#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bui s LYS 2 N 0.00 3.83 -0.00 3.17 -0.14 -1.26 -5.02 119.74 120.31 2bui s LYS 2 Ca 0.00 2.21 0.01 0.00 -1.36 0.00 0.00 55.97 56.83 2bui s LYS 2 Cb 0.00 -2.68 -0.04 0.00 -1.68 0.00 0.00 37.83 33.44 2bui s LYS 2 CO 0.00 -0.63 0.03 1.03 -0.76 0.00 0.00 175.35 175.02 2bui s ARG 3 N -2.36 2.88 -0.10 1.68 0.52 -1.26 -4.47 118.95 115.83 2bui s ARG 3 Ca 0.59 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 55.25 2bui s ARG 3 Cb -0.39 -2.73 -0.02 0.00 0.52 0.00 0.00 34.95 32.33 2bui s ARG 3 CO 0.50 0.63 -0.14 0.00 0.02 0.00 0.00 175.30 176.31 2bui s ALA 4 N -1.12 2.59 0.21 2.13 0.00 -1.26 -0.64 121.76 123.66 2bui s ALA 4 Ca 0.21 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.32 2bui s ALA 4 Cb -0.12 -1.11 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 2bui s ALA 4 CO 0.11 0.34 -0.15 0.14 0.00 0.00 0.00 175.76 176.21 2bui s VAL 5 N 0.03 1.76 -0.34 0.00 -7.23 0.65 -1.27 120.40 114.01 2bui s VAL 5 Ca -0.05 -2.21 -0.11 0.00 -1.81 0.00 0.00 61.98 57.80 2bui s VAL 5 Cb -0.14 -2.04 -0.00 0.00 0.56 0.00 0.00 36.38 34.75 2bui s VAL 5 CO 0.04 -0.58 0.20 -0.63 -0.31 0.00 0.00 175.10 173.82 2bui s ILE 6 N -2.93 4.86 -1.01 -0.62 1.01 -0.22 -0.09 121.20 122.19 2bui s ILE 6 Ca 0.22 -0.46 0.13 0.00 0.00 0.00 0.00 60.65 60.55 2bui s ILE 6 Cb -0.01 -3.54 0.40 0.00 0.01 0.00 0.00 42.46 39.31 2bui s ILE 6 CO 0.07 -0.04 1.33 0.35 0.00 0.00 0.00 174.94 176.65 2bui n THR 7 N 5.04 1.17 -3.64 2.92 -2.24 -0.36 -1.28 114.28 115.90 2bui n THR 7 Ca -0.13 -1.10 -0.03 0.00 -2.27 0.00 0.00 64.05 60.53 2bui n THR 7 Cb 0.49 0.40 -0.04 0.00 -2.10 0.00 0.00 70.33 69.08 2bui n THR 7 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bui s GLY 8 N -1.09 0.05 0.05 3.38 0.00 -1.26 -3.93 107.32 104.53 2bui s GLY 8 Ca 0.30 2.75 -0.14 0.00 0.00 0.00 0.00 44.72 47.63 2bui s GLY 8 CO 0.18 1.10 0.30 0.48 0.00 0.00 0.00 173.10 175.16 2bui s LEU 9 N -1.03 0.89 -0.04 0.66 0.05 -1.26 0.03 118.68 117.99 2bui s LEU 9 Ca 0.08 -0.22 -0.16 0.00 0.05 0.00 0.00 54.13 53.89 2bui s LEU 9 Cb -0.01 1.35 0.03 0.00 -2.05 0.00 0.00 46.19 45.51 2bui s LEU 9 CO -0.07 -0.63 0.34 -0.83 -0.55 0.00 0.00 176.35 174.62 2bui s GLY 10 N -2.12 -0.20 -0.12 -3.48 0.00 -0.06 -3.44 107.32 97.91 2bui s GLY 10 Ca -0.04 0.50 -0.25 0.00 0.00 0.00 0.00 44.72 44.93 2bui s GLY 10 CO -0.04 0.29 0.60 -1.50 0.00 0.00 0.00 173.10 172.45 2bui s ILE 11 N -1.09 0.01 -0.30 0.90 2.07 -1.26 -1.17 121.20 120.37 2bui s ILE 11 Ca -0.11 -0.07 -0.01 0.00 -1.41 0.00 0.00 60.65 59.05 2bui s ILE 11 Cb -0.04 -0.89 0.09 0.00 0.13 0.00 0.00 42.46 41.75 2bui s ILE 11 CO 0.04 -0.04 0.08 -0.69 -1.91 0.00 0.00 174.94 172.43 2bui s VAL 12 N -0.59 0.88 0.32 4.00 1.01 -0.71 -2.93 120.40 122.39 2bui s VAL 12 Ca -0.07 -1.31 0.03 0.00 0.00 0.00 0.00 61.98 60.63 2bui s VAL 12 Cb -0.03 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2bui s VAL 12 CO 0.05 -0.60 0.14 -0.94 0.00 0.00 0.00 175.10 173.75 2bui s SER 13 N 1.63 1.87 0.63 3.32 1.04 -0.04 -1.15 113.70 120.99 2bui s SER 13 Ca 0.08 -1.55 0.38 0.00 0.48 0.00 0.00 55.95 55.34 2bui s SER 13 Cb -0.17 0.34 2.13 0.00 0.10 0.00 0.00 66.02 68.42 2bui s SER 13 CO -0.23 -0.85 2.31 0.77 0.98 0.00 0.00 173.24 176.23 2bui h SER 14 N 2.13 0.00 -0.34 7.02 4.64 -1.76 -2.34 113.55 122.89 2bui h SER 14 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2bui h SER 14 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2bui h SER 14 CO 0.56 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.82 2bui n ILE 15 N -3.43 1.92 0.00 0.95 -5.35 -1.26 -4.44 119.36 107.75 2bui n ILE 15 Ca -0.03 -1.54 0.00 0.00 -0.27 0.00 0.00 62.75 60.91 2bui n ILE 15 Cb 0.08 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 37.97 2bui n ILE 15 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bui n GLY 16 N 0.01 3.90 0.55 3.28 0.00 -0.88 -3.92 105.19 108.13 2bui n GLY 16 Ca 0.20 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 46.09 2bui n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bui n ASN 17 N 0.00 1.63 -3.71 1.61 3.02 -1.26 -0.86 115.26 115.68 2bui n ASN 17 Ca 0.00 -1.76 -0.04 0.00 -0.03 0.00 0.00 54.58 52.75 2bui n ASN 17 Cb 0.00 -0.13 -0.01 0.00 -0.61 0.00 0.00 39.78 39.03 2bui n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2bui s ASN 18 N -1.45 -0.16 0.52 6.41 2.20 -1.15 -4.57 114.94 116.75 2bui s ASN 18 Ca 0.30 -0.47 0.23 0.00 -0.94 0.00 0.00 52.86 51.98 2bui s ASN 18 Cb 0.16 0.52 1.41 0.00 -2.00 0.00 0.00 41.25 41.34 2bui s ASN 18 CO 0.24 -0.98 2.12 0.06 -2.94 0.00 0.00 177.10 175.60 2bui h GLN 19 N 2.00 0.00 -0.19 3.55 3.07 -1.91 -1.69 115.11 119.94 2bui h GLN 19 Ca -0.24 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.45 2bui h GLN 19 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.79 2bui h GLN 19 CO 0.26 0.08 -0.09 1.96 0.09 0.00 0.00 178.83 181.14 2bui h GLN 20 N 0.00 0.40 -0.53 0.06 7.50 -1.98 -1.51 115.11 119.05 2bui h GLN 20 Ca -0.00 -0.17 -0.10 0.00 0.50 0.00 0.00 58.65 58.88 2bui h GLN 20 Cb 0.18 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.68 2bui h GLN 20 CO 0.01 0.69 -0.04 0.93 -1.50 0.00 0.00 178.83 178.93 2bui h GLU 21 N 0.09 0.97 -0.44 1.46 5.08 -1.82 -2.31 114.58 117.61 2bui h GLU 21 Ca 0.04 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 2bui h GLU 21 Cb 0.57 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2bui h GLU 21 CO 0.03 1.00 0.22 0.28 -1.00 0.00 0.00 179.01 179.54 2bui h VAL 22 N 0.84 1.18 -0.09 3.13 2.07 -1.30 -1.18 116.25 120.91 2bui h VAL 22 Ca 0.15 -0.49 0.02 0.00 0.82 0.00 0.00 66.70 67.20 2bui h VAL 22 Cb 0.58 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2bui h VAL 22 CO 0.03 0.19 -0.06 0.25 0.02 0.00 0.00 177.57 178.01 2bui h LEU 23 N 0.58 -0.19 -0.54 2.57 5.85 -1.15 0.19 115.31 122.61 2bui h LEU 23 Ca 0.15 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2bui h LEU 23 Cb 0.10 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 2bui h LEU 23 CO -0.02 -0.09 0.20 0.00 -0.34 0.00 0.00 178.44 178.19 2bui h ALA 24 N 1.01 0.67 -0.47 1.25 0.00 -1.17 -1.21 119.26 119.33 2bui h ALA 24 Ca 0.06 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2bui h ALA 24 Cb 0.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2bui h ALA 24 CO -0.13 -0.20 0.27 0.77 0.00 0.00 0.00 179.25 179.96 2bui h SER 25 N 0.38 0.57 -0.81 0.00 0.02 -0.52 -1.55 113.55 111.63 2bui h SER 25 Ca 0.26 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 2bui h SER 25 Cb 0.29 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 2bui h SER 25 CO -0.26 0.47 0.45 -0.07 -1.14 0.00 0.00 176.83 176.28 2bui h LEU 26 N 0.62 1.02 -0.70 5.07 3.38 -0.01 -0.49 115.31 124.19 2bui h LEU 26 Ca 0.17 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 2bui h LEU 26 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2bui h LEU 26 CO -0.03 0.81 -0.63 0.03 0.09 0.00 0.00 178.44 178.71 2bui h ARG 27 N 1.15 0.07 -0.01 1.13 3.08 -0.99 -3.11 114.38 115.68 2bui h ARG 27 Ca 0.29 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.29 2bui h ARG 27 Cb 0.02 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2bui h ARG 27 CO -0.05 0.68 -0.08 0.39 -1.07 0.00 0.00 179.97 179.84 2bui n GLU 28 N -3.81 1.49 -2.98 0.04 1.02 -0.61 -4.73 120.64 111.07 2bui n GLU 28 Ca -0.02 -0.92 -0.22 0.00 -0.02 0.00 0.00 57.16 55.98 2bui n GLU 28 Cb 0.63 -1.48 0.03 0.00 -0.02 0.00 0.00 31.44 30.60 2bui n GLU 28 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bui n GLY 29 N 1.24 -0.52 3.71 0.62 0.00 -0.27 -4.93 105.19 105.03 2bui n GLY 29 Ca 0.17 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 2bui n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bui s ARG 30 N -5.66 4.52 0.27 1.61 3.52 -0.72 -4.99 118.95 117.50 2bui s ARG 30 Ca 0.28 1.48 -0.28 0.00 -0.13 0.00 0.00 55.73 57.08 2bui s ARG 30 Cb -0.13 -3.45 -0.09 0.00 -1.56 0.00 0.00 34.95 29.72 2bui s ARG 30 CO 0.34 -0.12 0.92 0.45 -0.81 0.00 0.00 175.30 176.08 2bui s SER 31 N 1.04 7.48 -0.06 -2.12 0.15 -1.26 -4.75 113.70 114.18 2bui s SER 31 Ca 0.53 1.86 0.13 0.00 0.70 0.00 0.00 55.95 59.17 2bui s SER 31 Cb -0.22 -2.58 0.42 0.00 -1.71 0.00 0.00 66.02 61.93 2bui s SER 31 CO 0.27 0.07 1.35 0.61 1.20 0.00 0.00 173.24 176.73 2bui n GLY 32 N 1.09 3.08 3.75 9.45 0.00 0.25 -4.96 105.19 117.85 2bui n GLY 32 Ca -0.01 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 2bui n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bui s ILE 33 N -1.56 5.02 0.32 -0.61 -1.09 -1.25 -3.91 121.20 118.12 2bui s ILE 33 Ca 0.32 1.14 0.04 0.00 -2.23 0.00 0.00 60.65 59.91 2bui s ILE 33 Cb 0.20 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 37.16 2bui s ILE 33 CO 0.16 0.39 0.16 0.42 -1.23 0.00 0.00 174.94 174.83 2bui s THR 34 N 0.10 0.34 0.31 2.92 -4.23 -0.51 -4.13 115.64 110.43 2bui s THR 34 Ca 0.29 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.53 2bui s THR 34 Cb -0.17 -2.50 -0.10 0.00 1.34 0.00 0.00 72.50 71.08 2bui s THR 34 CO 0.15 0.00 0.97 0.12 -0.54 0.00 0.00 174.62 175.32 2bui s PHE 35 N -3.55 3.70 -0.29 3.99 5.36 -1.26 -1.98 117.98 123.94 2bui s PHE 35 Ca 0.35 1.79 0.03 0.00 -0.96 0.00 0.00 56.93 58.14 2bui s PHE 35 Cb 0.05 -3.00 0.08 0.00 -0.34 0.00 0.00 43.02 39.81 2bui s PHE 35 CO 0.18 0.09 -0.01 0.45 -1.46 0.00 0.00 175.22 174.46 2bui s SER 36 N -1.43 4.44 0.42 6.13 0.15 0.12 -4.88 113.70 118.65 2bui s SER 36 Ca 0.48 -1.71 0.09 0.00 0.70 0.00 0.00 55.95 55.52 2bui s SER 36 Cb -0.22 -1.45 0.90 0.00 -1.71 0.00 0.00 66.02 63.53 2bui s SER 36 CO 0.28 -0.30 2.03 -0.61 1.20 0.00 0.00 173.24 175.84 2bui h GLN 37 N 7.76 0.37 -0.14 5.44 5.75 -1.96 -2.58 115.11 129.75 2bui h GLN 37 Ca -0.12 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.34 2bui h GLN 37 Cb 1.03 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.50 2bui h GLN 37 CO 0.48 0.31 0.09 1.49 -2.65 0.00 0.00 178.83 178.55 2bui h GLU 38 N 0.37 0.19 -0.54 1.69 4.81 -1.95 -0.60 114.58 118.56 2bui h GLU 38 Ca 0.09 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 2bui h GLU 38 Cb 0.08 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 2bui h GLU 38 CO -0.01 0.16 -0.04 -0.07 -0.73 0.00 0.00 179.01 178.32 2bui h LEU 39 N 0.17 0.96 -0.25 1.64 3.38 -1.80 -2.27 115.31 117.15 2bui h LEU 39 Ca 0.05 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2bui h LEU 39 Cb 0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2bui h LEU 39 CO -0.01 1.06 0.12 0.50 0.09 0.00 0.00 178.44 180.20 2bui h LYS 40 N 0.85 0.36 0.00 1.13 3.64 -1.37 -2.51 116.57 118.67 2bui h LYS 40 Ca 0.15 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2bui h LYS 40 Cb 0.58 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2bui h LYS 40 CO 0.03 0.35 -0.02 -0.44 -2.27 0.00 0.00 179.45 177.11 2bui h ASP 41 N 0.28 0.00 0.67 4.20 3.32 -0.98 -0.76 116.42 123.15 2bui h ASP 41 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2bui h ASP 41 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2bui h ASP 41 CO -0.01 0.02 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 2bui n SER 42 N -4.21 0.00 0.00 6.45 3.41 -0.86 -4.87 113.62 113.53 2bui n SER 42 Ca -0.03 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2bui n SER 42 Cb 0.10 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 2bui n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bui n GLY 43 N 0.87 0.74 3.88 5.00 0.00 -0.29 -5.07 105.19 110.32 2bui n GLY 43 Ca 0.08 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 2bui n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bui s MET 44 N -0.79 3.68 0.09 1.61 -1.94 -1.07 -4.99 119.30 115.89 2bui s MET 44 Ca 0.00 0.59 0.13 0.00 -1.71 0.00 0.00 55.69 54.70 2bui s MET 44 Cb 0.00 -2.23 -0.14 0.00 2.01 0.00 0.00 34.83 34.47 2bui s MET 44 CO 0.00 -0.32 1.00 0.00 -0.01 0.00 0.00 175.02 175.69 2bui h ARG 45 N 0.35 0.00 -5.54 2.03 3.08 -1.94 -3.43 114.38 108.93 2bui h ARG 45 Ca -0.46 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 58.98 2bui h ARG 45 Cb 1.19 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.13 2bui h ARG 45 CO 0.62 0.53 0.20 0.45 -1.07 0.00 0.00 179.97 180.70 2bui s SER 46 N -6.19 6.59 -0.15 7.04 0.15 -1.26 -4.68 113.70 115.21 2bui s SER 46 Ca -0.01 0.70 0.17 0.00 0.70 0.00 0.00 55.95 57.51 2bui s SER 46 Cb 0.09 -2.35 0.42 0.00 -1.71 0.00 0.00 66.02 62.47 2bui s SER 46 CO 0.80 -0.40 1.31 1.41 1.20 0.00 0.00 173.24 177.56 2bui n HIS 47 N 5.77 0.56 -4.49 3.44 8.25 -1.26 -4.54 115.22 122.95 2bui n HIS 47 Ca 0.00 -0.90 -0.24 0.00 -0.26 0.00 0.00 57.72 56.33 2bui n HIS 47 Cb 0.49 -0.24 -0.14 0.00 1.12 0.00 0.00 29.99 31.23 2bui n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2bui s VAL 48 N -2.72 1.51 0.17 1.59 -7.23 -1.26 0.11 120.40 112.58 2bui s VAL 48 Ca 0.37 -1.21 -0.18 0.00 -1.81 0.00 0.00 61.98 59.15 2bui s VAL 48 Cb 0.30 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.93 2bui s VAL 48 CO 0.07 0.09 0.50 -1.66 -0.31 0.00 0.00 175.10 173.79 2bui s TRP 49 N -0.89 -0.18 -0.86 2.82 -2.14 -0.84 -4.36 118.94 112.49 2bui s TRP 49 Ca 0.05 -0.14 -0.13 0.00 2.66 0.00 0.00 56.10 58.55 2bui s TRP 49 Cb -0.09 0.37 0.23 0.00 -3.10 0.00 0.00 33.47 30.88 2bui s TRP 49 CO 0.02 -0.86 0.80 0.20 -2.66 0.00 0.00 176.95 174.46 2bui s GLY 50 N -2.84 2.75 0.34 3.67 0.00 0.57 -1.43 107.32 110.38 2bui s GLY 50 Ca 0.07 -3.41 -0.12 0.00 0.00 0.00 0.00 44.72 41.26 2bui s GLY 50 CO -0.06 1.26 0.72 0.54 0.00 0.00 0.00 173.10 175.56 2bui s ASN 51 N 1.94 6.65 -0.25 1.64 6.03 -1.25 -1.60 114.94 128.10 2bui s ASN 51 Ca 0.20 1.16 -0.25 0.00 -1.03 0.00 0.00 52.86 52.94 2bui s ASN 51 Cb -0.10 -2.33 -0.00 0.00 -3.03 0.00 0.00 41.25 35.79 2bui s ASN 51 CO -0.09 -0.26 0.86 -0.69 -2.03 0.00 0.00 177.10 174.89 2bui s VAL 52 N -2.11 4.81 -1.04 3.54 1.01 -1.26 -4.03 120.40 121.31 2bui s VAL 52 Ca 0.52 1.61 -0.05 0.00 0.00 0.00 0.00 61.98 64.05 2bui s VAL 52 Cb -0.10 -4.15 0.28 0.00 0.00 0.00 0.00 36.38 32.41 2bui s VAL 52 CO 0.23 -0.10 1.16 2.29 0.00 0.00 0.00 175.10 178.68 2bui n LYS 53 N 6.07 3.63 -3.67 2.72 2.85 -1.26 -4.92 118.16 123.59 2bui n LYS 53 Ca 0.06 -4.51 -0.09 0.00 -1.05 0.00 0.00 58.31 52.72 2bui n LYS 53 Cb 0.47 -2.50 -0.10 0.00 -0.65 0.00 0.00 35.03 32.26 2bui n LYS 53 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 2bui s LEU 54 N -1.86 -0.48 -0.48 -5.58 2.96 -1.26 -4.91 118.68 107.07 2bui s LEU 54 Ca 0.31 0.94 -0.28 0.00 -0.22 0.00 0.00 54.13 54.88 2bui s LEU 54 Cb -0.03 1.31 0.01 0.00 0.50 0.00 0.00 46.19 47.97 2bui s LEU 54 CO -0.02 -0.22 1.49 -0.62 -1.32 0.00 0.00 176.35 175.65 2bui s ASP 55 N 2.28 6.11 0.00 3.68 2.15 -1.26 -4.84 116.67 124.80 2bui s ASP 55 Ca -0.04 0.62 0.23 0.00 0.43 0.00 0.00 52.55 53.80 2bui s ASP 55 Cb -0.11 -2.54 1.13 0.00 -0.30 0.00 0.00 42.92 41.10 2bui s ASP 55 CO -0.12 -1.65 1.76 0.35 -0.17 0.00 0.00 175.17 175.33 2bui n THR 56 N 7.04 0.07 -1.74 1.71 -2.24 -1.26 -4.89 114.28 112.96 2bui n THR 56 Ca 0.16 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 2bui n THR 56 Cb 0.49 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2bui n THR 56 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2bui s THR 57 N -1.93 2.37 0.00 4.28 2.01 -1.26 -2.49 115.64 118.62 2bui s THR 57 Ca 0.35 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.43 2bui s THR 57 Cb 0.17 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.63 2bui s THR 57 CO 0.28 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 2bui n GLY 58 N 4.10 0.46 0.06 4.40 0.00 -1.26 -4.88 105.19 108.06 2bui n GLY 58 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2bui n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bui n LEU 59 N 0.00 0.57 -4.14 0.99 4.77 -1.04 -4.82 117.00 113.33 2bui n LEU 59 Ca 0.00 0.38 -0.24 0.00 -0.03 0.00 0.00 56.01 56.12 2bui n LEU 59 Cb 0.10 -0.31 -0.15 0.00 -2.33 0.00 0.00 43.42 40.73 2bui n LEU 59 CO 0.00 -0.06 -0.49 -0.63 -1.33 0.00 0.00 177.39 174.88 2bui s ILE 60 N -3.08 1.27 0.25 -0.08 1.01 -1.26 -5.08 121.20 114.23 2bui s ILE 60 Ca 0.10 -0.68 -0.30 0.00 0.00 0.00 0.00 60.65 59.77 2bui s ILE 60 Cb 0.15 -1.06 -0.14 0.00 0.01 0.00 0.00 42.46 41.42 2bui s ILE 60 CO 0.63 0.36 1.23 -0.67 0.00 0.00 0.00 174.94 176.49 2bui n ASP 61 N 2.76 2.06 -0.22 3.58 2.03 -1.26 -4.68 116.55 120.82 2bui n ASP 61 Ca -0.15 1.16 0.01 0.00 0.52 0.00 0.00 54.79 56.34 2bui n ASP 61 Cb 0.54 -1.35 0.25 0.00 -0.72 0.00 0.00 41.12 39.84 2bui n ASP 61 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 2bui h ARG 62 N 3.15 0.97 0.00 -0.67 0.11 -1.98 0.02 114.38 115.99 2bui h ARG 62 Ca -0.43 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 59.59 2bui h ARG 62 Cb 1.31 -0.22 -0.00 0.00 1.11 0.00 0.00 29.97 32.17 2bui h ARG 62 CO 0.68 0.64 -0.01 1.57 0.10 0.00 0.00 179.97 182.95 2bui h LYS 63 N 1.00 0.00 0.00 0.08 2.10 -2.01 -2.23 116.57 115.51 2bui h LYS 63 Ca 0.29 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.80 2bui h LYS 63 Cb -0.06 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.25 2bui h LYS 63 CO -0.07 0.01 -1.00 0.28 -2.00 0.00 0.00 179.45 176.66 2bui n VAL 64 N -3.11 1.48 0.33 0.07 0.31 -0.61 -4.40 118.33 112.39 2bui n VAL 64 Ca -0.01 0.07 0.21 0.00 -0.01 0.00 0.00 64.34 64.60 2bui n VAL 64 Cb 0.23 -2.20 1.12 0.00 -0.91 0.00 0.00 33.84 32.08 2bui n VAL 64 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 2bui h VAL 65 N -1.00 0.08 0.00 2.52 3.04 -1.00 -2.59 116.25 117.29 2bui h VAL 65 Ca -0.20 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 2bui h VAL 65 Cb 0.96 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.31 2bui h VAL 