#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bof h ALA 11 N 0.00 0.36 -0.74 7.82 0.00 -1.98 -0.02 119.26 124.71 1bof h ALA 11 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1bof h ALA 11 Cb 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1bof h ALA 11 CO 0.00 0.32 0.49 0.00 0.00 0.00 0.00 179.25 180.05 1bof h ALA 12 N 0.68 0.93 -0.68 0.00 0.00 -1.99 0.33 119.26 118.54 1bof h ALA 12 Ca 0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1bof h ALA 12 Cb 0.78 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1bof h ALA 12 CO 0.06 0.36 0.23 0.28 0.00 0.00 0.00 179.25 180.18 1bof h VAL 13 N 1.00 1.25 0.05 0.00 2.07 -1.96 -2.03 116.25 116.63 1bof h VAL 13 Ca 0.27 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1bof h VAL 13 Cb -0.11 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1bof h VAL 13 CO -0.06 0.33 -0.04 -0.33 0.02 0.00 0.00 177.57 177.48 1bof h GLU 14 N 0.98 -0.10 -0.54 1.57 4.39 0.29 -2.56 114.58 118.60 1bof h GLU 14 Ca 0.22 0.01 0.07 0.00 0.34 0.00 0.00 59.36 60.00 1bof h GLU 14 Cb 0.27 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 1bof h GLU 14 CO -0.01 -0.07 0.21 0.00 -1.16 0.00 0.00 179.01 177.98 1bof h ARG 15 N -0.10 0.39 0.00 2.33 3.08 -0.86 -2.68 114.38 116.54 1bof h ARG 15 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1bof h ARG 15 Cb 0.10 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1bof h ARG 15 CO -0.01 0.26 0.05 0.43 -1.07 0.00 0.00 179.97 179.62 1bof n SER 16 N -4.98 0.32 0.15 7.04 7.64 -0.77 -1.82 113.62 121.20 1bof n SER 16 Ca 0.06 0.63 0.07 0.00 1.01 0.00 0.00 58.87 60.64 1bof n SER 16 Cb 0.22 -0.66 0.06 0.00 -1.01 0.00 0.00 64.21 62.82 1bof n SER 16 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1bof h LYS 17 N 0.00 0.00 -7.06 1.43 1.57 -1.42 -3.47 116.57 107.62 1bof h LYS 17 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1bof h LYS 17 Cb 0.09 0.00 0.16 0.00 0.08 0.00 0.00 32.23 32.56 1bof h LYS 17 CO 0.00 0.20 0.50 -1.33 -0.57 0.00 0.00 179.45 178.25 1bof n MET 18 N -3.04 1.25 0.00 3.15 2.81 -0.75 -4.96 117.12 115.58 1bof n MET 18 Ca 0.01 0.48 0.00 0.00 -1.81 0.00 0.00 57.70 56.38 1bof n MET 18 Cb 0.64 -2.51 0.00 0.00 -0.71 0.00 0.00 33.22 30.64 1bof n MET 18 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1bof n ILE 19 N -1.67 0.22 0.20 2.02 -5.35 -1.26 -4.88 119.36 108.64 1bof n ILE 19 Ca 0.14 -0.34 0.04 0.00 -0.27 0.00 0.00 62.75 62.32 1bof n ILE 19 Cb 0.47 1.16 0.41 0.00 -1.74 0.00 0.00 39.64 39.95 1bof n ILE 19 CO 0.00 0.00 0.00 -2.24 -1.76 0.00 0.00 176.55 172.55 1bof h ASP 20 N 0.00 0.00 0.31 7.28 2.03 -2.00 -2.57 116.42 121.47 1bof h ASP 20 Ca 0.00 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.28 1bof h ASP 20 Cb 0.51 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.01 1bof h ASP 20 CO 0.00 0.33 -0.08 0.03 -1.03 0.00 0.00 179.24 178.48 1bof h ARG 21 N 0.00 0.00 0.00 4.15 3.08 -1.90 -1.94 114.38 117.78 1bof h ARG 21 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bof h ARG 21 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 1bof h ARG 21 CO 0.04 0.08 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.11 1bof h ASN 22 N 0.00 0.00 0.63 7.04 2.35 -1.83 -2.43 115.58 121.34 1bof h ASN 22 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1bof h ASN 22 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1bof h ASN 22 CO 0.01 0.01 -0.18 0.18 -1.65 0.00 0.00 177.43 175.80 1bof n LEU 23 N -3.11 0.31 -4.66 1.61 7.99 -0.73 -4.82 117.00 113.58 1bof n LEU 23 Ca -0.01 0.18 -0.35 0.00 -0.01 0.00 0.00 56.01 55.83 1bof n LEU 23 Cb 0.23 -0.31 -0.10 0.00 -0.11 0.00 0.00 43.42 43.13 1bof n LEU 23 CO 0.25 0.07 -0.30 -0.13 -1.51 0.00 0.00 177.39 175.77 1bof s ARG 24 N -2.81 3.25 0.19 3.23 0.52 -0.91 -5.03 118.95 117.39 1bof s ARG 24 Ca 0.19 -0.40 -0.21 0.00 -0.52 0.00 0.00 55.73 54.79 1bof s ARG 24 Cb 0.19 -2.89 0.12 0.00 0.52 0.00 0.00 34.95 32.88 1bof s ARG 24 CO 0.56 0.58 1.58 1.49 0.02 0.00 0.00 175.30 179.53 1bof h GLU 25 N 5.59 -0.15 -2.08 3.54 4.81 -1.88 -1.97 114.58 122.44 1bof h GLU 25 Ca -0.46 0.01 -0.62 0.00 -0.13 0.00 0.00 59.36 58.16 1bof h GLU 25 Cb 1.19 0.03 -0.40 0.00 0.63 0.00 0.00 28.75 30.21 1bof h GLU 25 CO 0.58 -0.10 -0.43 -0.25 -0.73 0.00 0.00 179.01 178.08 1bof n ASP 26 N -5.43 4.96 -0.25 1.04 8.00 -1.26 -4.90 116.55 118.71 1bof n ASP 26 Ca 0.04 -3.70 0.14 0.00 0.71 0.00 0.00 54.79 51.98 1bof n ASP 26 Cb 0.36 -0.62 0.42 0.00 -0.02 0.00 0.00 41.12 41.26 1bof n ASP 26 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1bof h GLY 27 N 3.00 1.08 2.00 0.44 0.00 -1.44 -1.46 103.07 106.69 1bof h GLY 27 Ca 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1bof h GLY 27 CO 0.89 0.06 0.00 0.83 0.00 0.00 0.00 176.54 178.32 1bof h GLU 28 N 0.59 0.00 -0.02 4.80 5.08 -1.87 -1.43 114.58 121.73 1bof h GLU 28 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1bof h GLU 28 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1bof h GLU 28 CO -0.19 0.00 -0.18 1.63 -1.00 0.00 0.00 179.01 179.27 1bof n LYS 29 N -2.33 1.68 -2.08 2.33 4.76 -0.55 -4.99 118.16 116.98 1bof n LYS 29 Ca 0.00 -1.36 -0.33 0.00 -2.87 0.00 0.00 58.31 53.75 1bof n LYS 29 Cb 0.15 -1.39 0.01 0.00 -1.84 0.00 0.00 35.03 31.96 1bof n LYS 29 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1bof s ALA 30 N -1.93 2.76 -0.25 7.82 0.00 -0.54 -5.03 121.76 124.59 1bof s ALA 30 Ca 0.20 0.39 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 1bof s ALA 30 Cb 0.16 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 20.01 1bof s ALA 30 CO 0.36 -0.77 0.22 0.00 0.00 0.00 0.00 175.76 175.58 1bof s ALA 31 N -2.45 3.57 -0.22 0.00 0.00 0.07 -4.86 121.76 117.88 1bof s ALA 31 Ca 0.63 -0.90 -0.24 0.00 0.00 0.00 0.00 51.96 51.46 1bof s ALA 31 Cb -0.16 -2.45 -0.01 0.00 0.00 0.00 0.00 23.12 20.50 1bof s ALA 31 CO 0.36 -0.37 0.77 0.50 0.00 0.00 0.00 175.76 177.02 1bof s ARG 32 N 1.43 4.21 -0.08 0.00 6.06 -1.26 -0.45 118.95 128.86 1bof s ARG 32 Ca 0.10 0.86 -0.03 0.00 -2.50 0.00 0.00 55.73 54.15 1bof s ARG 32 Cb -0.15 -3.62 -0.04 0.00 0.06 0.00 0.00 34.95 31.21 1bof s ARG 32 CO 0.08 -0.42 0.07 -1.21 -2.50 0.00 0.00 175.30 171.32 1bof s GLU 33 N 2.49 3.16 -0.14 5.12 2.02 -0.01 -0.61 118.70 130.73 1bof s GLU 33 Ca 0.34 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 55.01 1bof s GLU 33 Cb -0.16 -2.94 0.02 0.00 0.10 0.00 0.00 34.13 31.15 1bof s GLU 33 CO 0.09 0.72 -0.15 0.08 0.02 0.00 0.00 175.26 176.02 1bof s VAL 34 N -1.00 1.59 -0.31 2.63 1.01 -0.30 -4.03 120.40 119.99 1bof s VAL 34 Ca 0.16 -0.66 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 1bof s VAL 34 Cb -0.12 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 1bof s VAL 34 CO 0.05 0.46 0.25 -0.75 0.00 0.00 0.00 175.10 175.12 1bof s LYS 35 N 1.33 3.75 -0.14 2.72 2.20 -1.26 -0.38 119.74 127.96 1bof s LYS 35 Ca 0.02 -0.40 0.02 0.00 -0.36 0.00 0.00 55.97 55.24 1bof s LYS 35 Cb -0.13 -3.73 0.00 0.00 -1.51 0.00 0.00 37.83 32.46 1bof s LYS 35 CO -0.08 -0.33 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.21 1bof s LEU 36 N 1.82 2.25 -0.17 5.43 2.96 0.09 -1.02 118.68 130.03 1bof s LEU 36 Ca 0.08 -0.54 -0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1bof s LEU 36 Cb -0.17 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 1bof s LEU 36 CO 0.11 0.10 0.05 -0.22 -1.32 0.00 0.00 176.35 175.06 1bof s LEU 37 N 0.73 3.75 -0.24 -0.68 2.96 -0.76 -0.52 118.68 123.91 1bof s LEU 37 Ca -0.08 0.07 -0.07 0.00 -0.22 0.00 0.00 54.13 53.82 1bof s LEU 37 Cb -0.16 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.56 1bof s LEU 37 CO 0.01 0.19 0.07 -0.22 -1.32 0.00 0.00 176.35 175.08 1bof s LEU 38 N 0.29 3.51 0.32 -0.68 2.96 0.20 -1.23 118.68 124.05 1bof s LEU 38 Ca 0.03 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1bof s LEU 38 Cb -0.12 -1.94 -0.06 0.00 0.50 0.00 0.00 46.19 44.57 1bof s LEU 38 CO 0.01 -0.01 0.05 -0.76 -1.32 0.00 0.00 176.35 174.32 1bof s LEU 39 N 1.45 2.20 0.00 -0.68 1.43 -0.31 -3.40 118.68 119.37 1bof s LEU 39 Ca 0.06 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.80 1bof s LEU 39 Cb -0.15 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 45.68 1bof s LEU 39 CO 0.04 -0.58 0.00 0.61 0.23 0.00 0.00 176.35 176.64 1bof n GLY 40 N -0.67 3.92 3.61 -3.19 0.00 -1.26 -0.75 105.19 106.85 1bof n GLY 40 Ca -0.03 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 1bof n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bof s ALA 41 N -2.06 0.63 0.56 4.61 0.00 -1.26 -4.92 121.76 119.32 1bof s ALA 41 Ca 0.00 -0.05 -0.21 0.00 0.00 0.00 0.00 51.96 51.70 1bof s ALA 41 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 1bof s ALA 41 CO 0.00 -3.09 1.36 0.20 0.00 0.00 0.00 175.76 174.23 1bof s GLY 42 N -2.97 2.89 -1.51 0.00 0.00 -1.26 -2.50 107.32 101.97 1bof s GLY 42 Ca 0.66 1.34 0.00 0.00 0.00 0.00 0.00 44.72 46.72 1bof s GLY 42 CO 0.60 1.85 0.00 1.18 0.00 0.00 0.00 173.10 176.74 1bof n GLU 43 N -1.11 -1.31 0.00 2.90 1.02 -1.26 -4.88 120.64 116.00 1bof n GLU 43 Ca 0.11 0.98 0.13 0.00 -0.02 0.00 0.00 57.16 58.37 1bof n GLU 43 Cb 0.45 -5.23 0.48 0.00 -0.02 0.00 0.00 31.44 27.12 1bof n GLU 43 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1bof n SER 44 N -0.84 0.31 0.00 1.62 3.41 -1.04 -4.85 113.62 112.22 1bof n SER 44 Ca -0.14 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1bof n SER 44 Cb 0.55 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1bof n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bof n GLY 45 N 1.45 1.42 0.09 5.00 0.00 -1.26 -4.38 105.19 107.51 1bof n GLY 45 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 1bof n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bof h LYS 46 N 0.94 -0.12 0.00 1.61 1.57 -1.91 -2.38 116.57 116.28 1bof h LYS 46 Ca 0.00 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1bof h LYS 46 Cb 0.00 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1bof h LYS 46 CO 0.00 -0.08 -0.15 0.77 -0.57 0.00 0.00 179.45 179.42 1bof h SER 47 N -0.13 0.00 0.37 0.86 0.02 -1.97 -2.19 113.55 110.50 1bof h SER 47 Ca -0.01 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.75 1bof h SER 47 Cb 0.11 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1bof h SER 47 CO 0.00 0.15 -0.79 0.74 -1.14 0.00 0.00 176.83 175.80 1bof h THR 48 N 0.00 1.41 -0.75 -2.27 2.02 -1.84 -2.40 112.91 109.09 1bof h THR 48 Ca -0.00 -2.30 -0.06 0.00 0.77 0.00 0.00 66.41 64.82 1bof h THR 48 Cb 0.50 2.25 -0.03 0.00 -1.74 0.00 0.00 68.15 69.12 1bof h THR 48 CO 0.02 0.68 0.24 0.40 0.37 0.00 0.00 175.52 177.23 1bof h ILE 49 N 0.21 1.26 -0.51 3.11 1.08 -0.90 -1.53 117.51 120.23 1bof h ILE 49 Ca -0.04 -0.90 -0.01 0.00 -0.39 0.00 0.00 64.86 63.52 1bof h ILE 49 Cb 1.38 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 35.53 1bof h ILE 49 CO 0.13 0.36 0.30 0.58 -0.69 0.00 0.00 178.15 178.83 1bof h VAL 50 N 1.11 1.16 -0.78 1.67 2.07 -1.28 -2.28 116.25 117.93 1bof h VAL 50 Ca 0.24 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1bof h VAL 50 Cb 0.30 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1bof h VAL 50 CO -0.01 0.17 0.41 0.11 0.02 0.00 0.00 177.57 178.27 1bof h LYS 51 N 0.69 1.10 0.00 1.57 1.57 -1.09 -1.67 116.57 118.74 1bof h LYS 51 Ca 0.18 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1bof h LYS 51 Cb 0.01 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 1bof h LYS 51 CO -0.03 0.83 -0.10 1.96 -0.57 0.00 0.00 179.45 181.54 1bof h GLN 52 N 1.09 0.00 -0.21 3.15 1.08 -0.95 -0.47 115.11 118.80 1bof h GLN 52 Ca 0.27 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.31 1bof h GLN 52 Cb 0.07 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1bof h GLN 52 CO -0.04 0.10 -0.52 0.52 -0.95 0.00 0.00 178.83 177.94 1bof h MET 53 N 0.00 0.60 -0.19 1.46 2.86 -0.74 0.99 114.93 119.91 1bof h MET 53 Ca -0.00 -0.37 -0.13 0.00 -2.06 0.00 0.00 59.70 57.15 1bof h MET 53 Cb 0.21 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1bof h MET 53 CO 0.01 0.98 -0.38 0.87 1.06 0.00 0.00 176.91 179.45 1bof h LYS 54 N 0.47 0.59 -0.03 1.72 1.57 -1.17 0.27 116.57 119.99 1bof h LYS 54 Ca 0.02 -0.38 -0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1bof h LYS 54 Cb 1.07 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.42 1bof h LYS 54 CO 0.10 1.00 0.02 0.82 -0.57 0.00 0.00 179.45 180.82 1bof h ILE 55 N 0.26 1.08 0.01 1.86 2.04 -0.99 -0.19 117.51 121.58 1bof h ILE 55 Ca 0.01 -0.