0.00 1.13 3.86 -1.21 0.32 115.15 120.70 1ioi h HIS 125 Ca 0.38 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 1ioi h HIS 125 Cb 0.44 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.65 1ioi h HIS 125 CO -0.10 0.63 0.00 -0.85 0.86 0.00 0.00 177.93 178.47 1ioi n GLU 126 N -4.55 0.05 0.00 2.45 0.28 -0.63 -1.00 120.64 117.24 1ioi n GLU 126 Ca 0.03 0.06 0.15 0.00 -0.16 0.00 0.00 57.16 57.24 1ioi n GLU 126 Cb 0.12 -1.50 0.70 0.00 1.43 0.00 0.00 31.44 32.19 1ioi n GLU 126 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1ioi n ARG 127 N -1.47 0.97 -1.69 3.44 3.00 -0.62 -4.94 116.66 115.35 1ioi n ARG 127 Ca 0.07 -0.30 -0.11 0.00 -0.00 0.00 0.00 57.85 57.51 1ioi n ARG 127 Cb 0.28 -1.49 -0.03 0.00 0.00 0.00 0.00 32.46 31.22 1ioi n ARG 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ioi n GLY 128 N 1.17 0.69 3.55 5.14 0.00 -0.17 -5.02 105.19 110.54 1ioi n GLY 128 Ca 0.18 -0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1ioi n GLY 128 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ioi s ILE 129 N -2.47 5.25 0.17 -0.61 1.01 0.05 -4.98 121.20 119.62 1ioi s ILE 129 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.34 1ioi s ILE 129 Cb 0.00 -3.71 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 1ioi s ILE 129 CO 0.00 0.03 1.40 -2.16 0.00 0.00 0.00 174.94 174.20 1ioi s PRO 130 N 1.84 4.32 -0.09 2.79 0.04 -1.26 -3.31 135.00 139.33 1ioi s PRO 130 Ca 0.09 2.15 -0.23 0.00 0.04 0.00 0.00 61.00 63.04 1ioi s PRO 130 Cb -0.17 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.23 1ioi s PRO 130 CO 0.11 -0.40 0.54 0.00 0.04 0.00 0.00 177.00 177.30 1ioi s ALA 131 N 0.58 -1.39 0.23 8.56 0.00 -1.26 -2.16 121.76 126.32 1ioi s ALA 131 Ca 0.62 1.14 -0.09 0.00 0.00 0.00 0.00 51.96 53.62 1ioi s ALA 131 Cb -0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1ioi s ALA 131 CO 0.35 -0.31 0.37 1.52 0.00 0.00 0.00 175.76 177.69 1ioi s TYR 132 N -0.76 0.58 -0.41 0.00 -0.85 0.83 -4.96 117.35 111.79 1ioi s TYR 132 Ca -0.08 -0.91 -0.26 0.00 -0.52 0.00 0.00 57.07 55.30 1ioi s TYR 132 Cb -0.03 -0.04 0.02 0.00 0.38 0.00 0.00 41.96 42.30 1ioi s TYR 132 CO 0.06 -0.87 0.93 0.42 -1.52 0.00 0.00 175.55 174.56 1ioi s ILE 133 N -4.05 4.53 0.16 -3.49 1.09 -1.26 0.03 121.20 118.21 1ioi s ILE 133 Ca 0.27 0.99 -0.24 0.00 -1.10 0.00 0.00 60.65 60.57 1ioi s ILE 133 Cb 0.02 -4.38 -0.08 0.00 -1.06 0.00 0.00 42.46 36.96 1ioi s ILE 133 CO 0.09 -0.67 0.74 -0.55 -0.10 0.00 0.00 174.94 174.45 1ioi s SER 134 N 2.06 7.29 0.00 3.58 0.15 0.52 -4.89 113.70 122.41 1ioi s SER 134 Ca 0.38 1.55 0.18 0.00 0.70 0.00 0.00 55.95 58.76 1ioi s SER 134 Cb -0.11 -2.47 0.39 0.00 -1.71 0.00 0.00 66.02 62.12 1ioi s SER 134 CO 0.22 0.19 1.31 0.59 1.20 0.00 0.00 173.24 176.76 1ioi n ASN 135 N 1.47 3.22 -3.78 5.45 5.03 -1.26 -0.72 115.26 124.68 1ioi n ASN 135 Ca -0.06 -1.93 -0.13 0.00 0.87 0.00 0.00 54.58 53.34 1ioi n ASN 135 Cb 0.49 -0.26 -0.13 0.00 -1.02 0.00 0.00 39.78 38.87 1ioi n ASN 135 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1ioi s SER 136 N -1.20 -0.21 -0.16 6.41 0.15 -1.26 -4.71 113.70 112.72 1ioi s SER 136 Ca 0.33 0.42 0.16 0.00 0.70 0.00 0.00 55.95 57.56 1ioi s SER 136 Cb 0.19 0.38 0.62 0.00 -1.71 0.00 0.00 66.02 65.50 1ioi s SER 136 CO 0.26 -0.11 1.53 0.00 1.20 0.00 0.00 173.24 176.12 1ioi n ALA 137 N 3.46 3.15 -0.47 5.45 0.00 -1.26 -5.04 120.51 125.81 1ioi n ALA 137 Ca -0.18 -1.92 0.00 0.00 0.00 0.00 0.00 53.44 51.34 1ioi n ALA 137 Cb 0.56 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1ioi n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ioi n GLY 138 N 0.25 -0.28 2.18 0.00 0.00 -1.26 -3.45 105.19 102.63 1ioi n GLY 138 Ca 0.23 -1.06 -0.00 0.00 0.00 0.00 0.00 46.02 45.18 1ioi n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ioi n LEU 139 N 0.00 0.50 0.00 0.99 4.77 -1.26 -4.64 117.00 117.35 1ioi n LEU 139 Ca 0.00 -2.63 0.00 0.00 -0.03 0.00 0.00 56.01 53.35 1ioi n LEU 139 Cb 0.00 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1ioi n LEU 139 CO 0.00 1.07 0.00 0.00 -1.33 0.00 0.00 177.39 177.13 1ioi n TYR 140 N -0.39 0.00 0.05 -1.77 9.36 -1.26 -1.44 117.16 121.72 1ioi n TYR 140 Ca -0.03 0.00 0.18 0.00 3.32 0.00 0.00 57.90 61.38 1ioi n TYR 140 Cb 0.90 0.00 0.70 0.00 -0.63 0.00 0.00 39.34 40.31 1ioi n TYR 140 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1ioi h LEU 141 N 0.00 0.00 0.02 2.98 3.38 -1.97 -1.73 115.31 117.99 1ioi h LEU 141 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ioi h LEU 141 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ioi h LEU 141 CO 0.00 0.00 -0.01 0.28 0.09 0.00 0.00 178.44 178.80 1ioi h SER 142 N 0.00 -0.03 -0.59 -0.43 0.02 -1.96 -1.57 113.55 108.99 1ioi h SER 142 Ca 0.20 -0.29 -0.07 0.00 -0.84 0.00 0.00 61.79 60.79 1ioi h SER 142 Cb 0.85 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1ioi h SER 142 CO -0.00 0.28 0.09 -1.13 -1.14 0.00 0.00 176.83 174.93 1ioi h ASN 143 N -0.34 0.96 -0.01 3.07 -1.24 -1.54 0.83 115.58 117.32 1ioi h ASN 143 Ca -0.00 -0.22 0.03 0.00 0.71 0.00 0.00 56.30 56.82 1ioi h ASN 143 Cb 0.32 -0.25 -0.04 0.00 0.73 0.00 0.00 38.32 39.08 1ioi h ASN 143 CO 0.01 0.96 -0.21 0.22 -1.29 0.00 0.00 177.43 177.12 1ioi h TYR 144 N 0.94 -0.54 0.00 0.67 3.20 -1.28 0.16 116.97 120.13 1ioi h TYR 144 Ca 0.19 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.90 1ioi h TYR 144 Cb 0.42 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1ioi h TYR 144 CO 0.03 -0.29 -0.85 -0.39 -1.64 0.00 0.00 178.16 175.02 1ioi h VAL 145 N -0.33 1.58 -0.05 1.81 -1.51 -1.23 -1.20 116.25 115.33 1ioi h VAL 145 Ca 0.06 -2.81 -0.04 0.00 -1.23 0.00 0.00 66.70 62.68 1ioi h VAL 145 Cb 0.41 2.53 -0.01 0.00 -2.13 0.00 0.00 31.29 32.09 1ioi h VAL 145 CO -0.20 0.81 -0.16 -0.03 -1.23 0.00 0.00 177.57 176.76 1ioi h MET 146 N 0.02 0.07 0.00 5.19 1.85 -0.73 -2.81 114.93 