65 CO -0.12 0.00 0.00 -2.11 -1.01 0.00 0.00 177.57 174.33 2bui n ARG 66 N -3.18 0.06 0.00 4.17 1.85 -0.84 -1.44 116.66 117.27 2bui n ARG 66 Ca -0.03 0.36 0.09 0.00 -1.00 0.00 0.00 57.85 57.27 2bui n ARG 66 Cb 0.10 -1.63 0.01 0.00 -1.05 0.00 0.00 32.46 29.89 2bui n ARG 66 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2bui n PHE 67 N -1.74 0.00 -3.81 2.89 3.01 -0.97 -4.85 117.46 111.98 2bui n PHE 67 Ca 0.02 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.20 2bui n PHE 67 Cb 0.15 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.58 2bui n PHE 67 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 2bui s MET 68 N -1.98 3.49 0.43 -1.08 -1.94 -0.52 -3.17 119.30 114.53 2bui s MET 68 Ca 0.16 -0.40 0.07 0.00 -1.71 0.00 0.00 55.69 53.81 2bui s MET 68 Cb 0.14 -2.92 -0.03 0.00 2.01 0.00 0.00 34.83 34.03 2bui s MET 68 CO 0.42 0.50 0.26 -1.54 -0.01 0.00 0.00 175.02 174.65 2bui s SER 69 N -2.91 4.64 0.24 3.03 1.04 -1.26 -4.89 113.70 113.59 2bui s SER 69 Ca 0.37 -0.99 -0.05 0.00 0.48 0.00 0.00 55.95 55.76 2bui s SER 69 Cb -0.12 -0.42 0.44 0.00 0.10 0.00 0.00 66.02 66.02 2bui s SER 69 CO 0.28 -0.63 1.73 0.44 0.98 0.00 0.00 173.24 176.04 2bui h ASP 70 N 1.24 0.29 -0.51 7.02 3.32 -1.94 -0.37 116.42 125.46 2bui h ASP 70 Ca -0.42 0.10 0.09 0.00 0.02 0.00 0.00 57.03 56.82 2bui h ASP 70 Cb 1.26 0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.82 2bui h ASP 70 CO 0.65 0.12 0.11 0.00 -1.72 0.00 0.00 179.24 178.40 2bui h ALA 71 N 1.53 0.58 -0.33 3.45 0.00 -1.87 0.17 119.26 122.80 2bui h ALA 71 Ca 0.40 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.33 2bui h ALA 71 Cb 0.59 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2bui h ALA 71 CO -0.39 -0.30 -0.16 0.77 0.00 0.00 0.00 179.25 179.17 2bui h SER 72 N 0.25 0.59 -0.34 0.00 0.02 -1.59 -1.83 113.55 110.66 2bui h SER 72 Ca 0.26 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 2bui h SER 72 Cb 0.34 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2bui h SER 72 CO -0.33 0.77 0.00 0.40 -1.14 0.00 0.00 176.83 176.54 2bui h ILE 73 N 0.54 1.26 -0.63 3.27 2.04 0.25 -0.21 117.51 124.02 2bui h ILE 73 Ca 0.09 -0.96 -0.06 0.00 1.00 0.00 0.00 64.86 64.93 2bui h ILE 73 Cb 0.59 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 2bui h ILE 73 CO 0.04 0.31 0.16 1.88 0.00 0.00 0.00 178.15 180.54 2bui h TYR 74 N 0.40 1.06 -0.32 1.37 0.05 -0.55 -2.17 116.97 116.81 2bui h TYR 74 Ca 0.10 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 58.69 2bui h TYR 74 Cb 0.44 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 2bui h TYR 74 CO 0.04 0.88 -0.02 0.00 -1.05 0.00 0.00 178.16 178.00 2bui h ALA 75 N 1.05 0.44 0.03 3.88 0.00 -1.27 -2.09 119.26 121.31 2bui h ALA 75 Ca 0.20 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.88 2bui h ALA 75 Cb 0.35 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2bui h ALA 75 CO 0.00 0.22 -0.22 0.35 0.00 0.00 0.00 179.25 179.60 2bui h PHE 76 N 0.38 -0.58 -0.80 0.00 3.57 -0.86 0.93 116.94 119.58 2bui h PHE 76 Ca 0.09 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.63 2bui h PHE 76 Cb 0.49 0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 2bui h PHE 76 CO 0.04 -0.31 0.53 -0.07 -2.23 0.00 0.00 178.31 176.27 2bui h LEU 77 N -0.36 0.88 -1.26 0.59 3.38 -1.41 -0.44 115.31 116.70 2bui h LEU 77 Ca 0.05 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2bui h LEU 77 Cb 0.43 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2bui h LEU 77 CO -0.18 0.62 -0.24 0.28 0.09 0.00 0.00 178.44 179.01 2bui h SER 78 N 1.03 0.20 -0.18 -0.43 0.02 -0.64 -2.54 113.55 111.01 2bui h SER 78 Ca 0.31 -0.06 -0.21 0.00 -0.84 0.00 0.00 61.79 60.99 2bui h SER 78 Cb -0.04 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.46 2bui h SER 78 CO -0.08 0.45 -0.68 -0.03 -1.14 0.00 0.00 176.83 175.35 2bui h MET 79 N 0.19 0.81 -0.56 3.45 1.85 0.75 -1.51 114.93 119.91 2bui h MET 79 Ca 0.03 -0.60 0.03 0.00 -0.61 0.00 0.00 59.70 58.56 2bui h MET 79 Cb 0.53 0.10 -0.04 0.00 0.43 0.00 0.00 31.60 32.63 2bui h MET 79 CO 0.04 1.22 0.33 0.93 -0.40 0.00 0.00 176.91 179.02 2bui h GLU 80 N 0.58 0.63 -0.26 0.39 5.08 -1.02 0.68 114.58 120.66 2bui h GLU 80 Ca -0.02 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2bui h GLU 80 Cb 1.30 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2bui h GLU 80 CO 0.14 0.42 0.17 1.96 -1.00 0.00 0.00 179.01 180.70 2bui h GLN 81 N 0.65 0.33 -0.59 2.33 4.20 -1.39 -1.50 115.11 119.15 2bui h GLN 81 Ca 0.23 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.95 2bui h GLN 81 Cb 0.05 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 2bui h GLN 81 CO -0.11 0.22 0.36 0.00 -0.67 0.00 0.00 178.83 178.63 2bui h ALA 82 N 1.10 0.76 -0.54 3.87 0.00 -0.61 0.28 119.26 124.13 2bui h ALA 82 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2bui h ALA 82 Cb -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2bui h ALA 82 CO -0.03 0.11 0.25 0.82 0.00 0.00 0.00 179.25 180.40 2bui h ILE 83 N 0.72 1.20 -0.36 0.00 2.04 -0.65 0.15 117.51 120.61 2bui h ILE 83 Ca 0.23 -0.59 -0.12 0.00 1.00 0.00 0.00 64.86 65.38 2bui h ILE 83 Cb 0.00 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2bui h ILE 83 CO -0.09 0.23 -0.25 0.00 0.00 0.00 0.00 178.15 178.04 2bui h ALA 84 N 1.09 0.52 -0.36 1.87 0.00 -0.90 -2.27 119.26 119.22 2bui h ALA 84 Ca 0.18 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2bui h ALA 84 Cb 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2bui h ALA 84 CO -0.02 0.51 -0.10 0.22 0.00 0.00 0.00 179.25 179.86 2bui h ASP 85 N 0.60 0.59 1.40 0.00 3.58 -0.25 -2.50 116.42 119.84 2bui h ASP 85 Ca 0.07 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2bui h ASP 85 Cb 0.81 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.70 2bui h ASP 85 CO 0.07 0.73 0.00 0.00 -2.88 0.00 0.00 179.24 177.16 2bui h ALA 86 N 1.33 1.00 -0.54 -0.78 0.00 -0.56 -3.45 119.26 116.25 2bui h ALA 86 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2bui h ALA 86 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2bui h ALA 86 CO 0.03 0.00 -0.10 0.41 0.00 0.00 0.00 179.25 179.59 2bui n GLY 87 N 0.48 0.27 3.73 0.00 0.00 -0.90 -4.73 105.19 104.05 2bui n GLY 87 Ca 0.02 -0.74 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 2bui n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bui s LEU 88 N -1.17 4.28 0.15 0.99 1.43 -0.93 -5.06 118.68 118.37 2bui s LEU 88 Ca 0.00 0.74 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 2bui s LEU 88 Cb 0.00 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.58 2bui s LEU 88 CO 0.00 0.06 0.30 -0.94 0.23 0.00 0.00 176.35 176.00 2bui s SER 89 N 0.43 6.36 0.30 2.29 1.04 -1.26 -4.75 113.70 118.12 2bui s SER 89 Ca 0.23 0.26 0.06 0.00 0.48 0.00 0.00 55.95 56.98 2bui s SER 89 Cb -0.15 -1.95 0.75 0.00 0.10 0.00 0.00 66.02 64.77 2bui s SER 89 CO 0.09 0.05 1.76 -0.65 0.98 0.00 0.00 173.24 175.47 2bui h PRO 90 N 2.30 0.67 -0.14 4.02 0.11 -1.98 0.29 132.00 137.27 2bui h PRO 90 Ca -0.48 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.63 2bui h PRO 90 Cb 1.19 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2bui h PRO 90 CO 0.70 0.44 0.12 0.93 -0.21 0.00 0.00 178.00 179.98 2bui h GLU 91 N 0.69 0.00 0.11 1.05 3.07 -1.94 0.37 114.58 117.93 2bui h GLU 91 Ca 0.58 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 59.20 2bui h GLU 91 Cb 0.95 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 2bui h GLU 91 CO -0.41 0.00 -1.21 0.00 -1.40 0.00 0.00 179.01 175.99 2bui h ALA 92 N 1.89 0.10 0.00 3.43 0.00 -0.83 -3.42 119.26 120.44 2bui h ALA 92 Ca 0.07 -0.97 -0.04 0.00 0.00 0.00 0.00 54.91 53.96 2bui h ALA 92 Cb 0.31 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2bui h ALA 92 CO -0.00 0.68 -1.88 2.48 0.00 0.00 0.00 179.25 180.53 2bui n TYR 93 N -4.02 0.00 -2.78 0.00 0.18 -1.02 -4.85 117.16 104.67 2bui n TYR 93 Ca -0.22 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.20 2bui n TYR 93 Cb 0.86 -0.47 -0.06 0.00 -0.38 0.00 0.00 39.34 39.28 2bui n TYR 93 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 2bui s GLN 94 N -3.17 4.53 -1.50 -3.48 -0.21 0.10 -3.72 119.66 112.21 2bui s GLN 94 Ca -0.07 1.31 -0.13 0.00 0.02 0.00 0.00 55.36 56.49 2bui s GLN 94 Cb 0.11 -2.71 0.09 0.00 1.00 0.00 0.00 33.01 31.49 2bui s GLN 94 CO 0.76 0.23 0.83 0.09 -2.12 0.00 0.00 175.29 175.08 2bui n ASN 95 N 0.39 -4.57 -4.13 5.90 5.03 0.05 -4.86 115.26 113.07 2bui n ASN 95 Ca 0.03 -0.68 -0.33 0.00 0.87 0.00 0.00 54.58 54.46 2bui n ASN 95 Cb 0.51 -3.68 -0.15 0.00 -1.02 0.00 0.00 39.78 35.44 2bui n ASN 95 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2bui s ASN 96 N -3.12 4.23 0.66 6.41 3.84 -1.24 -4.93 114.94 120.79 2bui s ASN 96 Ca 0.59 -1.11 0.36 0.00 0.21 0.00 0.00 52.86 52.91 2bui s ASN 96 