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 1bof h ILE 55 Cb 0.98 1.18 0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1bof h ILE 55 CO 0.08 0.07 -0.49 0.40 0.00 0.00 0.00 178.15 178.21 1bof h ILE 56 N -0.04 1.49 -0.06 -0.67 2.04 -0.78 -3.40 117.51 116.08 1bof h ILE 56 Ca 0.01 -2.10 0.00 0.00 1.00 0.00 0.00 64.86 63.78 1bof h ILE 56 Cb 0.09 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 1bof h ILE 56 CO -0.00 0.59 0.00 1.41 0.00 0.00 0.00 178.15 180.15 1bof n HIS 57 N -4.31 0.05 -0.34 1.37 8.25 0.96 -4.95 115.22 116.23 1bof n HIS 57 Ca -0.11 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1bof n HIS 57 Cb 0.63 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.74 1bof n HIS 57 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1bof n GLU 58 N 1.32 0.26 -0.05 -0.41 -0.58 -0.78 -4.66 120.64 115.74 1bof n GLU 58 Ca 0.14 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.73 1bof n GLU 58 Cb 0.58 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.31 1bof n GLU 58 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1bof n ALA 59 N -3.00 1.29 0.00 0.62 0.00 -1.16 -4.79 120.51 113.47 1bof n ALA 59 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1bof n ALA 59 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1bof n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bof n GLY 60 N 1.89 1.30 3.16 0.00 0.00 -0.15 -4.57 105.19 106.83 1bof n GLY 60 Ca -0.31 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.47 1bof n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bof s TYR 61 N 0.00 2.91 0.51 1.61 1.51 -1.26 -4.79 117.35 117.84 1bof s TYR 61 Ca 0.00 -1.56 -0.06 0.00 -1.01 0.00 0.00 57.07 54.44 1bof s TYR 61 Cb 0.00 -1.98 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 1bof s TYR 61 CO 0.00 -0.75 0.83 -1.54 -1.11 0.00 0.00 175.55 172.98 1bof s SER 62 N 1.31 6.17 0.32 2.29 1.04 -1.26 -4.81 113.70 118.76 1bof s SER 62 Ca 0.03 0.96 0.07 0.00 0.48 0.00 0.00 55.95 57.49 1bof s SER 62 Cb -0.15 -2.20 0.77 0.00 0.10 0.00 0.00 66.02 64.54 1bof s SER 62 CO -0.09 -0.68 1.81 -0.08 0.98 0.00 0.00 173.24 175.19 1bof h GLU 63 N 0.11 0.73 -0.70 4.02 4.81 -1.98 0.50 114.58 122.06 1bof h GLU 63 Ca -0.46 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 1bof h GLU 63 Cb 1.21 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1bof h GLU 63 CO 0.62 0.48 0.16 1.49 -0.73 0.00 0.00 179.01 181.02 1bof h GLU 64 N 0.75 1.12 -0.27 1.92 4.81 -1.98 -1.49 114.58 119.45 1bof h GLU 64 Ca 0.53 -0.28 -0.06 0.00 -0.13 0.00 0.00 59.36 59.42 1bof h GLU 64 Cb 0.84 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1bof h GLU 64 CO -0.30 1.00 -0.07 0.93 -0.73 0.00 0.00 179.01 179.84 1bof h GLU 65 N 1.06 0.52 -0.38 1.92 5.08 -0.59 -3.09 114.58 119.10 1bof h GLU 65 Ca 0.22 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1bof h GLU 65 Cb 0.39 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1bof h GLU 65 CO 0.01 0.73 0.25 0.00 -1.00 0.00 0.00 179.01 179.00 1bof h LYS 67 N 0.48 0.00 0.00 0.00 1.57 -1.18 -1.81 116.57 115.63 1bof h LYS 67 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1bof h LYS 67 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1bof h LYS 67 CO -0.03 0.10 0.00 1.04 -0.57 0.00 0.00 179.45 179.99 1bof n GLN 68 N -4.29 0.04 -0.09 3.15 6.02 -0.83 -2.70 117.38 118.68 1bof n GLN 68 Ca -0.03 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.31 1bof n GLN 68 Cb 0.18 -1.57 0.15 0.00 1.02 0.00 0.00 30.24 30.02 1bof n GLN 68 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1bof n TYR 69 N -1.65 0.23 0.04 1.08 4.02 -0.68 -4.62 117.16 115.57 1bof n TYR 69 Ca 0.04 -0.11 -0.11 0.00 -0.01 0.00 0.00 57.90 57.70 1bof n TYR 69 Cb 0.23 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.49 1bof n TYR 69 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1bof h LYS 70 N 4.63 -0.05 0.00 -0.72 3.64 -1.59 0.01 116.57 122.48 1bof h LYS 70 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1bof h LYS 70 Cb 1.00 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1bof h LYS 70 CO 0.00 -0.04 0.00 0.00 -2.27 0.00 0.00 179.45 177.14 1bof h ALA 71 N 0.96 1.00 0.15 5.00 0.00 -1.84 -1.38 119.26 123.15 1bof h ALA 71 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1bof h ALA 71 Cb 0.08 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.90 1bof h ALA 71 CO -0.05 0.00 -1.09 0.28 0.00 0.00 0.00 179.25 178.39 1bof h VAL 72 N 0.00 1.37 -0.71 0.00 2.07 -1.69 0.11 116.25 117.40 1bof h VAL 72 Ca 0.00 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.03 1bof h VAL 72 Cb 0.47 2.93 -0.03 0.00 -1.52 0.00 0.00 31.29 33.14 1bof h VAL 72 CO 0.00 0.74 0.45 0.58 0.02 0.00 0.00 177.57 179.36 1bof h VAL 73 N -0.01 1.19 -0.15 2.57 2.07 -0.49 0.94 116.25 122.37 1bof h VAL 73 Ca -0.18 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1bof h VAL 73 Cb 1.82 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1bof h VAL 73 CO 0.21 0.19 0.03 1.88 0.02 0.00 0.00 177.57 179.90 1bof h TYR 74 N 0.96 0.27 -0.41 1.57 0.05 -1.28 -1.75 116.97 116.38 1bof h TYR 74 Ca 0.26 -0.04 0.05 0.00 0.05 0.00 0.00 58.73 59.05 1bof h TYR 74 Cb -0.08 -0.07 -0.04 0.00 1.01 0.00 0.00 36.73 37.54 1bof h TYR 74 CO -0.02 0.41 0.16 1.03 -1.05 0.00 0.00 178.16 178.69 1bof h SER 75 N 0.04 0.19 -0.91 3.88 0.87 -0.63 -0.49 113.55 116.50 1bof h SER 75 Ca 0.05 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1bof h SER 75 Cb 0.29 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 1bof h SER 75 CO 0.00 0.14 0.52 0.78 -0.53 0.00 0.00 176.83 177.75 1bof h ASN 76 N 0.33 1.12 -0.20 6.23 -0.26 -0.72 -1.33 115.58 120.76 1bof h ASN 76 Ca 0.19 -0.09 -0.04 0.00 -0.56 0.00 0.00 56.30 55.81 1bof h ASN 76 Cb 0.16 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.13 1bof h ASN 76 CO -0.18 0.88 -0.02 0.74 -1.06 0.00 0.00 177.43 177.79 1bof h THR 77 N 1.27 1.27 -0.76 2.81 2.02 -0.81 -1.99 112.91 116.72 1bof h THR 77 Ca 0.32 -0.94 -0.05 0.00 0.77 0.00 0.00 66.41 66.52 1bof h THR 77 Cb -0.01 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1bof h THR 77 CO -0.06 0.28 0.29 0.40 0.37 0.00 0.00 175.52 176.80 1bof h ILE 78 N 0.10 1.26 -0.53 3.11 2.04 -0.86 -2.60 117.51 120.03 1bof h ILE 78 Ca 0.05 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 65.03 1bof h ILE 78 Cb 0.44 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1bof h ILE 78 CO 0.01 0.34 0.12 -0.61 0.00 0.00 0.00 178.15 178.01 1bof h GLN 79 N 1.11 0.85 0.37 2.37 4.15 -1.21 -1.98 115.11 120.77 1bof h GLN 79 Ca 0.25 -0.21 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 1bof h GLN 79 Cb 0.24 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1bof h GLN 79 CO -0.02 0.82 -0.18 0.77 -1.93 0.00 0.00 178.83 178.29 1bof h SER 80 N 0.75 -0.43 -0.57 -0.69 0.02 -1.12 -1.06 113.55 110.44 1bof h SER 80 Ca 0.16 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1bof h SER 80 Cb 0.36 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1bof h SER 80 CO 0.00 -0.28 0.34 -0.29 -1.14 0.00 0.00 176.83 175.47 1bof h ILE 81 N -0.54 1.17 -0.60 3.27 6.09 -1.49 -1.83 117.51 123.59 1bof h ILE 81 Ca -0.05 -0.39 -0.01 0.00 -1.37 0.00 0.00 64.86 63.03 1bof h ILE 81 Cb 0.41 0.40 -0.03 0.00 0.47 0.00 0.00 36.82 38.06 1bof h ILE 81 CO 0.08 0.18 0.32 0.40 -3.07 0.00 0.00 178.15 176.06 1bof h ILE 82 N 0.77 1.19 -0.16 2.19 2.04 -1.29 -0.20 117.51 122.05 1bof h ILE 82 Ca 0.21 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1bof h ILE 82 Cb -0.01 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1bof h ILE 82 CO -0.04 0.21 0.08 0.00 0.00 0.00 0.00 178.15 178.40 1bof h ALA 83 N 1.52 0.20 -0.31 1.87 0.00 -0.63 0.77 119.26 122.68 1bof h ALA 83 Ca 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1bof h ALA 83 Cb 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1bof h ALA 83 CO -0.03 -0.25 0.15 0.82 0.00 0.00 0.00 179.25 179.93 1bof h ILE 84 N 0.14 1.16 -0.34 0.00 2.04 -0.78 -1.40 117.51 118.32 1bof h ILE 84 Ca 0.05 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1bof h ILE 84 Cb 0.10 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1bof h ILE 84 CO -0.01 0.16 0.19 0.40 0.00 0.00 0.00 178.15 178.89 1bof h ILE 85 N 0.36 1.13 -0.27 -0.67 1.08 -0.83 -2.13 117.51 116.19 1bof h ILE 85 Ca 0.11 -0.34 -0.05 0.00 -0.39 0.00 0.00 64.86 64.18 1bof h ILE 85 Cb 0.12 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.61 1bof h ILE 85 CO -0.01 0.14 -0.06 -0.09 -0.69 0.00 0.00 178.15 177.43 1bof h ARG 86 N 0.42 0.43 -0.48 2.37 2.43 -0.79 -2.82 114.38 115.94 1bof h ARG 86 Ca 0.12 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1bof h ARG 86 Cb 0.05 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1bof h ARG 86 CO -0.02 0.51 -0.03 0.00 -1.51 0.00 0.00 179.97 178.92 1bof h ALA 87 N 1.53 1.04 -0.99 2.80 0.00 -0.63 -2.56 119.26 120.45 1bof h ALA 87 Ca 0.08 -0.28 0.18 0.00 0.00 0.00 0.00 54.91 54.89 1bof h ALA 87 Cb 0.37 -0.19 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1bof h ALA 87 CO 0.02 0.59 0.60 0.52 0.00 0.00 0.00 179.25 180.98 1bof h MET 88 N 0.76 0.75 0.51 0.00 2.86 -1.15 0.30 114.93 118.96 1bof h MET 88 Ca 0.14 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1bof h MET 88 Cb 0.50 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 32.00 1bof h MET 88 CO 0.03 0.49 -0.25 0.78 1.06 0.00 0.00 176.91 179.02 1bof h GLY 89 N 0.77 -0.72 0.94 8.32 0.00 -1.51 0.15 103.07 111.01 1bof h GLY 89 Ca 0.56 0.27 0.03 0.00 0.00 0.00 0.00 47.33 48.19 1bof h GLY 89 CO -0.37 -0.26 0.66 3.21 0.00 0.00 0.00 176.54 179.78 1bof h ARG 90 N -0.80 1.27 -0.01 4.80 3.08 -1.20 -2.40 114.38 119.12 1bof h ARG 90 Ca -0.07 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1bof h ARG 90 Cb 0.58 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1bof h ARG 90 CO 0.12 0.84 -0.08 1.28 -1.07 0.00 0.00 179.97 181.06 1bof n LEU 91 N -4.41 1.02 -3.26 3.04 4.77 0.96 -4.97 117.00 114.15 1bof n LEU 91 Ca 0.13 -0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 