118.52 1ioi h MET 146 Ca -0.02 -0.01 -0.09 0.00 -0.61 0.00 0.00 59.70 58.97 1ioi h MET 146 Cb 1.49 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 33.50 1ioi h MET 146 CO 0.12 0.24 -0.48 -0.92 -0.40 0.00 0.00 176.91 175.46 1ioi h TYR 147 N 0.07 0.00 -0.86 1.39 3.20 -0.50 -3.07 116.97 117.19 1ioi h TYR 147 Ca 0.01 0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.07 1ioi h TYR 147 Cb 0.34 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.54 1ioi h TYR 147 CO 0.00 1.14 0.57 -0.07 -1.64 0.00 0.00 178.16 178.16 1ioi h LEU 148 N -1.00 0.40 0.13 2.82 3.38 -1.22 0.35 115.31 120.16 1ioi h LEU 148 Ca -0.13 0.04 -0.27 0.00 0.09 0.00 0.00 57.88 57.61 1ioi h LEU 148 Cb 1.08 -0.04 0.03 0.00 0.09 0.00 0.00 40.66 41.81 1ioi h LEU 148 CO -0.08 0.17 -1.12 -1.28 0.09 0.00 0.00 178.44 176.22 1ioi h SER 149 N 0.40 0.76 0.45 -0.43 0.87 -1.66 0.07 113.55 114.01 1ioi h SER 149 Ca 0.44 -0.85 -0.04 0.00 -1.23 0.00 0.00 61.79 60.10 1ioi h SER 149 Cb 1.09 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.81 1ioi h SER 149 CO -0.16 1.54 -0.21 -0.07 -0.53 0.00 0.00 176.83 177.40 1ioi h LEU 150 N 0.09 0.00 -0.04 2.23 3.38 -1.27 -1.60 115.31 118.10 1ioi h LEU 150 Ca -0.18 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1ioi h LEU 150 Cb 1.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.58 1ioi h LEU 150 CO 0.21 0.21 -0.14 -0.74 0.09 0.00 0.00 178.44 178.08 1ioi h HIS 151 N 0.00 0.21 -0.82 1.13 2.76 -0.94 -1.87 115.15 115.63 1ioi h HIS 151 Ca -0.00 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.05 1ioi h HIS 151 Cb 0.49 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.38 1ioi h HIS 151 CO 0.00 0.76 0.39 1.25 -1.30 0.00 0.00 177.93 179.03 1ioi h HIS 152 N -0.41 1.18 -0.52 5.26 -0.00 -0.94 -0.36 115.15 119.37 1ioi h HIS 152 Ca -0.01 -0.06 0.07 0.00 -0.00 0.00 0.00 60.37 60.37 1ioi h HIS 152 Cb 0.77 -0.37 -0.06 0.00 -0.00 0.00 0.00 27.41 27.76 1ioi h HIS 152 CO 0.14 0.86 0.19 1.03 -0.00 0.00 0.00 177.93 180.15 1ioi h SER 153 N 1.17 0.20 -0.14 3.26 0.87 -1.24 0.14 113.55 117.82 1ioi h SER 153 Ca 0.28 0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.80 1ioi h SER 153 Cb 0.13 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1ioi h SER 153 CO -0.03 0.14 -0.23 0.00 -0.53 0.00 0.00 176.83 176.18 1ioi h ALA 154 N 1.34 1.04 0.09 6.23 0.00 -0.70 -1.48 119.26 125.78 1ioi h ALA 154 Ca 0.25 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1ioi h ALA 154 Cb 0.27 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ioi h ALA 154 CO -0.25 0.58 -0.52 1.15 0.00 0.00 0.00 179.25 180.21 1ioi h THR 155 N 0.51 1.61 -0.05 0.00 2.02 -0.91 -3.41 112.91 112.68 1ioi h THR 155 Ca 0.08 -2.47 0.00 0.00 0.77 0.00 0.00 66.41 64.79 1ioi h THR 155 Cb 0.67 3.27 0.00 0.00 -1.74 0.00 0.00 68.15 70.35 1ioi h THR 155 CO 0.05 0.68 0.00 0.29 0.37 0.00 0.00 175.52 176.91 1ioi n LYS 156 N -4.30 0.86 0.00 6.66 5.02 0.48 -5.01 118.16 121.86 1ioi n LYS 156 Ca -0.13 -1.29 0.00 0.00 -2.02 0.00 0.00 58.31 54.88 1ioi n LYS 156 Cb 0.70 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 1ioi n LYS 156 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ioi n GLY 157 N 0.64 3.00 3.11 0.72 0.00 -0.56 -4.99 105.19 107.11 1ioi n GLY 157 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1ioi n GLY 157 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ioi s TYR 158 N -1.41 0.80 0.95 1.61 -0.85 -1.25 -4.34 117.35 112.86 1ioi s TYR 158 Ca 0.00 -0.61 -0.12 0.00 -0.52 0.00 0.00 57.07 55.83 1ioi s TYR 158 Cb 0.00 -0.47 0.10 0.00 0.38 0.00 0.00 41.96 41.97 1ioi s TYR 158 CO 0.00 -0.08 0.77 -0.35 -1.52 0.00 0.00 175.55 174.37 1ioi n PRO 159 N 1.01 -0.48 0.08 -3.49 -0.04 -1.25 -3.15 135.00 127.67 1ioi n PRO 159 Ca -0.19 -0.09 -0.20 0.00 -0.04 0.00 0.00 63.50 62.98 1ioi n PRO 159 Cb 0.56 -2.11 -0.15 0.00 -0.04 0.00 0.00 33.50 31.77 1ioi n PRO 159 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1ioi h LYS 160 N -1.78 0.33 -6.01 0.54 6.56 -1.18 -3.42 116.57 111.61 1ioi h LYS 160 Ca -0.44 -0.56 -0.69 0.00 -1.06 0.00 0.00 60.65 57.90 1ioi h LYS 160 Cb 1.28 0.21 -0.30 0.00 -0.57 0.00 0.00 32.23 32.85 1ioi h LYS 160 CO 0.38 1.22 -0.86 -1.64 -2.06 0.00 0.00 179.45 176.49 1ioi s MET 161 N -2.60 2.60 -0.02 3.15 -1.94 -0.95 -4.95 119.30 114.59 1ioi s MET 161 Ca -0.11 -0.86 -0.10 0.00 -1.71 0.00 0.00 55.69 52.90 1ioi s MET 161 Cb 0.06 -2.22 0.01 0.00 2.01 0.00 0.00 34.83 34.69 1ioi s MET 161 CO 0.86 0.40 0.21 0.45 -0.01 0.00 0.00 175.02 176.94 1ioi s SER 162 N -0.20 -0.09 0.00 3.03 0.15 -1.25 -0.63 113.70 114.71 1ioi s SER 162 Ca -0.02 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.62 1ioi s SER 162 Cb -0.13 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1ioi s SER 162 CO 0.03 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.72 1ioi n GLY 163 N 1.58 -0.31 3.13 9.45 0.00 -1.13 -0.90 105.19 117.01 1ioi n GLY 163 Ca -0.21 -0.99 -0.26 0.00 0.00 0.00 0.00 46.02 44.56 1ioi n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ioi s PHE 164 N -2.00 1.66 -0.13 1.61 2.19 -1.26 -0.50 117.98 119.55 1ioi s PHE 164 Ca 0.00 -0.45 0.03 0.00 0.33 0.00 0.00 56.93 56.83 1ioi s PHE 164 Cb 0.00 -1.11 0.01 0.00 -1.31 0.00 0.00 43.02 40.61 1ioi s PHE 164 CO 0.00 -0.14 -0.21 0.42 1.83 0.00 0.00 175.22 177.12 1ioi s ILE 165 N -0.02 1.92 -0.24 3.12 1.09 0.25 -1.58 121.20 125.74 1ioi s ILE 165 Ca -0.02 -0.90 -0.10 0.00 -1.10 0.00 0.00 60.65 58.52 1ioi s ILE 165 Cb -0.11 -1.70 -0.05 0.00 -1.06 0.00 0.00 42.46 39.54 1ioi s ILE 165 CO 0.02 0.52 0.15 -1.00 -0.10 0.00 0.00 174.94 174.53 1ioi s HIS 166 N 0.77 3.28 0.03 3.97 3.76 0.21 -0.42 115.29 126.90 1ioi s HIS 166 Ca -0.09 0.16 0.02 0.00 -0.15 0.00 0.00 55.06 55.00 1ioi s HIS 166 Cb -0.16 -2.27 -0.04 0.00 1.11 0.00 0.00 32.58 31.22 1ioi s HIS 166 CO -0.00 0.01 0.02 0.14 -0.85 0.00 0.00 174.74 