Cb -0.30 -1.59 1.94 0.00 -0.55 0.00 0.00 41.25 40.75 2bui s ASN 96 CO 0.73 -0.15 2.11 -0.65 -2.79 0.00 0.00 177.10 176.35 2bui h PRO 97 N 7.89 0.00 -0.63 0.43 0.11 -1.92 -1.02 132.00 136.85 2bui h PRO 97 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2bui h PRO 97 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2bui h PRO 97 CO 0.53 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.86 2bui n ARG 98 N -3.05 4.10 -3.99 1.05 1.74 -1.26 -3.93 116.66 111.32 2bui n ARG 98 Ca -0.02 -2.84 -0.30 0.00 -0.77 0.00 0.00 57.85 53.92 2bui n ARG 98 Cb 0.26 -2.03 -0.16 0.00 -1.02 0.00 0.00 32.46 29.51 2bui n ARG 98 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2bui s VAL 99 N -2.21 1.55 0.21 1.55 1.01 -0.39 -0.65 120.40 121.48 2bui s VAL 99 Ca 0.50 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2bui s VAL 99 Cb 0.35 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2bui s VAL 99 CO 0.20 0.25 0.07 0.61 0.00 0.00 0.00 175.10 176.23 2bui n GLY 100 N 4.74 3.50 3.11 4.51 0.00 0.44 -1.25 105.19 120.23 2bui n GLY 100 Ca -0.15 -2.25 -0.12 0.00 0.00 0.00 0.00 46.02 43.50 2bui n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bui s LEU 101 N 0.00 -0.36 -0.31 0.99 1.98 0.12 -1.72 118.68 119.39 2bui s LEU 101 Ca 0.05 0.73 -0.01 0.00 -2.89 0.00 0.00 54.13 52.02 2bui s LEU 101 Cb -0.00 0.95 0.10 0.00 0.66 0.00 0.00 46.19 47.89 2bui s LEU 101 CO 0.03 -0.23 0.10 -0.63 -1.89 0.00 0.00 176.35 173.73 2bui s ILE 102 N 2.35 0.82 -0.03 6.68 1.01 0.15 -3.00 121.20 129.18 2bui s ILE 102 Ca -0.01 -1.34 -0.14 0.00 0.00 0.00 0.00 60.65 59.16 2bui s ILE 102 Cb -0.12 -1.61 0.02 0.00 0.01 0.00 0.00 42.46 40.76 2bui s ILE 102 CO -0.10 -0.66 0.31 0.00 0.00 0.00 0.00 174.94 174.48 2bui s ALA 103 N 1.65 -0.78 0.23 9.38 0.00 -1.19 -2.74 121.76 128.31 2bui s ALA 103 Ca 0.09 0.43 -0.03 0.00 0.00 0.00 0.00 51.96 52.45 2bui s ALA 103 Cb -0.17 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.92 2bui s ALA 103 CO -0.25 -0.24 0.35 0.41 0.00 0.00 0.00 175.76 176.03 2bui n GLY 104 N 1.58 2.22 3.34 0.00 0.00 -1.11 -3.39 105.19 107.83 2bui n GLY 104 Ca -0.20 -1.44 -0.18 0.00 0.00 0.00 0.00 46.02 44.20 2bui n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bui s SER 105 N -2.34 2.29 0.10 1.61 1.04 -1.26 -2.17 113.70 112.97 2bui s SER 105 Ca 0.16 -1.11 -0.09 0.00 0.48 0.00 0.00 55.95 55.39 2bui s SER 105 Cb -0.01 -0.08 -0.17 0.00 0.10 0.00 0.00 66.02 65.85 2bui s SER 105 CO 0.12 -0.33 1.24 1.23 0.98 0.00 0.00 173.24 176.48 2bui h GLY 106 N 2.51 0.62 -1.30 7.32 0.00 -1.81 -3.39 103.07 107.03 2bui h GLY 106 Ca -0.38 -1.11 -0.05 0.00 0.00 0.00 0.00 47.33 45.79 2bui h GLY 106 CO 0.64 0.98 -0.53 0.61 0.00 0.00 0.00 176.54 178.24 2bui n GLY 107 N 1.04 2.43 7.00 4.60 0.00 -1.26 -4.64 105.19 114.36 2bui n GLY 107 Ca -0.09 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2bui n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bui n GLY 108 N -0.39 1.62 2.68 -0.02 0.00 -1.26 -3.88 105.19 103.94 2bui n GLY 108 Ca 0.08 0.41 -0.17 0.00 0.00 0.00 0.00 46.02 46.34 2bui n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2bui s SER 109 N -4.00 0.90 0.48 1.61 0.15 -1.25 -4.66 113.70 106.92 2bui s SER 109 Ca 0.00 -1.92 0.16 0.00 0.70 0.00 0.00 55.95 54.88 2bui s SER 109 Cb 0.00 0.52 1.12 0.00 -1.71 0.00 0.00 66.02 65.95 2bui s SER 109 CO 0.00 -0.21 2.06 -0.65 1.20 0.00 0.00 173.24 175.63 2bui h PRO 110 N 6.49 0.00 -0.11 5.44 0.11 -1.92 -1.80 132.00 140.21 2bui h PRO 110 Ca 0.10 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 2bui h PRO 110 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2bui h PRO 110 CO 0.21 0.11 0.05 -0.09 -0.21 0.00 0.00 178.00 178.07 2bui h ARG 111 N 0.00 0.16 0.00 1.05 2.43 -1.93 -0.19 114.38 115.90 2bui h ARG 111 Ca -0.00 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2bui h ARG 111 Cb 0.20 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 2bui h ARG 111 CO 0.01 0.24 -0.34 0.74 -1.51 0.00 0.00 179.97 179.12 2bui h PHE 112 N 0.05 0.00 -0.38 2.20 -1.00 -1.88 0.19 116.94 116.13 2bui h PHE 112 Ca 0.04 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.72 2bui h PHE 112 Cb 0.13 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 2bui h PHE 112 CO -0.03 0.34 -0.14 0.37 -1.61 0.00 0.00 178.31 177.24 2bui h GLN 113 N 0.00 0.76 -0.29 1.51 5.75 -1.18 -0.60 115.11 121.06 2bui h GLN 113 Ca -0.00 -0.31 -0.17 0.00 -0.15 0.00 0.00 58.65 58.01 2bui h GLN 113 Cb 1.15 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.67 2bui h GLN 113 CO 0.04 0.93 -0.48 0.28 -2.65 0.00 0.00 178.83 176.95 2bui h VAL 114 N 0.56 1.28 -0.95 2.39 2.07 -0.91 -2.66 116.25 118.03 2bui h VAL 114 Ca 0.09 -1.67 0.05 0.00 0.82 0.00 0.00 66.70 65.99 2bui h VAL 114 Cb 0.67 1.62 -0.06 0.00 -1.52 0.00 0.00 31.29 32.00 2bui h VAL 114 CO 0.05 0.54 0.61 0.15 0.02 0.00 0.00 177.57 178.94 2bui h PHE 115 N 0.62 1.14 -0.08 1.57 3.57 -0.80 0.58 116.94 123.54 2bui h PHE 115 Ca 0.02 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 2bui h PHE 115 Cb 1.09 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 2bui h PHE 115 CO 0.07 0.62 0.03 0.78 -2.23 0.00 0.00 178.31 177.59 2bui h GLY 116 N 1.14 0.13 0.95 2.40 0.00 -0.99 -0.47 103.07 106.22 2bui h GLY 116 Ca 0.40 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 2bui h GLY 116 CO -0.15 0.07 0.12 0.00 0.00 0.00 0.00 176.54 176.57 2bui h ALA 117 N 0.88 0.56 -0.64 3.60 0.00 -1.11 0.33 119.26 122.88 2bui h ALA 117 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2bui h ALA 117 Cb 0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2bui h ALA 117 CO -0.00 0.23 0.37 -0.44 0.00 0.00 0.00 179.25 179.41 2bui h ASP 118 N 0.55 0.77 -0.02 0.00 3.45 -0.82 -1.57 116.42 118.79 2bui h ASP 118 Ca 0.14 -0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.53 2bui h ASP 118 Cb 0.30 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 2bui h ASP 118 CO -0.00 0.61 -0.05 0.00 -1.57 0.00 0.00 179.24 178.23 2bui h ALA 119 N 1.52 0.03 -0.99 3.45 0.00 -0.78 -3.22 119.26 119.28 2bui h ALA 119 Ca 0.23 -0.32 0.12 0.00 0.00 0.00 0.00 54.91 54.94 2bui h ALA 119 Cb -0.01 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.69 2bui h ALA 119 CO -0.04 -0.13 0.63 1.98 0.00 0.00 0.00 179.25 181.69 2bui h MET 120 N -0.50 0.94 0.00 0.00 1.85 -0.67 -0.92 114.93 115.65 2bui h MET 120 Ca -0.00 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 59.03 2bui h MET 120 Cb 0.65 -0.21 0.00 0.00 0.43 0.00 0.00 31.60 32.47 2bui h MET 120 CO 0.01 0.62 0.00 0.54 -0.40 0.00 0.00 176.91 177.69 2bui n ARG 121 N -4.60 0.25 -1.18 0.39 1.74 -0.61 -4.06 116.66 108.59 2bui n ARG 121 Ca 0.19 0.10 -0.15 0.00 -0.77 0.00 0.00 57.85 57.21 2bui n ARG 121 Cb 0.36 -1.50 0.10 0.00 -1.02 0.00 0.00 32.46 30.40 2bui n ARG 121 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bui n GLY 122 N 0.52 -0.92 0.23 -0.13 0.00 -0.35 -4.97 105.19 99.58 2bui n GLY 122 Ca 0.09 -1.75 0.09 0.00 0.00 0.00 0.00 46.02 44.45 2bui n GLY 122 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2bui h PRO 123 N 0.00 0.00 -0.02 1.61 0.11 -1.87 -3.11 132.00 128.72 2bui h PRO 123 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2bui h PRO 123 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2bui h PRO 123 CO 0.17 0.21 -0.16 0.54 -0.21 0.00 0.00 178.00 178.55 2bui n ARG 124 N -3.78 1.47 0.00 1.05 1.74 -1.26 -5.01 116.66 110.86 2bui n ARG 124 Ca -0.02 -1.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.05 2bui n ARG 124 Cb 0.31 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 2bui n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bui n GLY 125 N 1.30 2.14 0.38 -0.13 0.00 -1.18 -1.02 105.19 106.68 2bui n GLY 125 Ca 0.14 0.25 0.15 0.00 0.00 0.00 0.00 46.02 46.56 2bui n GLY 125 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bui h LEU 126 N 0.00 0.56 -1.02 0.99 3.38 -1.88 -1.27 115.31 116.07 2bui h LEU 126 Ca 0.00 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2bui h LEU 126 Cb 0.00 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2bui h LEU 126 CO 0.00 0.25 0.55 0.11 0.09 0.00 0.00 178.44 179.43 2bui h LYS 127 N 0.57 1.22 0.00 1.13 1.57 -1.48 -2.53 116.57 117.05 2bui h LYS 127 Ca 0.48 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 59.03 2bui h LYS 127 Cb 0.94 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 2bui h LYS 127 CO -0.22 0.85 -0.57 0.00 -0.57 0.00 0.00 179.45 178.94 2bui h ALA 128 N 1.36 0.82 -0.33 3.86 0.00 -1.20 -3.27 119.26 120.50 2bui h ALA 128 Ca 0.32 -0.52 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2bui h ALA 128 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2bui h ALA 128 CO -0.06 0.71 -0.29 0.28 0.00 0.00 0.00 179.25 179.89 2bui h VAL 129 N 0.00 1.29 0.00 0.00 2.07 -1.21 -3.48 116.25 114.93 2bui h VAL 129 Ca -0.01 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.06 2bui h VAL 129 Cb 1.19 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2bui h VAL 129 CO 0.07 0.47 0.00 0.61 0.02 0.00 0.00 177.57 178.75 2bui n GLY 130 N 0.11 -1.66 1.87 2.17 0.00 -1.07 -4.62 105.19 102.00 2bui n GLY 130 Ca -0.03 -1.54 0.07 0.00 0.00 0.00 0.00 46.02 44.53 2bui n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bui n PRO 131 N -2.05 4.81 -0.03 1.61 -0.04 -1.26 -4.42 135.00 133.62 2bui n PRO 131 Ca 0.00 -3.14 0.01 0.00 -0.04 0.00 0.00 63.50 60.33 2bui n PRO 131 Cb 0.00 -2.24 0.03 0.00 -0.04 0.00 0.00 33.50 31.25 2bui n PRO 131 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2bui n TYR 132 N 0.69 0.08 -0.06 0.54 4.01 -1.26 -4.75 117.16 116.41 2bui n TYR 132 Ca 0.28 -0.39 -0.11 0.00 -0.16 0.00 0.00 57.90 57.52 2bui n TYR 132 Cb 1.17 -0.03 0.02 0.00 -0.31 0.00 0.00 39.34 40.19 2bui n TYR 132 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2bui h VAL 133 N 0.47 1.29 -0.43 -0.72 2.07 -1.82 -3.25 116.25 113.86 2bui h VAL 133 Ca 0.00 -1.65 0.05 0.00 0.82 0.00 0.00 66.70 65.93 2bui h VAL 133 Cb 0.45 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 2bui h VAL 133 CO 0.00 0.53 0.15 0.58 0.02 0.00 0.00 177.57 178.86 2bui h VAL 134 N 0.61 0.87 0.00 2.57 2.07 -1.93 0.18 116.25 120.62 2bui h VAL 134 Ca 0.04 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2bui h VAL 134 Cb 1.02 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2bui h VAL 134 CO 0.10 0.06 -0.15 0.71 0.02 0.00 0.00 177.57 178.30 2bui h THR 135 N 0.32 0.36 0.17 2.57 1.35 -1.82 0.73 112.91 116.59 2bui h THR 135 Ca 0.20 -0.99 -0.30 0.00 -0.55 0.00 0.00 66.41 64.77 2bui h THR 135 Cb 0.19 1.75 0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2bui h THR 135 CO -0.20 0.15 -1.36 0.11 -0.25 0.00 0.00 175.52 173.97 2bui h LYS 136 N 0.00 0.36 0.00 4.72 1.57 -1.32 -3.38 116.57 118.52 2bui h LYS 136 Ca -0.00 -0.61 -0.23 0.00 -1.87 0.00 0.00 60.65 57.93 2bui h LYS 136 Cb 0.74 0.23 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 2bui h LYS 136 CO 0.02 1.28 -1.54 0.00 -0.57 0.00 0.00 179.45 178.64 2bui h ALA 137 N 0.43 0.71 -3.03 3.86 0.00 -0.48 -3.38 119.26 117.38 2bui h ALA 137 Ca -0.19 -1.18 -0.56 0.00 0.00 0.00 0.00 54.91 52.98 2bui h ALA 137 Cb 2.04 0.37 0.15 0.00 0.00 0.00 0.00 17.79 20.36 2bui h ALA 137 CO 0.22 1.29 0.47 0.00 0.00 0.00 0.00 179.25 181.22 2bui n MET 138 N -2.99 1.25 0.26 0.00 0.00 0.23 -3.92 117.12 111.95 2bui n MET 138 Ca -0.13 0.48 0.11 0.00 0.00 0.00 0.00 57.70 58.16 2bui n MET 138 Cb 0.96 -2.48 0.71 0.00 0.00 0.00 0.00 33.22 32.41 2bui n MET 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2bui h ALA 139 N 0.80 1.42 -0.31 3.17 0.00 -1.92 -2.10 119.26 120.31 2bui h ALA 139 Ca -0.50 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2bui h ALA 139 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2bui h ALA 139 CO 0.54 0.14 0.00 -1.13 0.00 0.00 0.00 179.25 178.80 2bui n SER 140 N -3.84 1.72 -0.23 0.00 3.41 -1.26 -4.47 113.62 108.95 2bui n SER 140 Ca -0.02 -1.98 0.01 0.00 -0.26 0.00 0.00 58.87 56.61 2bui n SER 140 Cb 0.21 -0.21 0.08 0.00 -0.26 0.00 0.00 64.21 64.04 2bui n SER 140 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2bui h GLY 141 N 5.28 0.54 0.85 5.00 0.00 -1.60 0.47 103.07 113.61 2bui h GLY 141 Ca 0.00 0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.59 2bui h GLY 141 CO 0.00 -0.25 0.60 -2.08 0.00 0.00 0.00 176.54 174.80 2bui h VAL 142 N 0.02 1.08 0.15 4.60 2.07 -1.85 0.39 116.25 122.71 2bui h VAL 142 Ca 0.33 -0.36 -0.28 0.00 0.82 0.00 0.00 66.70 67.21 2bui h VAL 142 Cb 0.52 -0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2bui h VAL 142 CO -0.67 0.19 -1.39 0.77 0.02 0.00 0.00 177.57 176.49 2bui h SER 143 N 1.06 0.50 -0.56 0.57 4.64 -1.37 -3.28 113.55 115.10 2bui h SER 143 Ca 0.39 -0.90 -0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2bui h SER 143 Cb 0.18 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 2bui h SER 143 CO -0.15 1.63 0.34 0.00 -0.87 0.00 0.00 176.83 177.78 2bui h ALA 144 N 0.03 0.72 0.00 5.18 0.00 -0.80 0.31 119.26 124.70 2bui h ALA 144 Ca -0.28 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2bui h ALA 144 Cb 1.86 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.42 2bui h ALA 144 CO 0.12 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.58 2bui n LEU 146 N -2.50 2.90 0.21 0.00 4.32 -1.00 -4.28 117.00 116.65 2bui n LEU 146 Ca 0.02 -0.10 0.06 0.00 -0.02 0.00 0.00 56.01 55.98 2bui n LEU 146 Cb 0.27 -0.80 0.55 0.00 -1.62 0.00 0.00 43.42 41.83 2bui n LEU 146 CO 0.23 0.86 1.00 0.00 -1.22 0.00 0.00 177.39 178.27 2bui h ALA 147 N -0.06 1.82 0.20 -1.18 0.00 -1.01 -2.26 119.26 116.78 2bui h ALA 147 Ca -0.52 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2bui h ALA 147 Cb 1.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.53 2bui h ALA 147 CO -0.10 0.14 -0.10 1.15 0.00 0.00 0.00 179.25 180.34 2bui h THR 148 N 0.07 0.39 -0.10 0.00 2.02 -1.77 -1.05 112.91 112.48 2bui h THR 148 Ca 0.02 -0.98 -0.07 0.00 0.77 0.00 0.00 66.41 66.15 2bui h THR 148 Cb 0.14 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2bui h THR 148 CO 0.01 0.11 -0.25 1.55 0.37 0.00 0.00 175.52 177.31 2bui h PRO 149 N -1.01 0.17 -0.06 6.66 0.13 -1.74 -2.33 132.00 133.83 2bui h PRO 149 Ca -0.03 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2bui h PRO 149 Cb 0.39 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.50 2bui h PRO 149 CO 0.05 0.41 0.00 1.19 -0.23 0.00 0.00 178.00 179.42 2bui n PHE 150 N -4.19 0.07 -3.57 1.56 3.01 -0.85 -4.93 117.46 108.56 2bui n PHE 150 Ca -0.01 -0.03 -0.20 0.00 1.01 0.00 0.00 57.45 58.21 2bui n PHE 150 Cb 0.34 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.88 2bui n PHE 150 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2bui n LYS 151 N -0.36 -6.22 -2.71 -1.08 5.02 -0.88 -4.60 118.16 107.33 2bui n LYS 151 Ca 0.16 0.76 -0.41 0.00 -2.02 0.00 0.00 58.31 56.80 2bui n LYS 151 Cb 0.18 -5.64 -0.04 0.00 -0.02 0.00 0.00 35.03 29.52 2bui n LYS 151 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2bui s ILE 152 N -3.44 4.62 -0.38 -0.18 -1.09 -0.41 -0.77 121.20 119.54 2bui s ILE 152 Ca 0.13 2.05 0.10 0.00 -2.23 0.00 0.00 60.65 60.70 2bui s ILE 152 Cb -0.06 -4.31 -0.12 0.00 -1.58 0.00 0.00 42.46 36.39 2bui s ILE 152 CO 0.76 0.25 0.39 1.41 -1.23 0.00 0.00 174.94 176.52 2bui n HIS 153 N 3.21 0.00 -0.09 3.97 8.25 -1.24 -4.88 115.22 124.44 2bui n HIS 153 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2bui n HIS 153 Cb 0.50 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.56 2bui n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bui n GLY 154 N 1.38 1.12 3.77 -1.41 0.00 -0.38 -4.66 105.19 105.00 2bui n GLY 154 Ca 0.01 -1.49 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 2bui n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bui s VAL 155 N 0.97 2.16 -0.28 1.61 0.11 -1.26 -4.82 120.40 118.88 2bui s VAL 155 Ca 0.00 0.15 0.02 0.00 -2.93 0.00 0.00 61.98 59.22 2bui s VAL 155 Cb 0.00 -3.08 0.17 0.00 -1.53 0.00 0.00 36.38 31.93 2bui s VAL 155 CO 0.00 0.02 0.47 0.21 -3.33 0.00 0.00 175.10 172.47 2bui s ASN 156 N -0.56 -0.29 0.06 3.54 2.47 -1.25 0.12 114.94 119.04 2bui s ASN 156 Ca 0.61 -0.06 -0.28 0.00 0.42 0.00 0.00 52.86 53.55 2bui s ASN 156 Cb -0.43 1.43 0.09 0.00 -1.45 0.00 0.00 41.25 40.90 2bui s ASN 156 CO 0.55 -0.33 1.13 -0.72 -3.72 0.00 0.00 177.10 174.01 2bui s TYR 157 N 2.64 -0.09 -0.09 0.43 1.13 -1.16 -5.00 117.35 115.22 2bui s TYR 157 Ca 0.11 -0.11 0.00 0.00 -1.41 0.00 0.00 57.07 55.67 2bui s TYR 157 Cb -0.12 0.59 -0.03 0.00 -1.10 0.00 0.00 41.96 41.30 2bui s TYR 157 CO -0.27 -0.53 -0.09 -1.12 -2.51 0.00 0.00 175.55 171.03 2bui s SER 158 N -2.94 4.43 -0.10 -0.18 0.01 -1.26 -3.17 113.70 110.49 2bui s SER 158 Ca 0.13 -0.13 -0.10 0.00 1.31 0.00 0.00 55.95 57.16 2bui s SER 158 Cb 0.02 -1.28 -0.05 0.00 0.21 0.00 0.00 66.02 64.92 2bui s SER 158 CO -0.01 0.29 0.22 -0.63 0.41 0.00 0.00 173.24 173.53 2bui s ILE 159 N -0.39 5.36 -0.03 1.44 -1.09 -1.26 -4.94 121.20 120.28 2bui s ILE 159 Ca 0.05 0.41 0.01 0.00 -2.23 0.00 0.00 60.65 58.89 2bui s ILE 159 Cb -0.12 -3.51 0.02 0.00 -1.58 0.00 0.00 42.46 37.27 2bui s ILE 159 CO 0.02 0.57 -0.02 -0.55 -1.23 0.00 0.00 174.94 173.74 2bui s SER 160 N -0.77 0.59 -0.42 3.58 0.15 -1.26 -4.17 113.70 111.40 2bui s SER 160 Ca 0.17 -0.06 0.09 0.00 0.70 0.00 0.00 55.95 56.84 2bui s SER 160 Cb -0.13 -0.30 0.37 0.00 -1.71 0.00 0.00 66.02 64.25 2bui s SER 160 CO 0.06 -0.08 1.22 -1.54 1.20 0.00 0.00 173.24 174.10 2bui n SER 161 N 4.08 -1.75 0.00 5.45 3.41 -1.26 -4.90 113.62 118.65 2bui n SER 161 Ca -0.26 -2.96 0.00 0.00 -0.26 0.00 0.00 58.87 55.39 2bui