55.71 1bof n LEU 91 Cb 0.06 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1bof n LEU 91 CO 0.36 0.18 0.14 0.29 -1.33 0.00 0.00 177.39 177.02 1bof n LYS 92 N -0.36 -1.65 -4.70 3.23 4.76 0.35 -5.02 118.16 114.77 1bof n LYS 92 Ca 0.17 1.09 -0.29 0.00 -2.87 0.00 0.00 58.31 56.42 1bof n LYS 92 Cb 0.31 -5.33 -0.17 0.00 -1.84 0.00 0.00 35.03 28.00 1bof n LYS 92 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1bof s ILE 93 N -3.19 1.60 0.53 -0.18 1.01 -0.19 -5.04 121.20 115.73 1bof s ILE 93 Ca 0.22 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 60.10 1bof s ILE 93 Cb -0.04 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 1bof s ILE 93 CO 0.77 0.46 0.82 -1.81 0.00 0.00 0.00 174.94 175.18 1bof s ASP 94 N 0.73 5.85 0.25 3.58 1.01 -1.26 -4.67 116.67 122.16 1bof s ASP 94 Ca -0.12 0.70 -0.30 0.00 0.71 0.00 0.00 52.55 53.54 1bof s ASP 94 Cb -0.16 -1.85 -0.09 0.00 1.01 0.00 0.00 42.92 41.83 1bof s ASP 94 CO 0.02 -0.83 1.08 -0.36 0.21 0.00 0.00 175.17 175.29 1bof s PHE 95 N -2.82 3.63 0.21 4.23 0.08 -1.26 -4.28 117.98 117.77 1bof s PHE 95 Ca 0.51 1.70 -0.09 0.00 0.12 0.00 0.00 56.93 59.16 1bof s PHE 95 Cb -0.10 -3.25 0.25 0.00 -0.57 0.00 0.00 43.02 39.35 1bof s PHE 95 CO 0.44 -0.45 1.80 0.78 -0.10 0.00 0.00 175.22 177.68 1bof h GLY 96 N 4.16 0.96 -5.88 4.36 0.00 -1.90 -3.38 103.07 101.39 1bof h GLY 96 Ca -0.46 -0.24 -0.65 0.00 0.00 0.00 0.00 47.33 45.98 1bof h GLY 96 CO 0.68 0.13 -0.86 -0.35 0.00 0.00 0.00 176.54 176.14 1bof s ASP 97 N -5.56 2.95 0.00 0.19 2.15 -1.26 -4.94 116.67 110.19 1bof s ASP 97 Ca -0.13 -0.57 0.08 0.00 0.43 0.00 0.00 52.55 52.37 1bof s ASP 97 Cb 0.16 -1.36 0.44 0.00 -0.30 0.00 0.00 42.92 41.86 1bof s ASP 97 CO 0.76 0.04 1.09 0.00 -0.17 0.00 0.00 175.17 176.89 1bof n ALA 98 N 4.26 1.62 0.20 3.66 0.00 -1.26 -2.38 120.51 126.62 1bof n ALA 98 Ca -0.20 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.28 1bof n ALA 98 Cb 0.51 -1.13 0.36 0.00 0.00 0.00 0.00 19.45 19.19 1bof n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bof h ALA 99 N 2.42 0.97 0.00 0.00 0.00 -1.95 -3.13 119.26 117.57 1bof h ALA 99 Ca 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1bof h ALA 99 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1bof h ALA 99 CO 0.00 0.38 -0.08 0.00 0.00 0.00 0.00 179.25 179.55 1bof h ARG 100 N 0.00 0.00 0.00 0.00 2.47 -1.88 -2.78 114.38 112.18 1bof h ARG 100 Ca -0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1bof h ARG 100 Cb 0.87 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.19 1bof h ARG 100 CO 0.04 0.08 -0.01 0.00 0.56 0.00 0.00 179.97 180.64 1bof h ALA 101 N 1.92 1.18 0.13 0.04 0.00 -1.77 0.22 119.26 120.98 1bof h ALA 101 Ca -0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 1bof h ALA 101 Cb 0.38 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bof h ALA 101 CO 0.01 0.01 -1.43 -0.44 0.00 0.00 0.00 179.25 177.40 1bof h ASP 102 N 0.00 0.43 -0.44 0.00 3.32 -1.73 -3.01 116.42 114.99 1bof h ASP 102 Ca -0.00 -0.53 -0.09 0.00 0.02 0.00 0.00 57.03 56.42 1bof h ASP 102 Cb 0.04 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1bof h ASP 102 CO 0.00 1.43 -0.05 0.44 -1.72 0.00 0.00 179.24 179.35 1bof h ASP 103 N 0.08 0.86 -0.67 6.45 3.32 -0.93 0.14 116.42 125.67 1bof h ASP 103 Ca -0.21 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 1bof h ASP 103 Cb 2.01 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 41.30 1bof h ASP 103 CO 0.18 0.95 0.41 0.00 -1.72 0.00 0.00 179.24 179.06 1bof h ALA 104 N 1.13 0.85 -0.44 3.45 0.00 -0.75 0.27 119.26 123.78 1bof h ALA 104 Ca 0.14 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1bof h ALA 104 Cb 0.55 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bof h ALA 104 CO 0.03 0.32 -0.11 -0.09 0.00 0.00 0.00 179.25 179.41 1bof h ARG 105 N 0.91 0.85 0.00 0.00 2.43 -1.26 -2.70 114.38 114.61 1bof h ARG 105 Ca 0.24 -0.33 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 1bof h ARG 105 Cb -0.03 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1bof h ARG 105 CO -0.05 0.96 -0.22 0.37 -1.51 0.00 0.00 179.97 179.53 1bof h GLN 106 N 0.68 0.00 -0.29 0.20 5.75 -0.50 -1.65 115.11 119.29 1bof h GLN 106 Ca 0.11 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1bof h GLN 106 Cb 0.65 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.18 1bof h GLN 106 CO 0.04 0.22 0.18 1.25 -2.65 0.00 0.00 178.83 177.87 1bof h LEU 107 N 0.00 0.35 -1.07 -2.39 5.85 -0.63 -0.42 115.31 117.00 1bof h LEU 107 Ca -0.00 -0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.57 1bof h LEU 107 Cb 0.41 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1bof h LEU 107 CO 0.03 0.30 -0.44 -0.26 -0.34 0.00 0.00 178.44 177.73 1bof h PHE 108 N 0.37 0.07 -0.11 1.25 0.04 -1.28 -1.37 116.94 115.91 1bof h PHE 108 Ca 0.10 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.82 1bof h PHE 108 Cb 0.01 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1bof h PHE 108 CO -0.04 0.48 -0.06 0.28 -0.60 0.00 0.00 178.31 178.37 1bof h VAL 109 N 0.05 1.33 -0.21 -0.55 2.07 -0.91 0.54 116.25 118.58 1bof h VAL 109 Ca 0.00 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.34 1bof h VAL 109 Cb 0.79 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.40 1bof h VAL 109 CO 0.06 0.32 -0.14 -0.07 0.02 0.00 0.00 177.57 177.76 1bof h LEU 110 N -0.14 0.48 -0.60 2.57 3.38 -1.03 -2.99 115.31 116.98 1bof h LEU 110 Ca 0.02 -0.44 -0.11 0.00 0.09 0.00 0.00 57.88 57.44 1bof h LEU 110 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1bof h LEU 110 CO 0.02 0.81 -0.11 0.00 0.09 0.00 0.00 178.44 179.25 1bof h ALA 111 N 0.68 0.80 0.00 1.53 0.00 -1.32 -2.91 119.26 118.04 1bof h ALA 111 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1bof h ALA 111 Cb 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1bof h ALA 111 CO 0.04 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.36 1bof n GLY 112 N -0.29 -0.87 0.80 0.00 0.00 0.18 -2.61 105.19 102.40 1bof n GLY 112 Ca 0.02 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1bof n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bof n ALA 113 N -1.39 2.40 -2.40 4.61 0.00 -1.10 -4.99 120.51 117.64 1bof n ALA 113 Ca 0.05 -0.84 -0.21 0.00 0.00 0.00 0.00 53.44 52.44 1bof n ALA 113 Cb 0.14 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 18.87 1bof n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bof s ALA 114 N -1.28 2.27 -0.16 0.00 0.00 -1.07 -5.06 121.76 116.44 1bof s ALA 114 Ca 0.26 -1.71 -0.01 0.00 0.00 0.00 0.00 51.96 50.49 1bof s ALA 114 Cb 0.16 -0.16 -0.23 0.00 0.00 0.00 0.00 23.12 22.89 1bof s ALA 114 CO 0.23 0.16 0.17 0.39 0.00 0.00 0.00 175.76 176.71 1bof n GLU 115 N -0.38 0.71 -4.57 0.00 -0.58 -1.26 -5.00 120.64 109.56 1bof n GLU 115 Ca -0.08 0.21 -0.26 0.00 -0.42 0.00 0.00 57.16 56.62 1bof n GLU 115 Cb 0.60 -1.64 -0.11 0.00 -0.57 0.00 0.00 31.44 29.72 1bof n GLU 115 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1bof s GLU 116 N -2.55 1.86 0.36 3.49 -1.05 -1.26 -5.11 118.70 114.44 1bof s GLU 116 Ca -0.25 -2.04 -0.26 0.00 -0.15 0.00 0.00 54.97 52.27 1bof s GLU 116 Cb 0.07 -1.44 -0.12 0.00 -0.44 0.00 0.00 34.13 32.20 1bof s GLU 116 CO 0.72 -0.07 1.06 0.41 0.95 0.00 0.00 175.26 178.33 1bof n GLY 117 N -0.88 -0.08 3.58 -3.83 0.00 -1.26 -5.00 105.19 97.72 1bof n GLY 117 Ca -0.04 0.24 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 1bof n GLY 117 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bof s PHE 118 N -1.16 0.04 -0.11 1.61 -0.71 -1.26 -4.81 117.98 111.57 1bof s PHE 118 Ca 0.60 -0.40 -0.05 0.00 -1.04 0.00 0.00 56.93 56.03 1bof s PHE 118 Cb -0.61 0.36 0.05 0.00 -1.21 0.00 0.00 43.02 41.60 1bof s PHE 118 CO 0.59 -0.98 0.25 1.41 -1.34 0.00 0.00 175.22 175.16 1bof s MET 119 N -3.93 0.21 0.19 1.99 1.75 -1.26 -4.85 119.30 113.40 1bof s MET 119 Ca 0.14 0.55 0.04 0.00 -1.25 0.00 0.00 55.69 55.17 1bof s MET 119 Cb -0.01 -0.11 -0.05 0.00 2.84 0.00 0.00 34.83 37.49 1bof s MET 119 CO 0.02 -0.17 -0.06 0.95 -0.65 0.00 0.00 175.02 175.11 1bof s THR 120 N 1.32 1.12 0.27 10.11 -4.23 -1.26 -5.03 115.64 117.95 1bof s THR 120 Ca -0.09 -2.05 -0.03 0.00 -1.18 0.00 0.00 61.69 58.34 1bof s THR 120 Cb -0.10 -2.08 0.27 0.00 1.34 0.00 0.00 72.50 71.93 1bof s THR 120 CO -0.09 -0.55 1.92 0.00 -0.54 0.00 0.00 174.62 175.36 1bof h ALA 121 N 2.64 1.39 0.03 3.99 0.00 -1.99 0.21 119.26 125.54 1bof h ALA 121 Ca -0.37 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1bof h ALA 121 Cb 1.21 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1bof h ALA 121 CO 0.64 0.51 -0.02 1.49 0.00 0.00 0.00 179.25 181.87 1bof h GLU 122 N 1.20 -0.05 -0.42 0.00 4.81 -1.99 -0.19 114.58 117.94 1bof h GLU 122 Ca 0.39 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1bof h GLU 122 Cb 0.03 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1bof h GLU 122 CO -0.12 0.13 0.25 1.25 -0.73 0.00 0.00 179.01 179.79 1bof h LEU 123 N -0.21 0.51 -0.86 1.64 5.85 -1.83 -1.77 115.31 118.63 1bof h LEU 123 Ca -0.00 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.73 1bof h LEU 123 Cb 0.19 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.03 1bof h LEU 123 CO 0.01 0.41 0.53 0.00 -0.34 0.00 0.00 178.44 179.05 1bof h ALA 124 N 1.12 1.20 -0.19 1.25 0.00 -0.43 -1.34 119.26 120.87 1bof h ALA 124 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1bof h ALA 124 Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1bof h ALA 124 CO -0.03 0.24 0.10 0.78 0.00 0.00 0.00 179.25 180.34 1bof h GLY 125 N 0.94 0.28 0.78 0.00 0.00 -0.51 -1.89 103.07 102.67 1bof h GLY 125 Ca 0.39 -0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.62 1bof h GLY 125 CO -0.19 0.12 0.19 -2.08 0.00 0.00 0.00 176.54 174.58 1bof h VAL 126 N 0.20 0.97 -0.33 4.60 2.07 -0.54 -2.61 116.25 120.61 1bof h VAL 126 Ca 0.07 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 1bof h VAL 126 Cb 0.07 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1bof h VAL 126 CO -0.01 0.07 0.01 0.40 0.02 0.00 0.00 177.57 178.06 1bof h ILE 127 N 0.39 1.25 -0.68 4.57 2.04 -1.20 -2.29 117.51 121.60 1bof h ILE 127 Ca 0.17 -0.94 0.02 0.00 1.00 0.00 0.00 64.86 65.11 1bof h ILE 127 Cb 0.09 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 1bof h ILE 127 CO -0.13 0.31 0.44 0.11 0.00 0.00 0.00 178.15 178.88 1bof h LYS 128 N 0.39 0.86 -0.48 2.37 1.57 -1.27 0.11 116.57 120.12 1bof h LYS 128 Ca 0.10 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1bof h LYS 128 Cb 0.43 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1bof h LYS 128 CO 0.02 0.57 -0.11 0.00 -0.57 0.00 0.00 179.45 179.36 1bof h ARG 129 N 0.89 0.92 -0.21 3.15 3.08 -1.46 -1.91 114.38 118.83 1bof h ARG 129 Ca 0.26 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 1bof h ARG 129 Cb -0.05 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1bof h ARG 129 CO -0.08 1.01 0.03 -0.07 -1.07 0.00 0.00 179.97 179.79 1bof h LEU 130 N 0.77 0.34 -1.23 3.04 3.38 -1.05 -2.92 115.31 117.64 1bof h LEU 130 Ca 0.12 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1bof h LEU 130 Cb 0.66 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1bof h LEU 130 CO 0.05 0.52 0.52 -0.25 0.09 0.00 0.00 178.44 179.36 1bof h TRP 131 N 0.15 0.98 0.00 1.13 -0.00 -0.74 -2.08 115.95 115.40 1bof h TRP 131 Ca 0.06 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.98 1bof h TRP 131 Cb 0.32 -0.33 0.00 0.00 -0.00 0.00 0.00 29.16 29.15 1bof h TRP 131 CO 0.02 0.60 0.00 1.17 -0.00 0.00 0.00 178.44 180.23 1bof n LYS 132 N -4.43 0.13 -2.20 2.65 4.81 -0.73 -4.51 118.16 113.88 1bof n LYS 132 Ca 0.09 0.18 -0.40 0.00 -0.87 0.00 0.00 58.31 57.31 1bof n LYS 132 Cb 0.05 -1.67 -0.02 0.00 0.02 0.00 0.00 35.03 33.41 1bof n LYS 132 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1bof s ASP 133 N -3.76 6.80 0.23 3.14 2.15 -0.78 -4.92 116.67 119.52 1bof s ASP 133 Ca 0.10 2.57 -0.05 0.00 0.43 0.00 0.00 52.55 55.60 1bof s ASP 133 Cb 0.14 -2.64 0.22 0.00 -0.30 0.00 0.00 42.92 40.33 1bof s ASP 133 CO 0.49 -0.50 1.69 0.77 -0.17 0.00 0.00 175.17 177.46 1bof h SER 134 N 3.32 0.86 0.13 -0.34 4.64 -1.89 0.64 113.55 120.91 1bof h SER 134 Ca -0.49 -0.24 -0.12 0.00 -0.47 0.00 0.00 61.79 60.47 1bof h SER 134 Cb 1.23 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.07 1bof h SER 134 CO 0.65 0.95 -0.43 1.23 -0.87 0.00 0.00 176.83 178.36 1bof h GLY 135 N 0.98 0.41 0.96 -0.77 0.00 -1.88 -0.50 103.07 102.27 1bof h GLY 135 Ca 0.14 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 1bof h GLY 135 CO 0.03 0.37 -0.36 -2.08 0.00 0.00 0.00 176.54 174.49 1bof h VAL 136 N 0.31 1.31 -0.28 4.60 2.07 -1.75 -2.07 116.25 120.45 1bof h VAL 136 Ca 0.02 -1.57 -0.05 0.00 0.82 0.00 0.00 66.70 65.93 1bof h VAL 136 Cb 0.88 1.75 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 1bof h VAL 136 CO 0.07 0.49 -0.04 1.56 0.02 0.00 0.00 177.57 179.68 1bof h GLN 137 N 0.37 0.43 -0.41 1.57 1.08 -0.71 0.82 115.11 118.26 1bof h GLN 137 Ca 0.02 -0.09 -0.14 0.00 -1.45 0.00 0.00 58.65 56.99 1bof h GLN 137 Cb 0.95 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.31 1bof h GLN 137 CO 0.08 0.49 -0.29 0.00 -0.95 0.00 0.00 178.83 178.16 1bof h ALA 138 N 1.55 0.70 -0.35 3.87 0.00 -0.96 -1.31 119.26 122.77 1bof h ALA 138 Ca 0.09 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 1bof h ALA 138 Cb 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1bof h ALA 138 CO 0.01 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.64 1bof h PHE 140 N 0.64 0.51 0.00 0.00 3.57 -0.54 -2.01 116.94 119.10 1bof h PHE 140 Ca 0.08 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1bof h PHE 140 Cb 0.82 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.39 1bof h PHE 140 CO 0.04 0.38 0.00 0.09 -2.23 0.00 0.00 178.31 176.59 1bof n ASN 141 N -4.77 0.00 -1.14 0.41 3.02 -0.52 -1.18 115.26 111.09 1bof n ASN 141 Ca -0.00 0.50 -0.02 0.00 -0.03 0.00 0.00 54.58 55.02 1bof n ASN 141 Cb 0.06 -0.50 0.21 0.00 -0.61 0.00 0.00 39.78 38.95 1bof n ASN 141 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bof n ARG 142 N -1.50 2.10 0.34 3.52 1.74 -0.76 -4.74 116.66 117.36 1bof n ARG 142 Ca 0.01 -3.09 0.22 0.00 -0.77 0.00 0.00 57.85 54.22 1bof n ARG 142 Cb 0.05 -1.84 1.17 0.00 -1.02 0.00 0.00 32.46 30.82 1bof n ARG 142 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1bof h SER 143 N 1.17 0.00 0.36 0.55 4.64 -1.14 -1.36 113.55 117.76 1bof h SER 143 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1bof h SER 143 Cb 1.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1bof h SER 143 CO 0.38 0.00 0.00 0.08 -0.87 0.00 0.00 176.83 176.42 1bof h ARG 144 N 0.00 0.00 0.00 4.77 0.11 -1.86 -2.27 114.38 115.13 1bof h ARG 144 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1bof h ARG 144 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 1bof h ARG 144 CO 0.00 0.00 -0.32 0.39 0.10 0.00 0.00 179.97 180.14 1bof n GLU 145 N -2.55 0.01 -4.09 0.08 1.02 -0.51 -4.64 120.64 109.97 1bof n GLU 145 Ca -0.00 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 1bof n GLU 145 Cb 0.14 -1.51 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 1bof n GLU 145 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 1bof s TYR 146 N -3.01 0.88 -0.26 -0.32 1.13 -0.86 -5.13 117.35 109.79 1bof s TYR 146 Ca 0.12 -1.14 -0.26 0.00 -1.41 0.00 0.00 57.07 54.38 1bof s TYR 146 Cb 0.18 -0.11 0.00 0.00 -1.10 0.00 0.00 41.96 40.93 1bof s TYR 146 CO 0.64 -0.99 0.89 -0.65 -2.51 0.00 0.00 175.55 172.93 1bof s GLN 147 N -3.59 4.15 -0.04 -3.49 -0.21 -1.26 -4.91 119.66 110.31 1bof s GLN 147 Ca 0.30 0.98 -0.02 0.00 0.02 0.00 0.00 55.36 56.64 1bof s GLN 147 Cb 0.01 -3.67 0.02 0.00 1.00 0.00 0.00 33.01 30.38 1bof s GLN 147 CO 0.15 -0.61 0.09 -1.17 -2.12 0.00 0.00 175.29 171.64 1bof s LEU 148 N 3.01 1.21 0.30 2.90 2.96 -1.26 -4.89 118.68 122.92 1bof s LEU 148 Ca 0.37 0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 54.17 1bof s LEU 148 Cb -0.15 0.21 -0.13 0.00 0.50 0.00 0.00 46.19 46.63 1bof s LEU 148 CO 0.09 -0.09 1.32 0.59 -1.32 0.00 0.00 176.35 176.93 1bof n ASN 149 N 3.73 2.70 0.22 3.68 4.13 -1.26 -4.89 115.26 123.56 1bof n ASN 149 Ca -0.21 1.18 0.06 0.00 1.68 0.00 0.00 54.58 57.29 1bof n ASN 149 Cb 0.54 -1.46 0.49 0.00 -1.54 0.00 0.00 39.78 37.81 1bof n ASN 149 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1bof h ASP 150 N 3.11 0.00 -0.24 6.41 3.32 -2.01 -1.50 116.42 125.51 1bof h ASP 150 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1bof h ASP 150 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1bof h ASP 150 CO 0.67 0.26 0.00 -1.20 -1.72 0.00 0.00 179.24 177.25 1bof n SER 151 N -3.99 1.35 -0.04 6.45 7.64 -1.26 -4.41 113.62 119.36 1bof n SER 151 Ca -0.02 -1.97 -0.08 0.00 1.01 0.00 0.00 58.87 57.81 1bof n SER 151 Cb 0.33 -0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1bof n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bof h ALA 152 N 3.50 0.05 -0.36 -0.43 0.00 -1.63 -2.22 119.26 118.17 1bof h ALA 152 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1bof h ALA 152 Cb 0.34 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1bof h ALA 152 CO 0.00 -0.54 -0.24 0.00 0.00 0.00 0.00 179.25 178.47 1bof h ALA 153 N 1.06 0.92 0.05 0.00 0.00 -1.83 -1.68 119.26 117.79 1bof h ALA 153 Ca 0.12 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1bof h ALA 153 Cb 0.29 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1bof h ALA 153 CO -0.29 0.62 -0.21 -0.92 0.00 0.00 0.00 179.25 178.45 1bof h TYR 154 N 0.62 -0.55 -0.08 0.00 3.20 -1.71 -0.51 116.97 117.94 1bof h TYR 154 Ca 0.09 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1bof h TYR 154 Cb 0.73 0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.24 1bof h TYR 154 CO 0.03 -0.30 -0.15 1.88 -1.64 0.00 0.00 178.16 177.99 1bof h TYR 155 N -0.36 0.31 -0.82 -3.82 0.05 -1.42 -3.11 116.97 107.80 1bof h TYR 155 Ca 0.04 -0.11 0.04 0.00 0.05 0.00 0.00 58.73 58.75 1bof h TYR 155 Cb 0.41 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.04 1bof h TYR 155 CO -0.23 0.74 0.52 -0.07 -1.05 0.00 0.00 178.16 178.08 1bof h LEU 156 N -0.22 0.85 -1.22 3.88 3.38 -1.25 -1.40 115.31 119.33 1bof h LEU 156 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1bof h LEU 156 Cb 0.72 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1bof h LEU 156 CO 0.03 0.57 0.00 0.78 0.09 0.00 0.00 178.44 179.92 1bof h ASN 157 N 0.99 0.00 -0.49 -0.43 2.35 -1.18 -2.93 115.58 113.90 1bof h ASN 157 Ca 0.34 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.92 1bof h ASN 157 Cb 0.05 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.32 1bof h ASN 157 CO -0.13 0.00 0.11 0.47 -1.65 0.00 0.00 177.43 176.23 1bof n ASP 158 N -3.07 3.68 -0.11 5.81 8.00 -0.59 -4.75 116.55 125.52 1bof n ASP 158 Ca 0.01 -3.38 -0.05 0.00 0.71 0.00 0.00 54.79 52.08 1bof n ASP 158 Cb 0.34 -0.66 0.02 0.00 -0.02 0.00 0.00 41.12 40.80 1bof n ASP 158 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1bof h LEU 159 N 1.70 -0.06 -0.64 0.64 6.46 -1.20 -2.38 115.31 119.84 1bof h LEU 159 Ca 0.20 0.07 0.12 0.00 -0.12 0.00 0.00 57.88 58.15 1bof h LEU 159 Cb 1.89 0.11 -0.12 0.00 -0.73 0.00 0.00 40.66 41.81 1bof h LEU 159 CO 0.50 0.01 -0.25 -0.78 -0.62 0.00 0.00 178.44 177.29 1bof h ASP 160 N 0.15 -0.90 -0.16 1.25 1.82 -1.87 0.67 116.42 117.39 1bof h ASP 160 Ca 0.18 0.22 -0.01 0.00 -0.39 0.00 0.00 57.03 57.02 1bof h ASP 160 Cb 0.22 0.50 -0.01 0.00 0.68 0.00 0.00 39.33 40.73 1bof h ASP 160 CO -0.26 -0.27 0.06 -0.09 -1.61 0.00 0.00 179.24 177.07 1bof h ARG 161 N -0.08 0.24 0.00 0.28 2.43 -1.88 -2.86 114.38 112.50 1bof h ARG 161 Ca 0.28 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 1bof h ARG 161 Cb 0.53 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1bof h ARG 161 CO -0.69 0.34 -0.19 0.82 -1.51 0.00 0.00 179.97 178.74 1bof h ILE 162 N 0.09 1.04 0.00 1.20 2.04 -0.67 -2.94 117.51 118.27 1bof h ILE 162 Ca 0.05 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1bof h ILE 162 Cb 0.19 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1bof h ILE 162 CO -0.00 0.18 -0.09 0.00 0.00 0.00 0.00 178.15 178.23 1bof n ALA 163 N -2.46 2.40 -1.72 1.87 0.00 0.22 -4.80 120.51 116.03 1bof n ALA 163 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 1bof n ALA 163 Cb 0.26 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 1bof n ALA 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1bof n GLN 164 N -2.16 2.29 -0.11 0.00 1.13 -1.11 -4.83 117.38 112.60 1bof n GLN 164 Ca 0.05 0.80 0.24 0.00 -1.94 0.00 0.00 57.00 56.15 1bof n GLN 164 Cb 0.42 -2.44 0.68 0.00 0.11 0.00 0.00 30.24 29.01 1bof n GLN 164 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1bof h PRO 165 N 2.97 0.05 -0.60 -1.09 0.11 -1.91 -1.94 132.00 129.58 1bof h PRO 165 Ca -0.47 -0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.46 1bof h PRO 165 Cb 1.27 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.26 1bof h PRO 165 CO 0.65 0.03 0.18 0.09 -0.21 0.00 0.00 178.00 178.75 1bof n ASN 166 N -4.34 4.26 -4.67 -2.05 5.03 -1.26 -5.03 115.26 107.19 1bof n ASN 166 Ca 0.15 -3.29 -0.45 0.00 0.87 0.00 0.00 54.58 51.86 1bof n ASN 166 Cb 0.77 -0.70 -0.03 0.00 -1.02 0.00 0.00 39.78 38.80 1bof n ASN 166 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bof n TYR 167 N -0.41 2.25 -3.87 3.10 9.36 -0.73 -5.02 117.16 121.84 1bof n TYR 167 Ca 0.37 0.36 -0.28 0.00 3.32 0.00 0.00 57.90 61.67 1bof n TYR 167 Cb 1.25 -2.50 -0.17 0.00 -0.63 0.00 0.00 39.34 37.30 1bof n TYR 167 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1bof s ILE 168 N 0.32 1.03 0.33 2.97 1.01 -1.26 -5.07 121.20 120.53 1bof s ILE 168 Ca 0.72 -0.58 -0.29 0.00 0.00 0.00 0.00 60.65 60.51 1bof s ILE 168 Cb -0.65 -1.22 -0.12 0.00 0.01 0.00 0.00 42.46 40.47 1bof s ILE 168 CO 0.45 0.12 1.34 -2.65 0.00 0.00 0.00 174.94 174.20 1bof n PRO 169 N 4.90 2.19 -2.47 2.79 -0.02 -1.26 -5.01 135.00 136.12 1bof n PRO 169 Ca -0.11 0.77 -0.25 0.00 -2.02 0.00 0.00 63.50 61.89 1bof n PRO 169 Cb 0.48 -2.38 0.04 0.00 -0.02 0.00 0.00 33.50 31.62 1bof n PRO 169 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1bof s THR 170 N -0.91 3.05 0.26 3.45 -4.23 -1.26 -4.72 115.64 111.28 1bof s THR 170 Ca 0.57 -0.30 -0.02 0.00 -1.18 0.00 0.00 61.69 60.76 1bof s THR 170 Cb -0.57 -3.22 0.23 0.00 1.34 0.00 0.00 72.50 70.29 1bof s THR 170 CO 0.60 -0.20 1.79 1.56 -0.54 0.00 0.00 174.62 177.83 1bof h GLN 171 N -0.17 0.71 -0.66 3.99 4.20 -1.95 0.13 115.11 121.36 1bof h GLN 171 