174.06 1ioi s VAL 167 N 1.15 4.22 1.34 -0.90 -7.23 0.93 -0.70 120.40 119.20 1ioi s VAL 167 Ca 0.07 -0.70 -0.20 0.00 -1.81 0.00 0.00 61.98 59.34 1ioi s VAL 167 Cb -0.14 -2.94 0.34 0.00 0.56 0.00 0.00 36.38 34.20 1ioi s VAL 167 CO 0.05 0.28 0.97 -2.84 -0.31 0.00 0.00 175.10 173.25 1ioi s PRO 168 N -1.87 -2.30 0.64 4.82 0.02 -1.26 -0.81 135.00 134.24 1ioi s PRO 168 Ca 0.23 0.27 -0.17 0.00 0.02 0.00 0.00 61.00 61.34 1ioi s PRO 168 Cb -0.12 -1.44 -0.01 0.00 0.02 0.00 0.00 34.50 32.95 1ioi s PRO 168 CO 0.14 -4.50 1.21 0.71 -0.33 0.00 0.00 177.00 174.24 1ioi s TYR 169 N -2.40 2.27 0.18 6.54 2.02 -1.20 -4.73 117.35 120.03 1ioi s TYR 169 Ca 0.69 1.54 -0.05 0.00 -0.37 0.00 0.00 57.07 58.87 1ioi s TYR 169 Cb -0.16 -3.48 -0.06 0.00 -0.40 0.00 0.00 41.96 37.86 1ioi s TYR 169 CO 0.59 -2.38 0.43 0.96 -1.57 0.00 0.00 175.55 173.58 1ioi s ILE 170 N -1.73 5.11 0.30 2.71 -0.00 -1.25 -0.15 121.20 126.19 1ioi s ILE 170 Ca 0.76 0.07 0.05 0.00 -0.00 0.00 0.00 60.65 61.54 1ioi s ILE 170 Cb -0.30 -3.64 0.29 0.00 -0.00 0.00 0.00 42.46 38.81 1ioi s ILE 170 CO 0.38 -0.04 1.75 -0.65 -0.00 0.00 0.00 174.94 176.38 1ioi h PRO 171 N 2.58 0.61 0.00 0.37 0.11 -1.93 0.11 132.00 133.85 1ioi h PRO 171 Ca -0.46 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ioi h PRO 171 Cb 1.17 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1ioi h PRO 171 CO 0.71 0.40 -0.01 1.05 -0.21 0.00 0.00 178.00 179.94 1ioi h GLU 172 N 0.63 0.00 0.00 1.05 9.09 -1.95 -1.19 114.58 122.21 1ioi h GLU 172 Ca 0.58 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.99 1ioi h GLU 172 Cb 0.98 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.08 1ioi h GLU 172 CO -0.43 0.01 -0.62 1.96 0.05 0.00 0.00 179.01 179.98 1ioi h GLN 173 N 0.00 0.00 -0.03 1.06 4.20 -1.17 -3.35 115.11 115.82 1ioi h GLN 173 Ca -0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.54 1ioi h GLN 173 Cb 0.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1ioi h GLN 173 CO 0.00 0.00 -0.73 0.82 -0.67 0.00 0.00 178.83 178.26 1ioi h ILE 174 N 0.00 1.45 0.00 2.54 1.08 -1.25 -3.32 117.51 118.02 1ioi h ILE 174 Ca 0.00 -2.30 -0.00 0.00 -0.39 0.00 0.00 64.86 62.17 1ioi h ILE 174 Cb 0.97 2.23 -0.00 0.00 -3.07 0.00 0.00 36.82 36.95 1ioi h ILE 174 CO 0.00 0.67 -0.02 0.16 -0.69 0.00 0.00 178.15 178.27 1ioi h ILE 175 N 0.12 0.08 -0.00 -0.67 3.07 -1.68 -0.69 117.51 117.74 1ioi h ILE 175 Ca -0.02 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 66.00 1ioi h ILE 175 Cb 1.28 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 39.19 1ioi h ILE 175 CO 0.11 0.02 -0.47 -0.90 -1.05 0.00 0.00 178.15 175.86 1ioi n ASP 176 N -3.16 0.71 0.00 2.16 5.68 -1.25 -3.82 116.55 116.88 1ioi n ASP 176 Ca -0.01 -0.50 -0.16 0.00 -0.50 0.00 0.00 54.79 53.62 1ioi n ASP 176 Cb 0.24 0.28 -0.05 0.00 -1.14 0.00 0.00 41.12 40.44 1ioi n ASP 176 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1ioi h LYS 177 N 0.38 0.69 -0.94 0.11 1.79 -1.30 -3.08 116.57 114.22 1ioi h LYS 177 Ca 0.00 -0.59 0.27 0.00 -2.18 0.00 0.00 60.65 58.14 1ioi h LYS 177 Cb 0.51 0.13 -0.14 0.00 -1.58 0.00 0.00 32.23 31.15 1ioi h LYS 177 CO 0.00 1.20 0.43 0.82 -1.08 0.00 0.00 179.45 180.82 1ioi h ILE 178 N 0.46 0.36 -0.65 1.86 2.04 -0.10 0.18 117.51 121.66 1ioi h ILE 178 Ca -0.06 -0.11 0.08 0.00 1.00 0.00 0.00 64.86 65.77 1ioi h ILE 178 Cb 1.43 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 1ioi h ILE 178 CO 0.16 0.06 0.32 1.23 0.00 0.00 0.00 178.15 179.92 1ioi h GLY 179 N 0.33 0.95 -4.00 5.37 0.00 -1.66 -2.00 103.07 102.06 1ioi h GLY 179 Ca 0.63 -0.20 -0.65 0.00 0.00 0.00 0.00 47.33 47.11 1ioi h GLY 179 CO -0.59 0.07 0.85 0.58 0.00 0.00 0.00 176.54 177.45 1ioi n LYS 180 N -4.88 2.62 -1.61 4.80 2.85 0.13 -4.88 118.16 117.20 1ioi n LYS 180 Ca 0.09 -3.16 -0.11 0.00 -1.05 0.00 0.00 58.31 54.08 1ioi n LYS 180 Cb 0.23 -2.23 -0.03 0.00 -0.65 0.00 0.00 35.03 32.34 1ioi n LYS 180 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ioi n GLY 181 N -0.80 0.81 2.99 2.58 0.00 -0.75 -5.02 105.19 105.00 1ioi n GLY 181 Ca 0.60 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1ioi n GLY 181 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ioi s GLN 182 N -3.46 0.94 -0.43 1.61 -0.44 0.41 -4.93 119.66 113.36 1ioi s GLN 182 Ca 0.00 -0.28 0.02 0.00 -2.50 0.00 0.00 55.36 52.60 1ioi s GLN 182 Cb 0.00 -0.88 0.13 0.00 -1.64 0.00 0.00 33.01 30.62 1ioi s GLN 182 CO 0.00 0.09 0.21 0.54 0.50 0.00 0.00 175.29 176.64 1ioi s VAL 183 N 0.25 1.52 0.69 1.34 0.11 -1.26 0.04 120.40 123.09 1ioi s VAL 183 Ca -0.04 -2.49 -0.14 0.00 -2.93 0.00 0.00 61.98 56.38 1ioi s VAL 183 Cb -0.09 -2.08 0.02 0.00 -1.53 0.00 0.00 36.38 32.70 1ioi s VAL 183 CO 0.00 -0.84 1.12 -2.84 -3.33 0.00 0.00 175.10 169.22 1ioi s PRO 184 N 0.47 2.57 0.37 1.54 0.02 -1.26 -5.02 135.00 133.68 1ioi s PRO 184 Ca 0.16 1.42 -0.28 0.00 0.02 0.00 0.00 61.00 62.32 1ioi s PRO 184 Cb -0.24 -1.92 -0.10 0.00 0.02 0.00 0.00 34.50 32.26 1ioi s PRO 184 CO -0.03 -1.43 1.38 -2.14 -0.33 0.00 0.00 177.00 174.45 1ioi s PRO 185 N -4.20 4.17 0.23 5.54 0.02 -1.26 -4.96 135.00 134.53 1ioi s PRO 185 Ca 0.67 2.35 0.07 0.00 0.02 0.00 0.00 61.00 64.11 1ioi s PRO 185 Cb -0.21 -2.96 -0.05 0.00 0.02 0.00 0.00 34.50 31.29 1ioi s PRO 185 CO 0.45 -0.40 -0.10 -1.54 -0.33 0.00 0.00 177.00 175.08 1ioi s SER 186 N -0.40 2.55 -0.10 2.53 1.04 -1.26 -3.23 113.70 114.83 1ioi s SER 186 Ca 0.52 -1.10 -0.09 0.00 0.48 0.00 0.00 55.95 55.77 1ioi s SER 186 Cb -0.42 -0.13 0.03 0.00 0.10 0.00 0.00 66.02 65.60 1ioi s SER 186 CO 0.56 -0.27 0.27 -0.32 0.98 0.00 0.00 173.24 174.47 1ioi s MET 187 N -3.70 0.31 0.40 4.02 1.75 0.78 -4.91 119.30 117.96 1ioi s MET 187 Ca 0.25 0.41 -0.26 0.00 -1.25 0.00 0.00 55.69 54.84 1ioi s MET 187 Cb 0.02 0.12 -0.09 0.00 2.84 0.00 0.00 34.83 37.72 1ioi s MET 187 CO 0.09 -0.06 1.24 -1.54 -0.65 0.00 0.00 175.02 174.10 1ioi