n SER 161 Cb 0.51 1.19 0.00 0.00 -0.26 0.00 0.00 64.21 65.65 2bui n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bui n ALA 162 N -0.18 0.00 1.56 7.33 0.00 -1.26 -1.07 120.51 126.88 2bui n ALA 162 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.52 2bui n ALA 162 Cb 0.79 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.57 2bui n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bui n ALA 164 N -0.73 3.08 -0.14 0.00 0.00 -0.24 -4.33 120.51 118.15 2bui n ALA 164 Ca 0.08 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2bui n ALA 164 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.18 2bui n ALA 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2bui n THR 165 N -1.09 0.00 0.27 0.00 -1.04 -1.04 -1.19 114.28 110.20 2bui n THR 165 Ca 0.02 0.72 0.14 0.00 -2.04 0.00 0.00 64.05 62.89 2bui n THR 165 Cb 0.14 -0.98 0.77 0.00 -1.82 0.00 0.00 70.33 68.44 2bui n THR 165 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2bui h SER 166 N 0.00 0.00 -0.10 8.00 4.64 -1.71 -1.44 113.55 122.94 2bui h SER 166 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2bui h SER 166 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2bui h SER 166 CO 0.00 0.09 -0.08 0.00 -0.87 0.00 0.00 176.83 175.97 2bui h ALA 167 N 1.91 0.15 -0.23 5.18 0.00 -1.42 -2.15 119.26 122.69 2bui h ALA 167 Ca -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2bui h ALA 167 Cb 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2bui h ALA 167 CO 0.01 -0.03 0.05 0.45 0.00 0.00 0.00 179.25 179.73 2bui h HIS 168 N -0.16 0.32 -0.48 0.00 -0.00 -0.70 -1.66 115.15 112.47 2bui h HIS 168 Ca 0.02 -0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.34 2bui h HIS 168 Cb 0.58 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 2bui h HIS 168 CO 0.08 0.29 0.17 0.00 -0.00 0.00 0.00 177.93 178.47 2bui h ILE 170 N 0.63 1.25 -0.67 0.00 2.04 -0.73 -1.66 117.51 118.37 2bui h ILE 170 Ca 0.16 -0.83 -0.08 0.00 1.00 0.00 0.00 64.86 65.11 2bui h ILE 170 Cb 0.24 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 2bui h ILE 170 CO -0.01 0.32 0.11 1.23 0.00 0.00 0.00 178.15 179.81 2bui h GLY 171 N 0.93 1.19 1.18 5.37 0.00 -1.05 -1.74 103.07 108.94 2bui h GLY 171 Ca 0.21 -0.79 -0.04 0.00 0.00 0.00 0.00 47.33 46.70 2bui h GLY 171 CO -0.01 0.73 0.26 -0.57 0.00 0.00 0.00 176.54 176.95 2bui h ASN 172 N 1.03 0.96 -0.80 0.19 -0.73 -0.82 -1.08 115.58 114.33 2bui h ASN 172 Ca 0.20 -0.15 -0.04 0.00 1.87 0.00 0.00 56.30 58.18 2bui h ASN 172 Cb 0.44 -0.25 -0.04 0.00 0.27 0.00 0.00 38.32 38.74 2bui h ASN 172 CO 0.01 0.87 0.33 0.00 -0.37 0.00 0.00 177.43 178.28 2bui h ALA 173 N 1.26 1.04 -0.42 1.57 0.00 -0.94 -1.47 119.26 120.31 2bui h ALA 173 Ca 0.23 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2bui h ALA 173 Cb 0.22 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bui h ALA 173 CO -0.02 0.65 0.03 0.28 0.00 0.00 0.00 179.25 180.19 2bui h VAL 174 N 1.16 1.22 -0.07 0.00 2.07 -0.68 -2.05 116.25 117.90 2bui h VAL 174 Ca 0.27 -0.85 -0.08 0.00 0.82 0.00 0.00 66.70 66.86 2bui h VAL 174 Cb 0.20 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2bui h VAL 174 CO -0.02 0.30 -0.33 -0.33 0.02 0.00 0.00 177.57 177.21 2bui h GLU 175 N 0.62 0.13 -0.35 1.57 5.08 -0.25 -1.62 114.58 119.76 2bui h GLU 175 Ca 0.13 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.33 2bui h GLU 175 Cb 0.35 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2bui h GLU 175 CO 0.01 0.44 -0.26 1.96 -1.00 0.00 0.00 179.01 180.17 2bui h GLN 176 N 0.11 0.71 -0.29 2.33 1.08 -0.58 -0.17 115.11 118.29 2bui h GLN 176 Ca 0.01 -0.29 -0.16 0.00 -1.45 0.00 0.00 58.65 56.76 2bui h GLN 176 Cb 0.63 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2bui h GLN 176 CO 0.05 0.89 -0.44 0.82 -0.95 0.00 0.00 178.83 179.19 2bui h ILE 177 N 0.61 1.29 -0.73 2.54 5.03 -1.19 -1.07 117.51 123.99 2bui h ILE 177 Ca 0.08 -1.63 -0.07 0.00 -0.12 0.00 0.00 64.86 63.13 2bui h ILE 177 Cb 0.75 1.62 -0.03 0.00 -3.03 0.00 0.00 36.82 36.13 2bui h ILE 177 CO 0.06 0.53 0.20 1.56 -0.68 0.00 0.00 178.15 179.82 2bui h GLN 178 N 0.58 1.16 0.00 2.37 4.20 -1.10 -0.27 115.11 122.04 2bui h GLN 178 Ca 0.03 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.47 2bui h GLN 178 Cb 1.04 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.66 2bui h GLN 178 CO 0.10 1.00 0.00 1.28 -0.67 0.00 0.00 178.83 180.54 2bui n LEU 179 N -4.24 0.00 -0.53 1.46 4.77 -0.09 -4.34 117.00 114.03 2bui n LEU 179 Ca 0.06 0.39 -0.07 0.00 -0.03 0.00 0.00 56.01 56.35 2bui n LEU 179 Cb 0.25 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2bui n LEU 179 CO 0.42 -0.15 -0.07 0.61 -1.33 0.00 0.00 177.39 176.87 2bui n GLY 180 N 0.29 0.88 0.09 -0.72 0.00 -0.11 -4.90 105.19 100.72 2bui n GLY 180 Ca 0.07 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.61 2bui n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bui h LYS 181 N 0.15 0.00 -4.90 1.61 1.57 -1.42 -3.47 116.57 110.10 2bui h LYS 181 Ca -0.14 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.27 2bui h LYS 181 Cb 0.57 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.64 2bui h LYS 181 CO 0.21 0.62 -0.77 -0.65 -0.57 0.00 0.00 179.45 178.28 2bui s GLN 182 N -2.79 0.71 -0.08 3.15 -1.52 -1.06 -4.77 119.66 113.30 2bui s GLN 182 Ca -0.00 -0.64 0.11 0.00 -1.95 0.00 0.00 55.36 52.88 2bui s GLN 182 Cb 0.09 -0.65 -0.24 0.00 -0.22 0.00 0.00 33.01 31.99 2bui s GLN 182 CO 0.80 0.16 0.52 -0.25 -0.25 0.00 0.00 175.29 176.27 2bui n ASP 183 N 1.98 0.89 -3.82 5.90 8.00 0.18 -4.15 116.55 125.53 2bui n ASP 183 Ca -0.18 0.32 -0.12 0.00 0.71 0.00 0.00 54.79 55.51 2bui n ASP 183 Cb 0.55 0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.54 2bui n ASP 183 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2bui s ILE 184 N -2.58 -0.00 -0.06 0.53 1.01 -0.93 -1.18 121.20 117.99 2bui s ILE 184 Ca -0.08 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 60.56 2bui s ILE 184 Cb 0.08 -0.22 0.04 0.00 0.01 0.00 0.00 42.46 42.37 2bui s ILE 184 CO 0.82 0.01 0.11 -0.69 0.00 0.00 0.00 174.94 175.18 2bui s VAL 185 N 0.16 -0.16 -0.30 2.92 1.01 0.28 -0.42 120.40 123.89 2bui s VAL 185 Ca -0.01 0.36 -0.28 0.00 0.00 0.00 0.00 61.98 62.05 2bui s VAL 185 Cb -0.02 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 36.17 2bui s VAL 185 CO -0.00 0.15 1.03 -0.36 0.00 0.00 0.00 175.10 175.91 2bui s PHE 186 N 2.02 3.20 0.02 5.22 0.40 -0.70 -1.54 117.98 126.60 2bui s PHE 186 Ca 0.02 1.21 0.08 0.00 -0.60 0.00 0.00 56.93 57.64 2bui s PHE 186 Cb -0.12 -3.52 -0.02 0.00 0.51 0.00 0.00 43.02 39.86 2bui s PHE 186 CO -0.04 -0.67 -0.25 0.00 0.70 0.00 0.00 175.22 174.96 2bui s ALA 187 N 3.45 2.12 0.00 5.36 0.00 -0.60 -0.67 121.76 131.42 2bui s ALA 187 Ca 0.43 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2bui s ALA 187 Cb -0.13 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2bui s ALA 187 CO 0.13 0.51 0.00 0.41 0.00 0.00 0.00 175.76 176.81 2bui n GLY 188 N 2.09 -0.59 3.60 0.00 0.00 -1.11 -0.01 105.19 109.16 2bui n GLY 188 Ca -0.16 -0.62 0.04 0.00 0.00 0.00 0.00 46.02 45.27 2bui n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bui n GLY 189 N 0.00 0.16 3.51 -0.02 0.00 -0.51 -2.74 105.19 105.60 2bui n GLY 189 Ca 0.00 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 2bui n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bui s GLY 190 N -3.83 0.32 -0.28 -0.02 0.00 -0.92 -1.86 107.32 100.73 2bui s GLY 190 Ca 0.29 -0.67 -0.18 0.00 0.00 0.00 0.00 44.72 44.15 2bui s GLY 190 CO -0.02 -0.56 0.77 1.85 0.00 0.00 0.00 173.10 175.14 2bui s GLU 191 N -3.96 0.66 0.64 2.90 2.56 -0.30 -4.11 118.70 117.09 2bui s GLU 191 Ca 0.17 1.05 -0.10 0.00 0.00 0.00 0.00 54.97 56.09 2bui s GLU 191 Cb 0.00 0.18 -0.01 0.00 2.00 0.00 0.00 34.13 36.30 2bui s GLU 191 CO 0.03 -0.12 1.01 -1.83 -0.56 0.00 0.00 175.26 173.79 2bui s GLU 192 N 1.28 3.18 -0.22 4.30 -1.05 -1.26 -1.56 118.70 123.37 2bui s GLU 192 Ca -0.07 0.45 0.02 0.00 -0.15 0.00 0.00 54.97 55.22 2bui s GLU 192 Cb -0.05 -2.12 0.04 0.00 -0.44 0.00 0.00 34.13 31.56 2bui s GLU 192 CO -0.15 -0.75 -0.15 -1.17 0.95 0.00 0.00 175.26 173.99 2bui s LEU 193 N -5.18 2.74 0.06 1.83 2.96 -1.26 -4.68 118.68 115.14 2bui s LEU 193 Ca 0.55 -0.96 -0.26 0.00 -0.22 0.00 0.00 54.13 53.24 2bui s LEU 193 Cb -0.11 -1.52 0.08 0.00 0.50 0.00 0.00 46.19 45.14 2bui s LEU 193 CO 0.51 -0.08 0.70 0.00 -1.32 0.00 0.00 176.35 176.16 2bui h TRP 195 N 2.25 0.00 -0.95 0.00 5.08 -1.97 -0.28 115.95 120.07 2bui h TRP 195 Ca -0.29 0.00 0.11 0.00 1.08 0.00 0.00 58.89 59.79 2bui h TRP 195 Cb 1.25 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 27.33 2bui h TRP 195 CO 0.27 0.35 0.58 0.93 -1.28 0.00 0.00 178.44 179.30 2bui h GLU 196 N 0.00 0.92 0.09 0.12 3.07 -1.96 -1.64 114.58 115.19 2bui h GLU 196 Ca -0.00 -0.06 -0.36 0.00 -0.50 0.00 0.00 59.36 58.44 2bui h GLU 196 Cb 0.72 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.39 2bui h GLU 196 CO 0.05 0.61 -2.06 -0.12 -1.40 0.00 0.00 179.01 176.09 2bui n MET 197 N -4.65 0.73 -0.23 2.33 1.56 -1.10 -4.40 117.12 111.36 2bui n MET 197 Ca 0.17 0.24 0.01 0.00 -0.27 0.00 0.00 57.70 57.85 2bui n MET 197 Cb 0.32 -1.68 0.13 0.00 2.15 0.00 0.00 33.22 34.13 2bui n MET 197 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2bui h ALA 198 N 0.15 0.93 -0.28 -5.12 0.00 -0.86 -2.21 119.26 111.87 2bui h ALA 198 Ca -0.44 0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.59 2bui h ALA 198 Cb 2.