Ca -0.44 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1bof h GLN 171 Cb 1.28 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.87 1bof h GLN 171 CO 0.58 0.47 0.23 0.37 -0.67 0.00 0.00 178.83 179.81 1bof h GLN 172 N 0.73 1.00 -0.83 1.46 5.75 -1.94 0.42 115.11 121.69 1bof h GLN 172 Ca 0.44 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.74 1bof h GLN 172 Cb 0.51 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 1bof h GLN 172 CO -0.30 0.84 0.48 -0.44 -2.65 0.00 0.00 178.83 176.75 1bof h ASP 173 N 0.97 1.02 -0.35 -0.69 3.32 -1.17 -1.52 116.42 118.00 1bof h ASP 173 Ca 0.22 -0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1bof h ASP 173 Cb 0.24 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1bof h ASP 173 CO -0.01 0.81 -0.06 0.58 -1.72 0.00 0.00 179.24 178.84 1bof h VAL 174 N 1.15 1.27 -0.06 -1.35 2.07 -0.11 -3.02 116.25 116.20 1bof h VAL 174 Ca 0.30 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1bof h VAL 174 Cb -0.01 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1bof h VAL 174 CO -0.05 0.36 -0.13 -0.07 0.02 0.00 0.00 177.57 177.70 1bof h LEU 175 N 0.46 0.09 -0.19 2.57 3.38 -0.60 -2.19 115.31 118.82 1bof h LEU 175 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1bof h LEU 175 Cb 0.55 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1bof h LEU 175 CO 0.03 0.23 0.00 0.54 0.09 0.00 0.00 178.44 179.33 1bof n ARG 176 N -4.34 0.16 -1.77 1.13 5.12 -0.60 -4.89 116.66 111.47 1bof n ARG 176 Ca -0.02 0.23 -0.34 0.00 -1.93 0.00 0.00 57.85 55.80 1bof n ARG 176 Cb 0.23 -1.73 0.05 0.00 -1.16 0.00 0.00 32.46 29.85 1bof n ARG 176 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1bof s THR 177 N -3.13 2.95 -0.28 0.55 -4.23 -0.83 -4.72 115.64 105.96 1bof s THR 177 Ca 0.09 0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 61.05 1bof s THR 177 Cb 0.12 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.96 1bof s THR 177 CO 0.49 -0.23 -0.01 -0.60 -0.54 0.00 0.00 174.62 173.72 1bof s ARG 178 N -3.87 2.74 -0.22 3.99 6.06 -1.26 -5.04 118.95 121.36 1bof s ARG 178 Ca 0.70 -1.06 -0.02 0.00 -2.50 0.00 0.00 55.73 52.86 1bof s ARG 178 Cb -0.24 -3.13 0.07 0.00 0.06 0.00 0.00 34.95 31.71 1bof s ARG 178 CO 0.40 -0.49 0.03 0.08 -2.50 0.00 0.00 175.30 172.82 1bof s VAL 179 N 1.33 0.69 0.33 7.11 1.01 -1.26 -4.99 120.40 124.61 1bof s VAL 179 Ca -0.01 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 1bof s VAL 179 Cb -0.18 -1.22 -0.11 0.00 0.00 0.00 0.00 36.38 34.88 1bof s VAL 179 CO -0.02 -0.27 1.55 -0.75 0.00 0.00 0.00 175.10 175.61 1bof s LYS 180 N 1.77 4.12 -0.04 2.72 2.47 -1.26 -4.98 119.74 124.54 1bof s LYS 180 Ca -0.00 2.57 -0.12 0.00 -1.56 0.00 0.00 55.97 56.85 1bof s LYS 180 Cb -0.17 -3.00 -0.05 0.00 -1.46 0.00 0.00 37.83 33.14 1bof s LYS 180 CO -0.11 -0.59 0.33 0.99 0.16 0.00 0.00 175.35 176.14 1bof s THR 181 N -0.47 5.18 0.09 3.43 2.01 -1.26 -5.09 115.64 119.53 1bof s THR 181 Ca 0.59 0.65 0.07 0.00 0.31 0.00 0.00 61.69 63.30 1bof s THR 181 Cb -0.47 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 1bof s THR 181 CO 0.54 0.58 -0.17 0.42 -0.69 0.00 0.00 174.62 175.30 1bof s THR 182 N -0.98 1.39 0.20 -0.82 -4.23 -1.26 -3.50 115.64 106.44 1bof s THR 182 Ca 0.21 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1bof s THR 182 Cb -0.15 -1.31 0.00 0.00 1.34 0.00 0.00 72.50 72.38 1bof s THR 182 CO 0.10 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 1bof n GLY 183 N 1.15 -2.10 3.76 3.99 0.00 -1.25 -4.76 105.19 105.98 1bof n GLY 183 Ca -0.20 -1.34 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 1bof n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bof s ILE 184 N -2.33 5.09 -0.16 -0.61 1.01 -1.26 -3.27 121.20 119.67 1bof s ILE 184 Ca 0.00 0.99 -0.02 0.00 0.00 0.00 0.00 60.65 61.61 1bof s ILE 184 Cb 0.00 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 1bof s ILE 184 CO 0.00 0.40 -0.07 -0.69 0.00 0.00 0.00 174.94 174.58 1bof s VAL 185 N 0.06 3.52 -0.11 2.92 1.01 -0.88 -4.96 120.40 121.95 1bof s VAL 185 Ca 0.26 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1bof s VAL 185 Cb -0.16 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 1bof s VAL 185 CO 0.12 0.49 -0.13 -0.70 0.00 0.00 0.00 175.10 174.89 1bof s GLU 186 N 0.52 3.18 0.01 2.72 2.12 -1.26 -0.25 118.70 125.74 1bof s GLU 186 Ca -0.05 -0.67 0.05 0.00 0.36 0.00 0.00 54.97 54.65 1bof s GLU 186 Cb -0.15 -2.59 -0.02 0.00 0.26 0.00 0.00 34.13 31.64 1bof s GLU 186 CO 0.03 0.32 -0.14 0.99 -0.54 0.00 0.00 175.26 175.92 1bof s THR 187 N 0.07 1.12 -0.09 -1.70 2.01 0.83 -4.96 115.64 112.92 1bof s THR 187 Ca -0.05 -0.80 0.04 0.00 0.31 0.00 0.00 61.69 61.19 1bof s THR 187 Cb -0.14 -0.98 -0.00 0.00 0.01 0.00 0.00 72.50 71.38 1bof s THR 187 CO 0.04 0.17 -0.23 -1.00 -0.69 0.00 0.00 174.62 172.91 1bof s HIS 188 N -0.58 2.55 0.04 4.92 3.76 -1.26 0.11 115.29 124.83 1bof s HIS 188 Ca 0.04 -0.90 -0.17 0.00 -0.15 0.00 0.00 55.06 53.88 1bof s HIS 188 Cb -0.07 -1.69 0.03 0.00 1.11 0.00 0.00 32.58 31.97 1bof s HIS 188 CO 0.00 -0.33 0.38 -0.59 -0.85 0.00 0.00 174.74 173.35 1bof s PHE 189 N 0.17 -0.22 -0.16 1.40 -0.12 -0.92 -5.02 117.98 113.11 1bof s PHE 189 Ca -0.13 0.15 -0.02 0.00 -0.05 0.00 0.00 56.93 56.88 1bof s PHE 189 Cb -0.16 0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.39 1bof s PHE 189 CO 0.07 -0.55 -0.10 0.99 -0.05 0.00 0.00 175.22 175.58 1bof s THR 190 N -2.48 3.19 -0.02 -4.49 2.01 -1.26 -0.34 115.64 112.23 1bof s THR 190 Ca -0.05 -0.59 -0.00 0.00 0.31 0.00 0.00 61.69 61.35 1bof s THR 190 Cb -0.01 -2.38 0.03 0.00 0.01 0.00 0.00 72.50 70.15 1bof s THR 190 CO -0.03 0.49 0.04 0.12 -0.69 0.00 0.00 174.62 174.55 1bof s PHE 191 N 0.73 0.03 -1.46 4.92 5.36 -0.65 -4.83 117.98 122.08 1bof s PHE 191 Ca -0.04 0.16 -0.06 0.00 -0.96 0.00 0.00 56.93 56.02 1bof s PHE 191 Cb -0.15 -0.29 0.03 0.00 -0.34 0.00 0.00 43.02 42.27 1bof s PHE 191 CO 0.02 -0.11 0.58 1.63 -1.46 0.00 0.00 175.22 175.87 1bof n LYS 192 N 4.43 -4.44 -1.21 10.12 5.02 -1.26 -1.11 118.16 129.71 1bof n LYS 192 Ca -0.23 0.75 -0.07 0.00 -2.02 0.00 0.00 58.31 56.74 1bof n LYS 192 Cb 0.50 -5.56 -0.03 0.00 -0.02 0.00 0.00 35.03 29.91 1bof n LYS 192 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1bof n ASP 193 N -2.45 -4.50 -4.68 4.39 -0.08 -1.26 -5.00 116.55 102.97 1bof n ASP 193 Ca -0.08 0.18 -0.35 0.00 -1.51 0.00 0.00 54.79 53.04 1bof n ASP 193 Cb 0.59 -2.64 -0.09 0.00 2.34 0.00 0.00 41.12 41.31 1bof n ASP 193 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1bof s LEU 194 N -1.66 3.73 -0.55 -2.67 1.43 -0.27 -4.49 118.68 114.21 1bof s LEU 194 Ca 0.00 0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 53.08 1bof s LEU 194 Cb 0.00 -1.90 0.12 0.00 0.03 0.00 0.00 46.19 44.45 1bof s LEU 194 CO 0.00 0.30 0.55 -1.00 0.23 0.00 0.00 176.35 176.43 1bof s HIS 195 N -0.38 3.20 0.04 0.29 3.76 0.22 -1.64 115.29 120.78 1bof s HIS 195 Ca 0.08 -1.22 -0.27 0.00 -0.15 0.00 0.00 55.06 53.50 1bof s HIS 195 Cb -0.12 -3.85 -0.05 0.00 1.11 0.00 0.00 32.58 29.67 1bof s HIS 195 CO 0.02 -1.08 0.86 -0.06 -0.85 0.00 0.00 174.74 173.62 1bof s PHE 196 N 1.84 3.73 -0.34 1.40 0.40 0.53 -1.15 117.98 124.39 1bof s PHE 196 Ca 0.05 1.59 0.01 0.00 -0.60 0.00 0.00 56.93 57.98 1bof s PHE 196 Cb -0.29 -2.95 0.09 0.00 0.51 0.00 0.00 43.02 40.38 1bof s PHE 196 CO 0.04 0.18 0.05 0.15 0.70 0.00 0.00 175.22 176.33 1bof s LYS 197 N 0.27 1.89 -0.25 0.44 -0.14 0.48 -2.17 119.74 120.25 1bof s LYS 197 Ca 0.44 -1.68 -0.11 0.00 -1.36 0.00 0.00 55.97 53.26 1bof s LYS 197 Cb -0.21 -3.24 -0.05 0.00 -1.68 0.00 0.00 37.83 32.65 1bof s LYS 197 CO 0.25 -0.86 0.17 1.41 -0.76 0.00 0.00 175.35 175.56 1bof s MET 198 N 1.05 4.01 -0.28 1.68 1.75 0.12 -0.73 119.30 126.89 1bof s MET 198 Ca 0.04 -0.30 -0.06 0.00 -1.25 0.00 0.00 55.69 54.13 1bof s MET 198 Cb -0.20 -3.57 0.01 0.00 2.84 0.00 0.00 34.83 33.90 1bof s MET 198 CO -0.05 -0.04 0.05 -0.06 -0.65 0.00 0.00 175.02 174.27 1bof s PHE 199 N 1.34 3.12 -0.89 4.11 0.08 0.32 -0.12 117.98 125.93 1bof s PHE 199 Ca 0.07 -1.04 -0.16 0.00 0.12 0.00 0.00 56.93 55.92 1bof s PHE 199 Cb -0.15 -2.21 0.18 0.00 -0.57 0.00 0.00 43.02 40.27 1bof s PHE 199 CO 0.07 -0.59 0.96 0.34 -0.10 0.00 0.00 175.22 175.91 1bof s ASP 200 N 1.47 6.73 -0.94 1.36 2.15 0.65 -0.63 116.67 127.46 1bof s ASP 200 Ca 0.03 -2.43 -0.24 0.00 0.43 0.00 0.00 52.55 50.33 1bof s ASP 200 Cb -0.17 -2.30 -0.03 0.00 -0.30 0.00 0.00 42.92 40.12 1bof s ASP 200 CO 0.01 -0.80 1.87 -0.69 -0.17 0.00 0.00 175.17 175.39 1bof s VAL 201 N 1.32 3.53 0.51 1.11 1.01 -1.22 -2.07 120.40 124.60 1bof s VAL 201 Ca 0.26 -0.48 0.08 0.00 0.00 0.00 0.00 61.98 61.84 1bof s VAL 201 Cb -0.07 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.13 1bof s VAL 201 CO -0.09 -1.11 0.56 -0.83 0.00 0.00 0.00 175.10 173.63 1bof s GLY 202 N 7.43 2.04 0.00 4.51 0.00 -1.20 -4.93 107.32 115.16 1bof s GLY 202 Ca 0.66 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 43.61 1bof s GLY 202 CO -0.01 -1.74 0.00 0.61 0.00 0.00 0.00 173.10 171.96 1bof n GLY 203 N -1.91 2.54 0.00 0.20 0.00 -1.23 -3.90 105.19 100.89 1bof n GLY 203 Ca 0.07 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1bof n GLY 203 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bof n VAL 218 N 0.00 0.00 -0.03 1.61 0.31 -1.26 -4.83 118.33 114.13 1bof n VAL 218 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 1bof n VAL 218 Cb 0.00 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.82 1bof n VAL 218 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1bof h THR 219 N 0.00 1.48 -3.70 2.52 2.02 -1.46 -3.41 112.91 110.36 1bof h THR 219 Ca 0.00 -1.62 -0.09 0.00 0.77 0.00 0.00 66.41 65.47 1bof h THR 219 Cb 0.00 2.56 -0.15 0.00 -1.74 0.00 0.00 68.15 68.82 1bof h THR 219 CO 0.00 0.41 -0.36 0.00 0.37 0.00 0.00 175.52 175.94 1bof s ALA 220 N -3.37 -0.31 -0.05 6.16 0.00 -1.12 -1.72 121.76 121.34 1bof s ALA 220 Ca -0.17 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.36 1bof s ALA 220 Cb -0.00 0.44 -0.00 0.00 0.00 0.00 0.00 23.12 23.55 1bof s ALA 220 CO 0.65 -0.47 -0.19 0.42 0.00 0.00 0.00 175.76 176.17 1bof s ILE 221 N -3.48 1.58 -0.32 0.00 1.01 0.16 -1.83 121.20 118.32 1bof s ILE 221 Ca 0.02 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 1bof s ILE 221 Cb 0.03 -1.35 0.05 0.00 0.01 0.00 0.00 42.46 41.20 1bof s ILE 221 CO -0.09 0.45 0.05 -0.63 0.00 0.00 0.00 174.94 174.72 1bof s ILE 222 N 0.03 3.23 -0.28 2.92 1.01 -0.36 0.10 121.20 127.84 1bof s ILE 222 Ca -0.05 -1.38 -0.14 0.00 0.00 0.00 0.00 60.65 59.09 1bof s ILE 222 Cb -0.12 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1bof s ILE 222 CO 0.03 -0.18 0.32 0.12 0.00 0.00 0.00 174.94 175.23 1bof s PHE 223 N 1.28 3.23 -0.04 3.97 5.36 0.14 -1.17 117.98 130.75 1bof s PHE 223 Ca -0.03 0.28 -0.13 0.00 -0.96 0.00 0.00 56.93 56.09 1bof s PHE 223 Cb -0.20 -2.53 -0.05 0.00 -0.34 0.00 0.00 43.02 39.90 1bof s PHE 223 CO -0.00 -0.23 0.33 0.00 -1.46 0.00 0.00 175.22 173.85 1bof s VAL 225 N -0.93 1.04 -0.72 0.00 1.01 0.24 -4.12 120.40 116.92 1bof s VAL 225 Ca 0.21 -0.42 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 1bof s VAL 225 Cb -0.15 -0.97 0.05 0.00 0.00 0.00 0.00 36.38 35.31 1bof s VAL 225 CO 0.10 0.34 1.15 0.00 