s SER 188 N 0.32 6.42 0.27 1.11 1.04 -1.26 -3.91 113.70 117.69 1ioi s SER 188 Ca -0.01 2.52 0.00 0.00 0.48 0.00 0.00 55.95 58.94 1ioi s SER 188 Cb -0.03 -2.63 0.62 0.00 0.10 0.00 0.00 66.02 64.09 1ioi s SER 188 CO -0.01 -0.76 1.69 0.22 0.98 0.00 0.00 173.24 175.36 1ioi h TYR 189 N 2.69 0.52 -0.57 5.02 3.20 -1.98 -0.05 116.97 125.80 1ioi h TYR 189 Ca -0.49 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.39 1ioi h TYR 189 Cb 1.24 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 39.39 1ioi h TYR 189 CO 0.54 -0.05 0.22 0.93 -1.64 0.00 0.00 178.16 178.16 1ioi h GLU 190 N 0.36 0.83 -0.12 1.82 3.07 -1.99 -0.98 114.58 117.58 1ioi h GLU 190 Ca 0.50 -0.13 -0.17 0.00 -0.50 0.00 0.00 59.36 59.06 1ioi h GLU 190 Cb 0.91 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 1ioi h GLU 190 CO -0.52 0.69 -0.64 1.98 -1.40 0.00 0.00 179.01 179.13 1ioi h MET 191 N 0.82 0.43 0.40 2.33 4.05 -1.38 -2.61 114.93 118.96 1ioi h MET 191 Ca 0.19 -0.31 -0.02 0.00 -0.28 0.00 0.00 59.70 59.29 1ioi h MET 191 Cb 0.18 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.03 1ioi h MET 191 CO -0.02 0.92 -0.19 0.93 0.23 0.00 0.00 176.91 178.79 1ioi h GLU 192 N 0.31 -0.51 -0.79 0.39 5.08 -1.20 -0.63 114.58 117.24 1ioi h GLU 192 Ca -0.01 0.04 0.17 0.00 -1.00 0.00 0.00 59.36 58.56 1ioi h GLU 192 Cb 1.18 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 30.44 1ioi h GLU 192 CO 0.11 -0.20 0.26 1.25 -1.00 0.00 0.00 179.01 179.43 1ioi h LEU 193 N -0.95 0.16 -0.88 1.33 5.85 -1.28 -1.10 115.31 118.45 1ioi h LEU 193 Ca -0.05 0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1ioi h LEU 193 Cb 0.55 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1ioi h LEU 193 CO 0.09 0.01 -0.33 -0.08 -0.34 0.00 0.00 178.44 177.79 1ioi h GLU 194 N 0.35 0.44 -0.42 1.25 4.57 -1.41 -1.52 114.58 117.83 1ioi h GLU 194 Ca 0.45 -0.19 -0.08 0.00 -1.18 0.00 0.00 59.36 58.37 1ioi h GLU 194 Cb 0.78 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.34 1ioi h GLU 194 CO -0.49 0.72 -0.03 0.00 -1.18 0.00 0.00 179.01 178.02 1ioi h ALA 195 N 1.28 0.57 0.00 2.92 0.00 0.09 0.56 119.26 124.68 1ioi h ALA 195 Ca 0.05 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1ioi h ALA 195 Cb 0.76 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ioi h ALA 195 CO 0.06 0.39 -0.66 -0.24 0.00 0.00 0.00 179.25 178.80 1ioi h VAL 196 N 0.60 1.40 -0.16 0.00 3.04 -1.12 -1.63 116.25 118.39 1ioi h VAL 196 Ca 0.12 -2.32 -0.15 0.00 -1.01 0.00 0.00 66.70 63.33 1ioi h VAL 196 Cb 0.53 2.28 -0.01 0.00 -2.01 0.00 0.00 31.29 32.08 1ioi h VAL 196 CO 0.03 0.65 -0.55 0.11 -1.01 0.00 0.00 177.57 176.79 1ioi h LYS 197 N 0.00 0.48 0.00 4.17 1.57 -1.05 -2.29 116.57 119.45 1ioi h LYS 197 Ca -0.01 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 1ioi h LYS 197 Cb 1.22 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 1ioi h LYS 197 CO 0.09 0.90 -0.14 0.28 -0.57 0.00 0.00 179.45 