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 2bui h ALA 198 CO 0.06 -0.07 0.20 0.00 0.00 0.00 0.00 179.25 179.44 2bui h GLU 200 N 0.08 0.96 -0.14 0.00 5.08 -1.62 0.20 114.58 119.16 2bui h GLU 200 Ca 0.13 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.25 2bui h GLU 200 Cb 0.41 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.46 2bui h GLU 200 CO -0.01 0.68 -0.52 0.74 -1.00 0.00 0.00 179.01 178.90 2bui h PHE 201 N 0.97 0.78 -0.94 4.33 0.04 -1.38 -2.81 116.94 117.94 2bui h PHE 201 Ca 0.26 -0.33 0.06 0.00 2.80 0.00 0.00 57.97 60.76 2bui h PHE 201 Cb -0.05 -0.13 -0.06 0.00 2.20 0.00 0.00 35.95 37.91 2bui h PHE 201 CO -0.01 1.11 0.60 0.22 -0.60 0.00 0.00 178.31 179.62 2bui h ASP 202 N 0.23 0.95 0.26 2.17 1.82 -1.10 0.21 116.42 120.96 2bui h ASP 202 Ca -0.03 0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.61 2bui h ASP 202 Cb 1.15 -0.19 -0.00 0.00 0.68 0.00 0.00 39.33 40.97 2bui h ASP 202 CO 0.11 0.61 -0.05 0.00 -1.61 0.00 0.00 179.24 178.29 2bui h ALA 203 N 1.43 1.26 0.00 -0.78 0.00 -0.50 0.30 119.26 120.97 2bui h ALA 203 Ca 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2bui h ALA 203 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2bui h ALA 203 CO -0.17 0.07 -0.42 -1.33 0.00 0.00 0.00 179.25 177.39 2bui n MET 204 N -3.52 0.19 -1.10 0.00 2.81 0.60 -4.93 117.12 111.17 2bui n MET 204 Ca -0.02 0.08 -0.03 0.00 -1.81 0.00 0.00 57.70 55.91 2bui n MET 204 Cb 0.17 -1.65 -0.01 0.00 -0.71 0.00 0.00 33.22 31.02 2bui n MET 204 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bui n GLY 205 N 1.38 0.64 0.08 3.03 0.00 0.11 -4.92 105.19 105.51 2bui n GLY 205 Ca 0.05 -0.90 0.12 0.00 0.00 0.00 0.00 46.02 45.29 2bui n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bui n ALA 206 N 1.06 2.70 -2.67 4.61 0.00 -0.83 -4.89 120.51 120.49 2bui n ALA 206 Ca -0.03 -0.17 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 2bui n ALA 206 Cb 0.11 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 2bui n ALA 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bui s LEU 207 N -4.34 4.23 0.24 0.00 1.43 -1.26 -1.64 118.68 117.35 2bui s LEU 207 Ca 0.08 0.57 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 2bui s LEU 207 Cb 0.13 -3.32 -0.09 0.00 0.03 0.00 0.00 46.19 42.94 2bui s LEU 207 CO 0.68 0.00 1.28 -0.55 0.23 0.00 0.00 176.35 177.99 2bui s SER 208 N -2.67 6.91 0.00 2.29 0.15 -0.86 -4.60 113.70 114.92 2bui s SER 208 Ca 0.41 2.46 0.00 0.00 0.70 0.00 0.00 55.95 59.52 2bui s SER 208 Cb -0.12 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2bui s SER 208 CO 0.26 -0.48 0.06 0.35 1.20 0.00 0.00 173.24 174.63 2bui n THR 209 N 1.96 0.00 0.36 6.45 -2.24 -1.26 -4.24 114.28 115.31 2bui n THR 209 Ca 0.04 -0.15 0.12 0.00 -2.27 0.00 0.00 64.05 61.78 2bui n THR 209 Cb 0.43 1.28 0.25 0.00 -2.10 0.00 0.00 70.33 70.18 2bui n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2bui n LYS 210 N -0.18 2.43 -1.13 -0.78 5.02 -1.26 -4.36 118.16 117.90 2bui n LYS 210 Ca 0.00 -2.16 0.04 0.00 -2.02 0.00 0.00 58.31 54.17 2bui n LYS 210 Cb 0.07 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.69 2bui n LYS 210 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2bui n TYR 211 N 1.35 0.13 0.26 2.13 4.02 -1.26 -4.82 117.16 118.98 2bui n TYR 211 Ca 0.19 -1.09 0.11 0.00 -0.01 0.00 0.00 57.90 57.10 2bui n TYR 211 Cb 0.57 -0.21 0.72 0.00 -0.02 0.00 0.00 39.34 40.40 2bui n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2bui h ASN 212 N 1.09 0.00 1.40 7.72 2.35 -1.93 -1.42 115.58 124.79 2bui h ASN 212 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2bui h ASN 212 Cb 1.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.80 2bui h ASN 212 CO 0.08 0.08 0.00 0.44 -1.65 0.00 0.00 177.43 176.37 2bui h ASP 213 N 0.00 0.00 -2.20 5.81 3.45 -1.95 -3.34 116.42 118.19 2bui h ASP 213 Ca -0.00 0.00 -0.58 0.00 0.43 0.00 0.00 57.03 56.88 2bui h ASP 213 Cb 0.17 0.00 -0.39 0.00 -0.56 0.00 0.00 39.33 38.54 2bui h ASP 213 CO 0.01 0.00 -0.97 0.35 -1.57 0.00 0.00 179.24 177.06 2bui n THR 214 N -2.82 -0.28 -0.36 0.35 -2.24 -0.55 -5.01 114.28 103.37 2bui n THR 214 Ca 0.03 -4.06 0.04 0.00 -2.27 0.00 0.00 64.05 57.79 2bui n THR 214 Cb 0.40 -1.91 0.11 0.00 -2.10 0.00 0.00 70.33 66.83 2bui n THR 214 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2bui h PRO 215 N 4.57 -0.00 0.00 -0.78 0.11 -1.67 -0.27 132.00 133.96 2bui h PRO 215 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2bui h PRO 215 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2bui h PRO 215 CO 0.50 -0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.68 2bui n GLU 216 N -5.59 0.06 0.00 1.05 1.02 -1.26 -2.29 120.64 113.64 2bui n GLU 216 Ca 0.14 0.25 0.05 0.00 -0.02 0.00 0.00 57.16 57.59 2bui n GLU 216 Cb 0.47 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.34 2bui n GLU 216 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2bui n LYS 217 N -1.30 3.11 0.21 3.49 4.76 -0.11 -4.71 118.16 123.60 2bui n LYS 217 Ca 0.02 -0.11 -0.15 0.00 -2.87 0.00 0.00 58.31 55.20 2bui n LYS 217 Cb 0.04 -1.04 -0.08 0.00 -1.84 0.00 0.00 35.03 32.11 2bui n LYS 217 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bui h ALA 218 N 1.65 -0.47 -1.79 7.82 0.00 -1.49 -3.38 119.26 121.59 2bui h ALA 218 Ca 0.00 -0.10 -0.57 0.00 0.00 0.00 0.00 54.91 54.24 2bui h ALA 218 Cb 0.28 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2bui h ALA 218 CO 0.00 -0.77 1.05 0.45 0.00 0.00 0.00 179.25 179.98 2bui s SER 219 N -4.78 6.40 -0.39 0.00 0.15 -1.26 -4.73 113.70 109.09 2bui s SER 219 Ca -0.15 0.81 0.10 0.00 0.70 0.00 0.00 55.95 57.41 2bui s SER 219 Cb 0.05 -2.54 0.32 0.00 -1.71 0.00 0.00 66.02 62.14 2bui s SER 219 CO 0.64 -1.38 0.73 -2.11 1.20 0.00 0.00 173.24 172.31 2bui n ARG 220 N 7.99 0.91 -1.60 5.44 1.85 -1.26 -4.63 116.66 125.36 2bui n ARG 220 Ca 0.16 -3.16 -0.51 0.00 -1.00 0.00 0.00 57.85 53.34 2bui n ARG 220 Cb 0.48 -1.53 -0.06 0.00 -1.05 0.00 0.00 32.46 30.30 2bui n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2bui n THR 221 N 0.57 0.04 -0.70 8.89 -1.04 -1.26 -1.14 114.28 119.64 2bui n THR 221 Ca 0.22 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 2bui n THR 221 Cb 0.64 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 2bui n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2bui n TYR 222 N 2.60 0.00 -2.67 -1.42 4.01 -1.26 -4.79 117.16 113.62 2bui n TYR 222 Ca 0.18 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.52 2bui n TYR 222 Cb 0.21 -0.06 -0.05 0.00 -0.31 0.00 0.00 39.34 39.12 2bui n TYR 222 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2bui s ASP 223 N -3.22 7.54 0.56 7.72 2.15 -0.30 -1.05 116.67 130.06 2bui s ASP 223 Ca 0.00 2.02 0.27 0.00 0.43 0.00 0.00 52.55 55.27 2bui s ASP 223 Cb 0.00 -2.61 1.48 0.00 -0.30 0.00 0.00 42.92 41.48 2bui s ASP 223 CO 0.00 0.06 2.00 0.00 -0.17 0.00 0.00 175.17 177.06 2bui h ALA 224 N 4.20 2.25 -0.43 3.66 0.00 -0.92 -2.18 119.26 125.84 2bui h ALA 224 Ca -0.45 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 2bui h ALA 224 Cb 1.20 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 2bui h ALA 224 CO 0.68 -0.57 0.06 0.72 0.00 0.00 0.00 179.25 180.15 2bui n HIS 225 N -4.10 1.47 -1.38 0.00 8.25 -1.26 -5.01 115.22 113.20 2bui n HIS 225 Ca 0.07 -1.11 -0.34 0.00 -0.26 0.00 0.00 57.72 56.08 2bui n HIS 225 Cb 0.54 -0.47 0.10 0.00 1.12 0.00 0.00 29.99 31.28 2bui n HIS 225 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2bui s ARG 226 N -2.96 2.06 -0.28 -0.41 1.70 -0.82 -4.98 118.95 113.26 2bui s ARG 226 Ca 0.47 1.74 0.18 0.00 -0.47 0.00 0.00 55.73 57.65 2bui s ARG 226 Cb 0.39 -1.83 0.45 0.00 -0.57 0.00 0.00 34.95 33.39 2bui s ARG 226 CO 0.09 -1.89 1.30 -0.40 -1.08 0.00 0.00 175.30 173.32 2bui n ASP 227 N -2.84 0.12 0.00 -2.89 5.75 -1.25 -4.72 116.55 110.71 2bui n ASP 227 Ca 0.13 -2.11 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 2bui n ASP 227 Cb 0.50 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 2bui n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bui n GLY 228 N -0.97 3.17 3.88 6.12 0.00 -0.84 -3.56 105.19 113.00 2bui n GLY 228 Ca -0.05 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 2bui n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bui s PHE 229 N -2.67 3.61 -0.31 1.61 -0.12 -0.65 -3.61 117.98 115.84 2bui s PHE 229 Ca 0.00 1.16 -0.12 0.00 -0.05 0.00 0.00 56.93 57.92 2bui s PHE 229 Cb 0.00 -2.60 -0.03 0.00 -0.63 0.00 0.00 43.02 39.76 2bui s PHE 229 CO 0.00 -0.57 0.21 0.08 -0.05 0.00 0.00 175.22 174.89 2bui s VAL 230 N -3.05 5.18 0.59 -2.49 1.01 -1.26 -2.04 120.40 118.34 2bui s VAL 230 Ca 0.53 -0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.20 2bui s VAL 230 Cb -0.11 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2bui s VAL 230 CO 0.51 0.09 1.21 -0.51 0.00 0.00 0.00 175.10 176.41 2bui s ILE 231 N 1.72 2.61 0.26 2.22 2.07 -1.26 0.14 121.20 128.95 2bui s ILE 231 Ca 0.06 0.38 -0.09 0.00 -1.41 0.00 0.00 60.65 59.60 2bui s ILE 231 Cb -0.17 -3.16 -0.01 0.00 0.13 0.00 0.00 42.46 39.26 2bui s ILE 231 CO 0.10 -0.08 0.43 0.00 -1.91 0.00 0.00 174.94 173.48 2bui s ALA 232 N -1.57 0.19 0.20 1.50 0.00 -0.07 -0.32 121.76 121.69 2bui s ALA 232 Ca 0.77 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 51.60 2bui s ALA 232 Cb -0.31 1.