0.00 0.00 0.00 175.10 176.69 1bof s ALA 226 N 0.77 2.93 0.43 5.51 0.00 -1.26 -0.36 121.76 129.77 1bof s ALA 226 Ca -0.13 -1.66 0.13 0.00 0.00 0.00 0.00 51.96 50.30 1bof s ALA 226 Cb -0.15 -4.09 1.01 0.00 0.00 0.00 0.00 23.12 19.88 1bof s ALA 226 CO 0.02 -3.07 1.97 -0.07 0.00 0.00 0.00 175.76 174.61 1bof h LEU 227 N 12.20 0.39 0.00 0.00 3.38 -1.35 -2.36 115.31 127.59 1bof h LEU 227 Ca -0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1bof h LEU 227 Cb 1.06 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1bof h LEU 227 CO 1.24 0.24 0.00 -1.54 0.09 0.00 0.00 178.44 178.47 1bof n SER 228 N -4.47 0.00 -0.08 -0.43 3.41 -1.26 -3.00 113.62 107.78 1bof n SER 228 Ca 0.10 0.07 0.15 0.00 -0.26 0.00 0.00 58.87 58.94 1bof n SER 228 Cb 0.37 -0.29 0.85 0.00 -0.26 0.00 0.00 64.21 64.88 1bof n SER 228 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bof n ASP 229 N -1.29 0.26 -0.31 4.04 9.92 -0.89 -4.24 116.55 124.04 1bof n ASP 229 Ca 0.07 -0.98 -0.03 0.00 -0.53 0.00 0.00 54.79 53.32 1bof n ASP 229 Cb 0.13 -0.03 0.11 0.00 -0.64 0.00 0.00 41.12 40.69 1bof n ASP 229 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 1bof h TYR 230 N 0.40 1.19 -0.56 1.24 -0.00 -1.76 -3.12 116.97 114.36 1bof h TYR 230 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.70 1bof h TYR 230 Cb 0.12 -0.38 0.00 0.00 -0.00 0.00 0.00 36.73 36.47 1bof h TYR 230 CO 0.00 0.83 0.00 -0.40 -0.00 0.00 0.00 178.16 178.59 1bof n ASP 231 N -4.33 4.84 0.00 0.10 5.75 -1.26 -3.93 116.55 117.72 1bof n ASP 231 Ca 0.09 -2.61 0.00 0.00 -0.01 0.00 0.00 54.79 52.26 1bof n ASP 231 Cb 0.11 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.59 1bof n ASP 231 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1bof n LEU 232 N 0.82 0.19 -0.17 -2.12 4.77 -1.18 -4.88 117.00 114.42 1bof n LEU 232 Ca 0.24 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.21 1bof n LEU 232 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 1bof n LEU 232 CO 0.26 0.00 -0.04 0.80 -1.33 0.00 0.00 177.39 177.07 1bof n MET 240 N -0.04 0.00 -2.08 3.23 0.00 -1.26 -4.73 117.12 112.25 1bof n MET 240 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.70 57.29 1bof n MET 240 Cb 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 33.22 33.16 1bof n MET 240 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1bof s ASN 241 N -0.04 6.73 0.18 6.12 3.84 -1.26 -4.89 114.94 125.61 1bof s ASN 241 Ca 0.02 2.67 -0.13 0.00 0.21 0.00 0.00 52.86 55.63 1bof s ASN 241 Cb -0.01 -2.64 0.15 0.00 -0.55 0.00 0.00 41.25 38.20 1bof s ASN 241 CO 0.03 -0.60 1.77 0.03 -2.79 0.00 0.00 177.10 175.53 1bof h ARG 242 N 4.13 0.40 -0.56 0.43 3.08 -1.85 -1.33 114.38 118.68 1bof h ARG 242 Ca -0.48 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 59.59 1bof h ARG 242 Cb 1.22 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 31.14 1bof h ARG 242 CO 0.71 0.27 0.32 1.98 -1.07 0.00 0.00 179.97 182.17 1bof h MET 243 N 0.41 0.60 -0.21 0.04 4.05 -1.89 -1.65 114.93 116.29 1bof h MET 243 Ca 0.23 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.55 1bof h MET 243 Cb 0.19 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1bof h MET 243 CO -0.20 0.40 -0.15 0.45 0.23 0.00 0.00 176.91 177.64 1bof h HIS 244 N 0.62 0.36 -0.43 1.39 3.86 -1.82 -0.70 115.15 118.44 1bof h HIS 244 Ca 0.24 -0.05 -0.13 0.00 -1.16 0.00 0.00 60.37 59.27 1bof h HIS 244 Cb 0.09 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 1bof h HIS 244 CO -0.08 0.48 -0.25 0.93 0.86 0.00 0.00 177.93 179.88 1bof h GLU 245 N 0.32 0.89 -0.72 2.45 4.39 -0.83 0.09 114.58 121.17 1bof h GLU 245 Ca 0.06 -0.39 -0.06 0.00 0.34 0.00 0.00 59.36 59.31 1bof h GLU 245 Cb 0.45 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 1bof h GLU 245 CO 0.03 1.03 0.20 1.03 -1.16 0.00 0.00 179.01 180.14 1bof h SER 246 N 0.76 1.07 -0.62 1.42 0.87 -0.50 -1.30 113.55 115.25 1bof h SER 246 Ca 0.09 -0.22 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 1bof h SER 246 Cb 0.80 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.46 1bof h SER 246 CO 0.07 1.01 0.20 0.24 -0.53 0.00 0.00 176.83 177.81 1bof h MET 247 N 1.07 0.96 -0.47 2.24 2.86 -0.93 -0.35 114.93 120.33 1bof h MET 247 Ca 0.23 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1bof h MET 247 Cb 0.34 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1bof h MET 247 CO -0.00 0.85 0.31 -0.22 1.06 0.00 0.00 176.91 178.91 1bof h LYS 248 N 0.89 0.62 -0.48 1.72 3.64 -0.60 -0.33 116.57 122.03 1bof h LYS 248 Ca 0.20 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1bof h LYS 248 Cb 0.29 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1bof h LYS 248 CO -0.01 0.41 0.03 1.25 -2.27 0.00 0.00 179.45 178.86 1bof h LEU 249 N 0.63 0.80 -0.73 5.20 5.85 -0.97 -2.90 115.31 123.20 1bof h LEU 249 Ca 0.17 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1bof h LEU 249 Cb -0.07 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1bof h LEU 249 CO -0.04 0.90 0.32 0.15 -0.34 0.00 0.00 178.44 179.43 1bof h PHE 250 N 0.69 1.08 -0.06 1.25 3.57 -0.85 -2.00 116.94 120.62 1bof h PHE 250 Ca 0.14 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1bof h PHE 250 Cb 0.47 -0.33 -0.06 0.00 2.79 0.00 0.00 35.95 38.82 1bof h PHE 250 CO 0.04 0.82 -0.37 0.22 -2.23 0.00 0.00 178.31 176.79 1bof h ASP 251 N 1.03 -1.12 -0.26 0.41 1.82 -0.91 0.12 116.42 117.51 1bof h ASP 251 Ca 0.25 0.15 -0.02 0.00 -0.39 0.00 0.00 57.03 57.01 1bof h ASP 251 Cb 0.17 0.46 -0.01 0.00 0.68 0.00 0.00 39.33 40.63 1bof h ASP 251 CO -0.02 -0.41 0.08 0.77 -1.61 0.00 0.00 179.24 178.04 1bof h SER 252 N -0.49 0.38 0.77 2.28 4.64 -1.43 -2.40 113.55 117.30 1bof h SER 252 Ca 0.07 -0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.15 1bof h SER 252 Cb 0.60 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1bof h SER 252 CO -0.33 0.49 -0.48 0.40 -0.87 0.00 0.00 176.83 176.04 1bof h ILE 253 N 0.25 0.04 -0.96 0.95 1.08 -1.16 -2.29 117.51 115.41 1bof h ILE 253 Ca 0.08 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.71 1bof h ILE 253 Cb 0.25 0.04 -0.10 0.00 -3.07 0.00 0.00 36.82 33.94 1bof h ILE 253 CO -0.00 0.00 0.57 0.00 -0.69 0.00 0.00 178.15 178.03 1bof n ASN 255 N -4.74 2.76 -4.75 0.00 3.02 -0.90 -4.92 115.26 105.72 1bof n ASN 255 Ca 0.20 -2.05 -0.40 0.00 -0.03 0.00 0.00 54.58 52.30 1bof n ASN 255 Cb 0.46 -0.35 -0.05 0.00 -0.61 0.00 0.00 39.78 39.22 1bof n ASN 255 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1bof s ASN 256 N -0.96 7.47 0.33 6.41 3.84 -0.81 -4.96 114.94 126.27 1bof s ASN 256 Ca 0.33 2.08 0.02 0.00 0.21 0.00 0.00 52.86 55.50 1bof s ASN 256 Cb 0.18 -2.62 0.60 0.00 -0.55 0.00 0.00 41.25 38.86 1bof s ASN 256 CO 0.21 0.01 1.97 0.11 -2.79 0.00 0.00 177.10 176.62 1bof h LYS 257 N 4.09 0.89 0.00 0.43 1.57 -1.91 -2.39 116.57 119.25 1bof h LYS 257 Ca -0.46 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.26 1bof h LYS 257 Cb 1.21 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 1bof h LYS 257 CO 0.68 0.59 -0.06 -1.49 -0.57 0.00 0.00 179.45 178.60 1bof h TRP 258 N 0.92 0.00 -0.53 -1.35 6.55 -1.95 -1.66 115.95 117.93 1bof h TRP 258 Ca 0.29 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.13 1bof h TRP 258 Cb 0.03 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.33 1bof h TRP 258 CO -0.00 0.06 0.00 1.19 -1.05 0.00 0.00 178.44 178.64 1bof n PHE 259 N -4.12 1.39 -0.27 0.49 3.72 -0.90 -4.43 117.46 113.33 1bof n PHE 259 Ca -0.03 -0.53 0.06 0.00 -0.05 0.00 0.00 57.45 56.90 1bof n PHE 259 Cb 0.14 -0.28 0.29 0.00 -0.94 0.00 0.00 39.48 38.69 1bof n PHE 259 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1bof h THR 260 N 3.42 1.02 -0.50 4.37 2.02 -1.34 -1.85 112.91 120.05 1bof h THR 260 Ca 0.00 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.87 1bof h THR 260 Cb 1.39 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1bof h THR 260 CO 0.25 0.17 0.00 0.47 0.37 0.00 0.00 175.52 176.78 1bof n ASP 261 N -4.50 3.34 -4.84 4.18 8.00 -1.26 -4.97 116.55 116.50 1bof n ASP 261 Ca 0.14 -2.00 -0.36 0.00 0.71 0.00 0.00 54.79 53.27 1bof n ASP 261 Cb 0.25 -0.33 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 1bof n ASP 261 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1bof s THR 262 N -1.00 4.95 -0.19 -3.53 2.01 -0.70 -4.97 115.64 112.20 1bof s THR 262 Ca 0.33 0.81 -0.29 0.00 0.31 0.00 0.00 61.69 62.85 1bof s THR 262 Cb 0.17 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.95 1bof s THR 262 CO 0.23 0.41 1.02 -0.44 -0.69 0.00 0.00 174.62 175.15 1bof s SER 263 N -1.43 7.14 -0.43 3.53 0.01 -0.70 -4.92 113.70 116.89 1bof s SER 263 Ca 0.31 1.42 -0.18 0.00 1.31 0.00 0.00 55.95 58.80 1bof s SER 263 Cb -0.16 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.55 1bof s SER 263 CO 0.17 -0.60 0.50 -0.63 0.41 0.00 0.00 173.24 173.09 1bof s ILE 264 N 2.83 5.01 -0.16 1.44 -1.09 -1.26 -0.66 121.20 127.31 1bof s ILE 264 Ca 0.45 -0.23 -0.06 0.00 -2.23 0.00 0.00 60.65 58.58 1bof s ILE 264 Cb -0.16 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.59 1bof s ILE 264 CO 0.10 -0.48 0.05 -0.63 -1.23 0.00 0.00 174.94 172.75 1bof s ILE 265 N 2.34 4.74 -0.22 2.92 1.09 0.11 -1.53 121.20 130.64 1bof s ILE 265 Ca 0.15 -0.06 -0.04 0.00 -1.10 0.00 0.00 60.65 59.60 1bof s ILE 265 Cb -0.16 -3.10 -0.01 0.00 -1.06 0.00 0.00 42.46 38.12 1bof s ILE 265 CO 0.15 0.50 -0.02 -0.22 -0.10 0.00 0.00 174.94 175.25 1bof s LEU 266 N 0.04 3.00 -0.41 2.97 2.96 0.78 0.23 118.68 128.25 1bof s LEU 266 Ca 0.05 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.50 1bof s LEU 266 Cb -0.12 -1.77 0.06 0.00 0.50 0.00 0.00 46.19 44.85 1bof s LEU 266 CO 0.01 -0.02 0.26 -0.36 -1.32 0.00 0.00 176.35 174.92 1bof s PHE 267 N 1.47 3.28 -0.92 5.38 0.40 0.12 -1.03 117.98 126.68 1bof s PHE 267 Ca 0.06 -1.20 -0.18 0.00 -0.60 0.00 0.00 56.93 55.00 1bof s PHE 267 Cb -0.14 -2.78 0.14 0.00 0.51 0.00 0.00 43.02 40.74 1bof s PHE 267 CO -0.02 -0.76 1.11 -0.51 0.70 0.00 0.00 175.22 175.74 1bof s LEU 268 N 1.51 5.16 0.69 -0.37 1.43 -0.33 -0.60 118.68 126.18 1bof s LEU 268 Ca 0.03 -2.09 -0.06 0.00 -1.03 0.00 0.00 54.13 50.98 1bof s LEU 268 Cb -0.22 -2.39 0.06 0.00 0.03 0.00 0.00 46.19 43.67 1bof s LEU 268 CO 0.05 -1.03 1.00 0.21 0.23 0.00 0.00 176.35 176.80 1bof s ASN 269 N 3.54 4.87 -1.42 2.29 2.47 0.51 -0.72 114.94 126.48 1bof s ASN 269 Ca 0.32 0.43 -0.03 0.00 0.42 0.00 0.00 52.86 54.00 1bof s ASN 269 Cb -0.05 -1.11 0.00 0.00 -1.45 0.00 0.00 41.25 38.64 1bof s ASN 269 CO -0.09 -1.55 0.46 0.29 -3.72 0.00 0.00 177.10 172.48 1bof n LYS 270 N -2.88 -3.95 0.27 0.43 5.02 -0.90 -1.03 118.16 115.13 1bof n LYS 270 Ca 0.08 0.83 0.14 0.00 -2.02 0.00 0.00 58.31 57.34 1bof n LYS 270 Cb 0.60 -5.47 0.79 0.00 -0.02 0.00 0.00 35.03 30.93 1bof n LYS 270 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1bof h LYS 271 N -1.06 0.00 -0.29 1.97 2.10 -1.70 -0.70 116.57 116.89 1bof h LYS 271 Ca -0.47 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.03 1bof h LYS 271 Cb 1.