180.01 1ioi h VAL 198 N 0.37 0.72 -0.02 0.50 2.07 -0.61 -2.58 116.25 116.69 1ioi h VAL 198 Ca 0.01 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1ioi h VAL 198 Cb 1.08 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1ioi h VAL 198 CO 0.10 0.14 -0.04 0.00 0.02 0.00 0.00 177.57 177.79 1ioi h ALA 199 N 1.86 0.04 -0.58 1.67 0.00 -0.91 -2.34 119.26 119.00 1ioi h ALA 199 Ca -0.00 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 54.73 1ioi h ALA 199 Cb 0.34 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.03 1ioi h ALA 199 CO 0.02 -0.16 0.10 0.82 0.00 0.00 0.00 179.25 180.03 1ioi h ILE 200 N -0.44 0.64 -0.53 0.00 1.08 -1.31 -1.43 117.51 115.52 1ioi h ILE 200 Ca 0.00 -0.08 -0.03 0.00 -0.39 0.00 0.00 64.86 64.36 1ioi h ILE 200 Cb 0.58 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 1ioi h ILE 200 CO 0.01 0.04 0.22 -0.33 -0.69 0.00 0.00 178.15 177.40 1ioi h GLU 201 N 0.23 0.78 0.00 2.37 5.08 -1.48 -1.78 114.58 119.78 1ioi h GLU 201 Ca 0.30 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.43 1ioi h GLU 201 Cb 0.45 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1ioi h GLU 201 CO -0.40 0.68 -0.45 -0.39 -1.00 0.00 0.00 179.01 177.45 1ioi h VAL 202 N 0.71 0.85 -0.15 3.13 -1.51 -0.81 -2.59 116.25 115.88 1ioi h VAL 202 Ca 0.18 -1.95 0.04 0.00 -1.23 0.00 0.00 66.70 63.73 1ioi h VAL 202 Cb 0.18 2.24 -0.04 0.00 -2.13 0.00 0.00 31.29 31.55 1ioi h VAL 202 CO -0.02 0.44 -0.07 0.00 -1.23 0.00 0.00 177.57 176.69 1ioi h ALA 203 N 1.55 0.05 -0.38 5.19 0.00 -1.15 -2.53 119.26 121.99 1ioi h ALA 203 Ca -0.00 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1ioi h ALA 203 Cb 1.21 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 1ioi h ALA 203 CO 0.06 -0.52 -0.11 -0.07 0.00 0.00 0.00 179.25 178.61 1ioi h LEU 204 N -0.06 0.65 -0.16 0.00 3.38 -1.24 0.79 115.31 118.67 1ioi h LEU 204 Ca 0.08 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1ioi h LEU 204 Cb 0.18 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1ioi h LEU 204 CO -0.19 0.79 0.00 -0.62 0.09 0.00 0.00 178.44 178.51 1ioi n GLU 205 N -4.18 0.05 -0.11 1.13 1.02 -0.98 -3.55 120.64 114.01 1ioi n GLU 205 Ca 0.01 0.28 -0.21 0.00 -0.02 0.00 0.00 57.16 57.22 1ioi n GLU 205 Cb 0.35 -1.59 -0.08 0.00 -0.02 0.00 0.00 31.44 30.10 1ioi n GLU 205 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ioi n GLU 206 N -1.68 0.56 -1.70 3.49 4.71 -0.93 -4.75 120.64 120.34 1ioi n GLU 206 Ca 0.03 0.34 -0.41 0.00 -0.01 0.00 0.00 57.16 57.11 1ioi n GLU 206 Cb 0.20 -1.55 -0.02 0.00 -1.01 0.00 0.00 31.44 29.05 1ioi n GLU 206 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1ioi n LEU 207 N -4.37 5.45 0.00 -4.62 -0.00 0.23 -5.12 117.00 108.57 1ioi n LEU 207 Ca -0.36 -3.65 0.00 0.00 -0.00 0.00 0.00 56.01 51.99 1ioi n LEU 207 Cb 0.70 -1.51 0.00 0.00 -0.00 0.00 0.00 43.42 42.61 1ioi n LEU 207 CO 0.11 0.29 0.00 0.18 -0.00 0.00 0.00 177.39 177.97