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1bof h LYS 271 CO 0.51 0.09 -0.40 0.38 -2.00 0.00 0.00 179.45 178.03 1bof h ASP 272 N 0.00 0.85 0.40 7.07 2.03 -1.90 -0.85 116.42 124.03 1bof h ASP 272 Ca -0.00 -0.50 -0.21 0.00 -0.73 0.00 0.00 57.03 55.59 1bof h ASP 272 Cb 0.29 -0.24 -0.00 0.00 -0.83 0.00 0.00 39.33 38.55 1bof h ASP 272 CO 0.01 1.19 -0.89 -0.07 -1.03 0.00 0.00 179.24 178.44 1bof h LEU 273 N 0.54 0.44 -0.70 0.15 3.38 -1.75 -3.06 115.31 114.31 1bof h LEU 273 Ca 0.03 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 1bof h LEU 273 Cb 0.99 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1bof h LEU 273 CO 0.09 1.14 0.02 0.15 0.09 0.00 0.00 178.44 179.93 1bof h PHE 274 N 0.20 1.10 -0.61 1.13 3.57 -1.14 -1.86 116.94 119.33 1bof h PHE 274 Ca -0.06 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.28 1bof h PHE 274 Cb 1.52 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 1bof h PHE 274 CO 0.05 0.97 0.38 1.49 -2.23 0.00 0.00 178.31 178.97 1bof h GLU 275 N 0.94 0.74 -0.25 1.11 4.81 -1.05 0.05 114.58 120.93 1bof h GLU 275 Ca 0.17 -0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.17 1bof h GLU 275 Cb 0.52 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1bof h GLU 275 CO 0.03 0.49 -0.60 1.49 -0.73 0.00 0.00 179.01 179.69 1bof h GLU 276 N 0.77 0.84 -0.47 1.92 4.22 -1.44 -3.32 114.58 117.10 1bof h GLU 276 Ca 0.24 -0.57 -0.07 0.00 0.08 0.00 0.00 59.36 59.04 1bof h GLU 276 Cb -0.01 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1bof h GLU 276 CO -0.09 1.19 0.02 0.87 -2.18 0.00 0.00 179.01 178.83 1bof h LYS 277 N 0.63 0.81 0.00 1.92 1.57 -0.92 -3.07 116.57 117.51 1bof h LYS 277 Ca -0.00 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1bof h LYS 277 Cb 1.21 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1bof h LYS 277 CO 0.13 0.85 0.00 0.97 -0.57 0.00 0.00 179.45 180.83 1bof h ILE 278 N 0.67 0.00 -0.81 1.86 6.09 -1.09 0.16 117.51 124.38 1bof h ILE 278 Ca 0.13 -0.02 -0.04 0.00 -1.37 0.00 0.00 64.86 63.56 1bof h ILE 278 Cb 0.48 0.98 -0.04 0.00 0.47 0.00 0.00 36.82 38.71 1bof h ILE 278 CO 0.02 0.00 0.35 0.11 -3.07 0.00 0.00 178.15 175.56 1bof h LYS 279 N 0.00 1.19 0.00 2.19 1.57 -1.65 -3.34 116.57 116.53 1bof h LYS 279 Ca 0.00 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1bof h LYS 279 Cb 0.03 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.13 1bof h LYS 279 CO 0.00 0.94 -0.09 1.63 -0.57 0.00 0.00 179.45 181.36 1bof n LYS 280 N -4.30 6.35 -4.81 3.15 5.02 -0.96 -5.02 118.16 117.59 1bof n LYS 280 Ca 0.07 -0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.04 1bof n LYS 280 Cb 0.17 -0.58 -0.14 0.00 -0.02 0.00 0.00 35.03 34.46 1bof n LYS 280 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1bof s SER 281 N -1.16 4.04 0.02 4.39 0.15 0.51 -5.12 113.70 116.54 1bof s SER 281 Ca 0.00 -0.27 -0.17 0.00 0.70 0.00 0.00 55.95 56.21 1bof s SER 281 Cb 0.01 -1.34 -0.06 0.00 -1.71 0.00 0.00 66.02 62.92 1bof s SER 281 CO 0.05 0.23 0.48 -2.16 1.20 0.00 0.00 173.24 173.05 1bof s PRO 282 N -0.05 4.07 0.56 5.44 0.04 -1.26 -4.35 135.00 139.44 1bof s PRO 282 Ca -0.03 0.56 0.28 0.00 0.04 0.00 0.00 61.00 61.85 1bof s PRO 282 Cb -0.14 -3.24 1.47 0.00 0.04 0.00 0.00 34.50 32.62 1bof s PRO 282 CO 0.04 0.63 1.96 1.25 0.04 0.00 0.00 177.00 180.92 1bof h LEU 283 N 4.77 0.00 -2.21 -3.56 5.85 -1.92 -0.46 115.31 117.78 1bof h LEU 283 Ca -0.50 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.25 1bof h LEU 283 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 1bof h LEU 283 CO 0.63 0.00 0.27 0.71 -0.34 0.00 0.00 178.44 179.71 1bof h THR 284 N 0.00 0.15 -0.32 1.05 1.35 -1.88 0.42 112.91 113.69 1bof h THR 284 Ca 0.25 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 66.07 1bof h THR 284 Cb 1.12 0.75 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 1bof h THR 284 CO -0.00 0.00 0.04 0.40 -0.25 0.00 0.00 175.52 175.71 1bof h ILE 285 N 0.00 1.17 0.01 6.82 2.04 -1.42 -2.66 117.51 123.47 1bof h ILE 285 Ca 0.05 -0.63 -0.33 0.00 1.00 0.00 0.00 64.86 64.95 1bof h ILE 285 Cb 0.58 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.50 1bof h ILE 285 CO -0.00 0.22 -1.83 0.00 0.00 0.00 0.00 178.15 176.54 1bof s TYR 287 N -2.44 3.44 0.43 0.00 2.02 0.49 -4.98 117.35 116.31 1bof s TYR 287 Ca -0.32 -2.93 0.12 0.00 -0.37 0.00 0.00 57.07 53.57 1bof s TYR 287 Cb 0.09 -2.99 0.99 0.00 -0.40 0.00 0.00 41.96 39.66 1bof s TYR 287 CO 0.57 -0.85 1.99 -1.00 -1.57 0.00 0.00 175.55 174.69 1bof h PRO 288 N 7.12 0.43 0.00 -1.71 0.13 -1.72 -1.59 132.00 134.65 1bof h PRO 288 Ca -0.06 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1bof h PRO 288 Cb 0.96 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1bof h PRO 288 CO 0.65 0.28 0.00 -0.85 -0.23 0.00 0.00 178.00 177.86 1bof n GLU 289 N -4.47 0.06 -1.68 0.86 0.00 -1.26 -4.84 120.64 109.31 1bof n GLU 289 Ca 0.08 0.16 -0.46 0.00 0.00 0.00 0.00 57.16 56.94 1bof n GLU 289 Cb 0.31 -1.58 -0.04 0.00 0.00 0.00 0.00 31.44 30.13 1bof n GLU 289 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.13 178.11 1bof n TYR 290 N -1.68 2.33 -0.04 -1.84 9.36 -0.60 -4.87 117.16 119.83 1bof n TYR 290 Ca 0.05 0.12 0.00 0.00 3.32 0.00 0.00 57.90 61.39 1bof n TYR 290 Cb 0.28 -2.61 0.00 0.00 -0.63 0.00 0.00 39.34 36.39 1bof n TYR 290 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1bof n ALA 291 N 4.81 2.29 -1.51 2.98 0.00 -1.26 -4.81 120.51 123.00 1bof n ALA 291 Ca 0.19 -0.60 -0.30 0.00 0.00 0.00 0.00 53.44 52.74 1bof n ALA 291 Cb 0.30 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.94 1bof n ALA 291 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1bof s GLY 292 N -0.23 1.65 0.64 0.00 0.00 -1.26 -5.00 107.32 103.11 1bof s GLY 292 Ca 0.00 -0.89 -0.17 0.00 0.00 0.00 0.00 44.72 43.67 1bof s GLY 292 CO 0.00 -0.15 1.15 -0.56 0.00 0.00 0.00 173.10 173.54 1bof s SER 293 N -4.27 5.08 -1.24 1.64 0.01 -1.26 -4.91 113.70 108.74 1bof s SER 293 Ca 0.69 2.17 -0.08 0.00 1.31 0.00 0.00 55.95 60.05 1bof s SER 293 Cb -0.09 -2.57 0.19 0.00 0.21 0.00 0.00 66.02 63.76 1bof s SER 293 CO 0.54 -1.66 1.81 0.59 0.41 0.00 0.00 173.24 174.93 1bof n ASN 294 N -2.09 5.35 -4.53 2.44 3.02 -1.26 -4.22 115.26 113.97 1bof n ASN 294 Ca 0.12 -3.17 -0.25 0.00 -0.03 0.00 0.00 54.58 51.25 1bof n ASN 294 Cb 0.51 -1.44 -0.11 0.00 -0.61 0.00 0.00 39.78 38.14 1bof n ASN 294 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1bof s THR 295 N -0.23 1.93 0.13 3.41 -4.23 -1.26 -4.80 115.64 110.59 1bof s THR 295 Ca 0.38 -2.11 -0.19 0.00 -1.18 0.00 0.00 61.69 58.59 1bof s THR 295 Cb 0.09 -2.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.17 1bof s THR 295 CO 0.02 -0.15 1.78 0.22 -0.54 0.00 0.00 174.62 175.95 1bof h TYR 296 N 2.02 0.32 0.57 3.99 3.20 -1.91 0.45 116.97 125.62 1bof h TYR 296 Ca -0.42 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.44 1bof h TYR 296 Cb 1.24 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1bof h TYR 296 CO 0.72 0.21 -0.40 0.93 -1.64 0.00 0.00 178.16 177.99 1bof h GLU 297 N 0.34 -0.90 -0.37 1.82 3.07 -1.97 -0.75 114.58 115.82 1bof h GLU 297 Ca 0.09 0.06 -0.10 0.00 -0.50 0.00 0.00 59.36 58.91 1bof h GLU 297 Cb -0.02 0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 1bof h GLU 297 CO -0.02 -0.60 -0.17 0.93 -1.40 0.00 0.00 179.01 177.75 1bof h GLU 298 N -0.93 0.76 -0.40 2.33 5.08 -1.84 -1.97 114.58 117.62 1bof h GLU 298 Ca -0.07 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1bof h GLU 298 Cb 0.77 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1bof h GLU 298 CO 0.04 0.94 0.01 0.00 -1.00 0.00 0.00 179.01 179.01 1bof h ALA 299 N 0.80 0.53 -0.40 3.43 0.00 -0.93 -1.79 119.26 120.90 1bof h ALA 299 Ca 0.08 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1bof h ALA 299 Cb 0.71 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bof h ALA 299 CO 0.05 0.30 0.02 0.00 0.00 0.00 0.00 179.25 179.62 1bof h ALA 300 N 0.89 0.53 -0.86 0.00 0.00 -1.17 -2.46 119.26 116.20 1bof h ALA 300 Ca 0.11 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1bof h ALA 300 Cb 0.45 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1bof h ALA 300 CO 0.02 0.29 0.56 0.00 0.00 0.00 0.00 179.25 180.12 1bof h ALA 301 N 0.90 1.12 -0.43 0.00 0.00 -1.31 -2.16 119.26 117.39 1bof h ALA 301 Ca 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1bof h ALA 301 Cb 0.44 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1bof h ALA 301 CO 0.02 0.42 0.28 -0.92 0.00 0.00 0.00 179.25 179.04 1bof h TYR 302 N 1.10 0.52 -0.56 0.00 3.20 -1.08 -1.87 116.97 118.30 1bof h TYR 302 Ca 0.34 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.20 1bof h TYR 302 Cb -0.03 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 1bof h TYR 302 CO -0.02 0.32 0.25 0.82 -1.64 0.00 0.00 178.16 177.90 1bof h ILE 303 N 0.56 1.21 -0.15 1.81 2.04 -1.10 -1.42 117.51 120.46 1bof h ILE 303 Ca 0.16 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1bof h ILE 303 Cb -0.05 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1bof h ILE 303 CO -0.04 0.24 0.02 -0.61 0.00 0.00 0.00 178.15 177.76 1bof h GLN 304 N 0.75 0.08 -0.76 2.37 4.15 -1.13 -2.06 115.11 118.51 1bof h GLN 304 Ca 0.19 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.62 1bof h GLN 304 Cb 0.15 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 1bof h GLN 304 CO -0.02 0.05 0.50 0.00 -1.93 0.00 0.00 178.83 177.43 1bof h GLN 306 N 1.00 0.72 -0.03 0.00 1.08 -0.67 -1.47 115.11 115.76 1bof h GLN 306 Ca 0.28 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.41 1bof h GLN 306 Cb -0.08 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.19 1bof h GLN 306 CO -0.07 0.48 -0.10 0.74 -0.95 0.00 0.00 178.83 178.93 1bof h PHE 307 N 0.75 0.15 0.00 2.96 -1.00 -0.97 -3.30 116.94 115.52 1bof h PHE 307 Ca 0.20 -0.06 -0.03 0.00 2.81 0.00 0.00 57.97 60.89 1bof h PHE 307 Cb -0.08 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.45 1bof h PHE 307 CO -0.04 0.74 -0.15 0.93 -1.61 0.00 0.00 178.31 178.18 1bof h GLU 308 N -0.48 0.00 0.00 1.51 5.08 -1.17 -2.08 114.58 117.45 1bof h GLU 308 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1bof h GLU 308 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1bof h GLU 308 CO 0.02 0.15 0.00 0.22 -1.00 0.00 0.00 179.01 178.40 1bof h ASP 309 N 0.00 0.00 0.68 1.42 3.58 -1.34 -2.51 116.42 118.25 1bof h ASP 309 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1bof h ASP 309 Cb 0.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.37 1bof h ASP 309 CO 0.02 0.00 0.00 0.18 -2.88 0.00 0.00 179.24 176.56 1bof n LEU 310 N -2.62 0.44 -4.64 2.28 4.77 -0.78 -4.70 117.00 111.76 1bof n LEU 310 Ca 0.00 0.61 -0.43 0.00 -0.03 0.00 0.00 56.01 56.16 1bof n LEU 310 Cb 0.21 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.73 1bof n LEU 310 CO 0.21 -0.44 1.45 0.21 -1.33 0.00 0.00 177.39 177.49 1bof s ASN 311 N -3.82 6.34 0.00 -1.43 2.47 -0.95 -4.86 114.94 112.69 1bof s ASN 311 Ca 0.05 1.92 0.17 0.00 0.42 0.00 0.00 52.86 55.43 1bof s ASN 311 Cb 0.10 -2.53 0.67 0.00 -1.45 0.00 0.00 41.25 38.04 1bof s ASN 311 CO 0.36 -1.24 1.48 0.29 -3.72 0.00 0.00 177.10 174.27 1bof n LYS 312 N 7.66 1.59 -2.71 0.43 5.02 -1.26 -4.01 118.16 124.88 1bof n LYS 312 Ca 0.20 -0.90 -0.12 0.00 -2.02 0.00 0.00 58.31 55.47 1bof n LYS 312 Cb 0.44 -1.33 0.02 0.00 -0.02 0.00 0.00 35.03 34.14 1bof n LYS 312 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1bof n ARG 313 N 0.15 1.30 0.09 1.97 0.63 -1.26 -4.96 116.66 114.58 1bof n ARG 313 Ca 0.14 -3.37 0.04 0.00 -0.92 0.00 0.00 57.85 53.74 1bof n ARG 313 Cb 0.26 -1.38 0.22 0.00 0.45 0.00 0.00 32.46 32.01 1bof n ARG 313 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1bof n LYS 314 N -0.05 0.05 -0.04 -0.14 5.02 -1.26 -0.62 118.16 121.12 1bof n LYS 314 Ca 0.13 0.47 0.01 0.00 -2.02 0.00 0.00 58.31 56.90 1bof n LYS 314 Cb 0.79 -1.87 -0.15 0.00 -0.02 0.00 0.00 35.03 33.77 1bof n LYS 314 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1bof n ASP 315 N -1.74 0.10 -0.05 4.39 5.68 -1.26 -4.56 116.55 119.10 1bof n ASP 315 Ca -0.01 0.04 -0.03 0.00 -0.50 0.00 0.00 54.79 54.30 1bof n ASP 315 Cb 0.21 1.37 -0.12 0.00 -1.14 0.00 0.00 41.12 41.43 1bof n ASP 315 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1bof n THR 316 N -2.54 0.72 -5.15 2.12 -1.04 -0.43 -4.99 114.28 102.98 1bof n THR 316 Ca -0.17 -0.57 -0.30 0.00 -2.04 0.00 0.00 64.05 60.98 1bof n THR 316 Cb 0.85 -0.37 -0.16 0.00 -1.82 0.00 0.00 70.33 68.83 1bof n THR 316 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1bof s LYS 317 N -2.62 2.23 -0.08 -2.82 2.20 0.21 -5.13 119.74 113.72 1bof s LYS 317 Ca -0.07 -0.83 0.01 0.00 -0.36 0.00 0.00 55.97 54.73 1bof s LYS 317 Cb 0.06 -1.95 -0.02 0.00 -1.51 0.00 0.00 37.83 34.41 1bof s LYS 317 CO 0.65 0.38 -0.11 -2.00 -0.36 0.00 0.00 175.35 173.91 1bof s GLU 318 N -0.22 2.90 -0.13 4.03 2.12 -1.26 -4.48 118.70 121.67 1bof s GLU 318 Ca -0.01 -0.63 -0.09 0.00 0.36 0.00 0.00 54.97 54.60 1bof s GLU 318 Cb -0.12 -2.55 -0.04 0.00 0.26 0.00 0.00 34.13 31.67 1bof s GLU 318 CO 0.02 0.50 0.19 0.42 -0.54 0.00 0.00 175.26 175.85 1bof s ILE 319 N -0.38 5.41 -0.40 -3.70 -1.09 -1.26 -4.48 121.20 115.29 1bof s ILE 319 Ca 0.05 0.32 -0.07 0.00 -2.23 0.00 0.00 60.65 58.72 1bof s ILE 319 Cb -0.12 -3.48 0.08 0.00 -1.58 0.00 0.00 42.46 37.36 1bof s ILE 319 CO 0.02 0.55 0.21 -0.31 -1.23 0.00 0.00 174.94 174.18 1bof s TYR 320 N -0.58 3.39 -0.13 3.97 2.02 -0.58 -4.98 117.35 120.45 1bof s TYR 320 Ca 0.15 -1.80 -0.09 0.00 -0.37 0.00 0.00 57.07 54.96 1bof s TYR 320 Cb -0.12 -2.91 -0.04 0.00 -0.40 0.00 0.00 41.96 38.49 1bof s TYR 320 CO 0.04 -0.87 0.18 0.99 -1.57 0.00 0.00 175.55 174.32 1bof s THR 321 N 1.33 5.41 -0.03 -0.71 2.01 -1.26 -0.16 115.64 122.24 1bof s THR 321 Ca 0.03 0.31 0.01 0.00 0.31 0.00 0.00 61.69 62.34 1bof s THR 321 Cb -0.22 -3.47 0.02 0.00 0.01 0.00 0.00 72.50 68.83 1bof s THR 321 CO 0.00 0.55 -0.01 -1.00 -0.69 0.00 0.00 174.62 173.46 1bof s HIS 322 N -0.52 0.39 -0.18 4.92 3.76 -0.20 -4.96 115.29 118.51 1bof s HIS 322 Ca 0.14 -0.05 -0.24 0.00 -0.15 0.00 0.00 55.06 54.76 1bof s HIS 322 Cb -0.12 -0.42 -0.02 0.00 1.11 0.00 0.00 32.58 33.13 1bof s HIS 322 CO 0.03 -0.12 0.79 -0.06 -0.85 0.00 0.00 174.74 174.54 1bof s PHE 323 N 0.80 3.40 0.26 1.40 0.40 -1.26 -1.19 117.98 121.78 1bof s PHE 323 Ca -0.09 1.17 0.06 0.00 -0.60 0.00 0.00 56.93 57.48 1bof s PHE 323 Cb -0.12 -2.97 -0.05 0.00 0.51 0.00 0.00 43.02 40.39 1bof s PHE 323 CO -0.01 -0.24 -0.06 0.95 0.70 0.00 0.00 175.22 176.56 1bof s THR 324 N 2.16 1.53 -0.41 0.64 -4.23 0.11 -4.94 115.64 110.49 1bof s THR 324 Ca 0.36 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.77 1bof s THR 324 Cb -0.16 -2.36 0.14 0.00 1.34 0.00 0.00 72.50 71.46 1bof s THR 324 CO 0.11 -0.36 0.23 0.00 -0.54 0.00 0.00 174.62 174.06 1bof h ALA 326 N 6.84 2.03 0.00 0.00 0.00 -1.96 0.07 119.26 126.23 1bof h ALA 326 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bof h ALA 326 Cb 0.94 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1bof h ALA 326 CO 0.43 -0.69 -0.19 0.25 0.00 0.00 0.00 179.25 179.05 1bof n THR 327 N -3.49 0.30 -2.98 0.00 -2.24 -1.26 -4.67 114.28 99.93 1bof n THR 327 Ca 0.07 -0.17 -0.43 0.00 -2.27 0.00 0.00 64.05 61.25 1bof n THR 327 Cb 0.65 -0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 68.47 1bof n THR 327 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1bof s ASP 328 N -3.84 6.30 0.23 3.42 -1.08 0.01 -4.94 116.67 116.78 1bof s ASP 328 Ca 0.11 -0.54 -0.06 0.00 -0.52 0.00 0.00 52.55 51.54 1bof s ASP 328 Cb 0.15 -2.37 0.33 0.00 -1.46 0.00 0.00 42.92 39.57 1bof s ASP 328 CO 0.62 -1.05 1.83 0.74 0.52 0.00 0.00 175.17 177.83 1bof h THR 329 N 5.95 0.99 -0.45 1.71 2.02 -1.84 -2.36 112.91 118.93 1bof h THR 329 Ca -0.26 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.60 1bof h THR 329 Cb 1.08 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1bof h THR 329 CO 1.02 0.16 0.21 0.50 0.37 0.00 0.00 175.52 177.77 1bof h LYS 330 N 0.86 0.66 -0.55 6.66 3.64 -1.95 -1.51 116.57 124.39 1bof h LYS 330 Ca 0.36 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 1bof h LYS 330 Cb 0.22 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1bof h LYS 330 CO -0.19 0.58 0.15 -0.97 -2.27 0.00 0.00 179.45 176.75 1bof h ASN 331 N 0.59 0.82 -0.17 4.20 -0.00 -1.83 -2.39 115.58 116.80 1bof h ASN 331 Ca 0.15 -0.22 -0.07 0.00 -0.00 0.00 0.00 56.30 56.16 1bof h ASN 331 Cb 0.14 -0.21 -0.02 0.00 -0.00 0.00 0.00 38.32 38.23 1bof h ASN 331 CO -0.02 0.82 -0.12 0.58 -0.00 0.00 0.00 177.43 178.70 1bof h VAL 332 N 0.77 1.23 -0.48 2.57 2.07 -1.22 -0.20 116.25 121.00 1bof h VAL 332 Ca 0.18 -1.04 -0.08 0.00 0.82 0.00 0.00 66.70 66.58 1bof h VAL 332 Cb 0.31 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1bof h VAL 332 CO -0.00 0.34 -0.03 -0.61 0.02 0.00 0.00 177.57 177.29 1bof h GLN 333 N 0.50 0.87 0.34 1.57 4.15 -1.11 0.13 115.11 121.55 1bof h GLN 333 Ca 0.09 -0.29 -0.02 0.00 0.77 0.00 0.00 58.65 59.20 1bof h GLN 333 Cb 0.50 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.13 1bof h GLN 333 CO 0.03 0.92 -0.16 0.35 -1.93 0.00 0.00 178.83 178.04 1bof h PHE 334 N 0.72 -0.43 -0.90 3.99 3.57 -1.17 -2.20 116.94 120.52 1bof h PHE 334 Ca 0.13 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.63 1bof h PHE 334 Cb 0.55 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 1bof h PHE 334 CO 0.04 -0.13 0.59 0.28 -2.23 0.00 0.00 178.31 176.86 1bof h VAL 335 N -0.70 1.24 0.00 1.41 2.07 -0.98 -1.91 116.25 117.37 1bof h VAL 335 Ca -0.05 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.98 1bof h VAL 335 Cb 0.49 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1bof h VAL 335 CO 0.08 0.23 -0.28 0.15 0.02 0.00 0.00 177.57 177.76 1bof h PHE 336 N 1.23 0.00 -0.22 1.57 3.57 -0.75 0.34 116.94 122.68 1bof h PHE 336 Ca 0.33 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.76 1bof h PHE 336 Cb -0.13 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1bof h PHE 336 CO -0.01 0.28 -0.12 0.22 -2.23 0.00 0.00 178.31 176.46 1bof h ASP 337 N 0.00 0.49 -0.58 0.41 1.82 -0.70 -1.29 116.42 116.57 1bof h ASP 337 Ca -0.00 -0.42 -0.05 0.00 -0.39 0.00 0.00 57.03 56.17 1bof h ASP 337 Cb 0.68 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.53 1bof h ASP 337 CO 0.04 0.80 0.16 0.00 -1.61 0.00 0.00 179.24 178.62 1bof h ALA 338 N 0.71 0.76 -0.69 -0.78 0.00 -0.88 -2.54 119.26 115.84 1bof h ALA 338 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bof h ALA 338 Cb 0.62 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1bof h ALA 338 CO 0.03 0.45 0.43 0.28 0.00 0.00 0.00 179.25 180.44 1bof h VAL 339 N 0.82 1.19 -0.51 0.00 2.07 -0.86 -2.73 116.25 116.23 1bof h VAL 339 Ca 0.18 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1bof h VAL 339 Cb 0.32 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1bof h VAL 339 CO -0.00 0.19 0.21 0.74 0.02 0.00 0.00 177.57 178.72 1bof h THR 340 N 0.93 1.19 -0.37 2.57 2.02 -0.95 -2.37 112.91 115.93 1bof h THR 340 Ca 0.25 -0.58 -0.10 0.00 0.77 0.00 0.00 66.41 66.75 1bof h THR 340 Cb -0.07 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1bof h THR 340 CO -0.05 0.23 -0.17 0.44 0.37 0.00 0.00 175.52 176.34 1bof h ASP 341 N 0.73 0.67 -0.55 4.18 3.32 -1.18 -1.08 116.42 122.51 1bof h ASP 341 Ca 0.18 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 1bof h ASP 341 Cb 0.14 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1bof h ASP 341 CO -0.02 0.85 0.18 0.58 -1.72 0.00 0.00 179.24 179.11 1bof h VAL 342 N 0.61 1.23 0.09 -1.35 2.07 -1.16 -0.90 116.25 116.84 1bof h VAL 342 Ca 0.10 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1bof h VAL 342 Cb 0.63 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1bof h VAL 342 CO 0.04 0.29 -0.04 0.40 0.02 0.00 0.00 177.57 178.28 1bof h ILE 343 N 0.76 0.95 -0.70 4.57 2.04 -1.13 0.24 117.51 124.24 1bof h ILE 343 Ca 0.18 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.98 1bof h ILE 343 Cb 0.27 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 1bof h ILE 343 CO -0.01 0.03 0.39 0.40 0.00 0.00 0.00 178.15 178.96 1bof h ILE 344 N -0.18 0.95 0.00 -0.67 2.04 -1.07 0.46 117.51 119.04 1bof h ILE 344 Ca -0.01 -0.24 -0.09 0.00 1.00 0.00 0.00 64.86 65.52 1bof h ILE 344 Cb 0.14 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1bof h ILE 344 CO 0.02 0.13 -0.43 0.50 0.00 0.00 0.00 178.15 178.37 1bof h LYS 345 N 0.70 0.00 0.00 2.37 3.64 -0.98 -3.29 116.57 119.01 1bof h LYS 345 Ca 0.32 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.40 1bof h LYS 345 Cb 0.23 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 1bof h LYS 345 CO -0.20 0.43 -2.15 0.09 -2.27 0.00 0.00 179.45 175.35 1bof n ASN 346 N -3.26 2.37 -0.01 4.20 4.13 0.84 -4.83 115.26 118.70 1bof n ASN 346 Ca 0.02 -0.10 0.00 0.00 1.68 0.00 0.00 54.58 56.17 1bof n ASN 346 Cb 0.67 -0.27 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 1bof n ASN 346 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1bof n ASN 347 N -3.07 1.20 -0.34 6.41 4.13 0.16 -4.82 115.26 118.92 1bof n ASN 347 Ca -0.35 -1.19 0.21 0.00 1.68 0.00 0.00 54.58 54.93 1bof n ASN 347 Cb 0.89 -0.00 0.45 0.00 -1.54 0.00 0.00 39.78 39.58 1bof n ASN 347 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1bof h LEU 348 N 0.02 0.56 -2.40 3.41 5.85 -1.57 -0.45 115.31 120.73 1bof h LEU 348 Ca 0.00 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1bof h LEU 348 Cb 0.10 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1bof h LEU 348 CO 0.00 0.04 -0.02 0.11 -0.34 0.00 0.00 178.44 178.23 1bof h LYS 349 N 0.46 0.00 -0.38 1.25 1.57 -1.88 -1.68 116.57 115.91 1bof h LYS 349 Ca 0.66 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 1bof h LYS 349 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1bof h LYS 349 CO -0.45 0.02 0.00 -0.25 -0.57 0.00 0.00 179.45 178.21 1bof n ASP 350 N -3.27 3.13 -4.60 0.86 8.00 -0.18 -4.88 116.55 115.61 1bof n ASP 350 Ca -0.02 -1.95 -0.38 0.00 0.71 0.00 0.00 54.79 53.15 1bof n ASP 350 Cb 0.15 -0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 40.91 1bof n ASP 350 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bof s GLY 352 N 1.68 1.65 -0.14 0.00 0.00 -1.26 -4.74 107.32 104.51 1bof s GLY 352 Ca 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 44.72 44.63 1bof s GLY 352 CO 0.10 0.19 0.04 1.08 0.00 0.00 0.00 173.10 174.52 1bof s LEU 353 N -5.37 3.76 0.00 0.66 1.43 -1.26 -0.83 118.68 117.07 1bof s LEU 353 Ca 0.57 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.80 1bof s LEU 353 Cb -0.12 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.19 1bof s LEU 353 CO 0.54 0.27 0.09 0.49 0.23 0.00 0.00 176.35 177.96