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.90 2bui s ALA 232 CO 0.34 -0.80 0.06 0.20 0.00 0.00 0.00 175.76 175.56 2bui s GLY 233 N -3.09 1.42 0.00 0.00 0.00 -0.63 -4.26 107.32 100.76 2bui s GLY 233 Ca 0.27 -1.70 0.00 0.00 0.00 0.00 0.00 44.72 43.29 2bui s GLY 233 CO 0.12 -1.51 0.00 0.61 0.00 0.00 0.00 173.10 172.32 2bui n GLY 234 N -0.31 0.27 3.75 0.20 0.00 -0.60 -4.35 105.19 104.14 2bui n GLY 234 Ca -0.03 -1.65 -0.08 0.00 0.00 0.00 0.00 46.02 44.26 2bui n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bui s GLY 235 N 0.00 0.27 -0.06 -0.02 0.00 -0.30 -1.15 107.32 106.06 2bui s GLY 235 Ca 0.00 -0.63 -0.29 0.00 0.00 0.00 0.00 44.72 43.80 2bui s GLY 235 CO 0.00 -0.35 0.88 -0.32 0.00 0.00 0.00 173.10 173.31 2bui s GLY 236 N -2.99 -0.42 -0.19 0.20 0.00 -0.77 -1.73 107.32 101.41 2bui s GLY 236 Ca 0.16 1.41 -0.17 0.00 0.00 0.00 0.00 44.72 46.12 2bui s GLY 236 CO 0.09 0.69 0.50 -0.29 0.00 0.00 0.00 173.10 174.09 2bui s MET 237 N -2.09 0.58 0.18 2.90 1.75 -0.32 -1.42 119.30 120.88 2bui s MET 237 Ca -0.00 0.70 0.08 0.00 -1.25 0.00 0.00 55.69 55.21 2bui s MET 237 Cb -0.01 0.27 -0.04 0.00 2.84 0.00 0.00 34.83 37.89 2bui s MET 237 CO -0.02 -0.07 -0.15 0.14 -0.65 0.00 0.00 175.02 174.26 2bui s VAL 238 N 0.30 1.70 -0.39 10.11 -7.23 0.99 -0.88 120.40 125.01 2bui s VAL 238 Ca -0.00 -2.06 -0.12 0.00 -1.81 0.00 0.00 61.98 57.99 2bui s VAL 238 Cb -0.04 -1.91 0.03 0.00 0.56 0.00 0.00 36.38 35.02 2bui s VAL 238 CO 0.00 -0.50 0.23 -0.69 -0.31 0.00 0.00 175.10 173.84 2bui s VAL 239 N -2.60 4.76 -0.27 1.32 1.01 0.10 -1.55 120.40 123.17 2bui s VAL 239 Ca 0.19 -0.82 -0.16 0.00 0.00 0.00 0.00 61.98 61.19 2bui s VAL 239 Cb -0.03 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 2bui s VAL 239 CO 0.06 -0.26 0.40 -0.69 0.00 0.00 0.00 175.10 174.61 2bui s VAL 240 N 1.59 5.15 0.08 2.92 1.01 -0.59 -1.22 120.40 129.34 2bui s VAL 240 Ca 0.03 0.64 0.05 0.00 0.00 0.00 0.00 61.98 62.69 2bui s VAL 240 Cb -0.19 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2bui s VAL 240 CO 0.08 0.14 -0.13 -0.70 0.00 0.00 0.00 175.10 174.49 2bui s GLU 241 N 2.12 0.83 0.28 2.72 2.12 0.87 -0.55 118.70 127.10 2bui s GLU 241 Ca 0.16 -1.02 -0.29 0.00 0.36 0.00 0.00 54.97 54.18 2bui s GLU 241 Cb -0.16 -0.75 -0.10 0.00 0.26 0.00 0.00 34.13 33.39 2bui s GLU 241 CO 0.10 0.15 1.18 -2.00 -0.54 0.00 0.00 175.26 174.16 2bui s GLU 242 N -2.05 4.53 0.10 4.30 -6.30 -0.33 -0.25 118.70 118.70 2bui s GLU 242 Ca 0.00 1.95 -0.28 0.00 -2.50 0.00 0.00 54.97 54.14 2bui s GLU 242 Cb -0.08 -3.16 -0.11 0.00 0.00 0.00 0.00 34.13 30.79 2bui s GLU 242 CO 0.02 0.04 1.46 1.25 0.02 0.00 0.00 175.26 178.05 2bui h LEU 243 N 3.88 -1.46 -0.75 2.70 5.85 -1.24 -0.74 115.31 123.55 2bui h LEU 243 Ca -0.47 0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.49 2bui h LEU 243 Cb 1.22 0.57 -0.06 0.00 0.37 0.00 0.00 40.66 42.76 2bui h LEU 243 CO 0.68 -0.40 0.43 -0.33 -0.34 0.00 0.00 178.44 178.48 2bui h GLU 244 N -0.47 0.75 -0.43 1.25 4.39 -1.93 0.18 114.58 118.32 2bui h GLU 244 Ca 0.03 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.71 2bui h GLU 244 Cb 0.56 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.01 2bui h GLU 244 CO -0.38 0.50 0.25 1.25 -1.16 0.00 0.00 179.01 179.46 2bui h HIS 245 N 0.77 0.47 -0.29 4.33 2.76 -1.88 0.19 115.15 121.50 2bui h HIS 245 Ca 0.34 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.49 2bui h HIS 245 Cb 0.24 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.04 2bui h HIS 245 CO -0.07 0.27 0.02 0.00 -1.30 0.00 0.00 177.93 176.85 2bui h ALA 246 N 1.20 0.39 -0.26 5.26 0.00 -0.29 -2.79 119.26 122.75 2bui h ALA 246 Ca 0.17 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2bui h ALA 246 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2bui h ALA 246 CO -0.08 0.11 -0.01 -0.07 0.00 0.00 0.00 179.25 179.20 2bui h LEU 247 N 0.30 0.37 -1.35 0.00 3.38 -0.40 -2.19 115.31 115.42 2bui h LEU 247 Ca 0.08 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2bui h LEU 247 Cb 0.40 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2bui h LEU 247 CO 0.01 0.43 0.04 0.00 0.09 0.00 0.00 178.44 179.02 2bui h ALA 248 N 1.62 1.48 -0.59 1.53 0.00 -0.35 -2.58 119.26 120.37 2bui h ALA 248 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2bui h ALA 248 Cb 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2bui h ALA 248 CO 0.01 0.38 0.00 2.89 0.00 0.00 0.00 179.25 182.53 2bui n ARG 249 N -4.33 3.95 -3.66 0.00 1.85 -1.09 -4.95 116.66 108.44 2bui n ARG 249 Ca 0.01 -2.93 -0.24 0.00 -1.00 0.00 0.00 57.85 53.69 2bui n ARG 249 Cb 0.20 -1.97 0.06 0.00 -1.05 0.00 0.00 32.46 29.71 2bui n ARG 249 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2bui n GLY 250 N 0.84 -0.46 3.81 2.89 0.00 -0.97 -4.97 105.19 106.33 2bui n GLY 250 Ca 0.25 0.19 -0.32 0.00 0.00 0.00 0.00 46.02 46.14 2bui n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bui s ALA 251 N -3.37 2.80 -0.36 4.61 0.00 -0.84 -5.00 121.76 119.59 2bui s ALA 251 Ca 0.40 0.32 -0.25 0.00 0.00 0.00 0.00 51.96 52.43 2bui s ALA 251 Cb -0.19 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.74 2bui s ALA 251 CO 0.77 -0.75 0.89 -1.58 0.00 0.00 0.00 175.76 175.09 2bui s HIS 252 N -2.54 3.09 -0.38 0.00 5.65 -1.26 -4.89 115.29 114.96 2bui s HIS 252 Ca 0.62 0.74 -0.14 0.00 0.25 0.00 0.00 55.06 56.53 2bui s HIS 252 Cb -0.15 -3.58 0.00 0.00 -1.18 0.00 0.00 32.58 27.68 2bui s HIS 252 CO 0.38 -0.79 0.27 0.42 -0.65 0.00 0.00 174.74 174.37 2bui s ILE 253 N 3.37 5.27 0.02 0.89 1.01 -1.26 -4.34 121.20 126.16 2bui s ILE 253 Ca 0.37 -0.45 -0.23 0.00 0.00 0.00 0.00 60.65 60.33 2bui s ILE 253 Cb -0.12 -3.83 -0.17 0.00 0.01 0.00 0.00 42.46 38.35 2bui s ILE 253 CO 0.18 -0.17 1.36 1.88 0.00 0.00 0.00 174.94 178.19 2bui h TYR 254 N 8.57 0.15 -1.80 3.97 0.05 -1.54 -3.46 116.97 122.92 2bui h TYR 254 Ca -0.29 -0.04 0.28 0.00 0.05 0.00 0.00 58.73 58.74 2bui h TYR 254 Cb 1.14 -0.04 -0.10 0.00 1.01 0.00 0.00 36.73 38.74 2bui h TYR 254 CO 0.60 0.51 0.74 0.00 -1.05 0.00 0.00 178.16 178.97 2bui s ALA 255 N -4.55 -2.09 -0.12 3.88 0.00 -1.25 -4.62 121.76 113.02 2bui s ALA 255 Ca -0.15 0.42 -0.02 0.00 0.00 0.00 0.00 51.96 52.20 2bui s ALA 255 Cb 0.04 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.64 2bui s ALA 255 CO 0.70 -1.06 -0.03 -2.00 0.00 0.00 0.00 175.76 173.37 2bui s GLU 256 N -2.55 3.30 -0.72 0.00 2.12 0.52 -1.06 118.70 120.31 2bui s GLU 256 Ca 0.16 -0.48 -0.26 0.00 0.36 0.00 0.00 54.97 54.75 2bui s GLU 256 Cb 0.02 -2.83 0.04 0.00 0.26 0.00 0.00 34.13 31.63 2bui s GLU 256 CO -0.01 0.46 1.20 0.42 -0.54 0.00 0.00 175.26 176.79 2bui s ILE 257 N -0.23 3.88 -2.62 -3.70 1.01 -0.40 -0.89 121.20 118.25 2bui s ILE 257 Ca 0.04 0.20 0.25 0.00 0.00 0.00 0.00 60.65 61.14 2bui s ILE 257 Cb -0.13 -4.86 0.40 0.00 0.01 0.00 0.00 42.46 37.89 2bui s ILE 257 CO 0.02 -1.75 1.51 1.33 0.00 0.00 0.00 174.94 176.04 2bui n VAL 258 N 6.26 0.11 -3.63 2.92 0.24 -0.47 -4.62 118.33 119.14 2bui n VAL 258 Ca 0.01 -0.42 -0.13 0.00 -2.04 0.00 0.00 64.34 61.77 2bui n VAL 258 Cb 0.48 0.87 -0.07 0.00 -1.47 0.00 0.00 33.84 33.65 2bui n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2bui s GLY 259 N -1.85 -0.49 -0.23 7.63 0.00 -1.10 -4.74 107.32 106.54 2bui s GLY 259 Ca 0.34 2.12 -0.03 0.00 0.00 0.00 0.00 44.72 47.15 2bui s GLY 259 CO 0.31 1.77 0.34 -0.47 0.00 0.00 0.00 173.10 175.05 2bui s TYR 260 N 0.38 -0.68 -0.04 1.90 5.04 -1.26 -1.52 117.35 121.18 2bui s TYR 260 Ca 0.00 0.66 0.01 0.00 -2.44 0.00 0.00 57.07 55.30 2bui s TYR 260 Cb -0.05 -0.09 -0.03 0.00 0.35 0.00 0.00 41.96 42.14 2bui s TYR 260 CO -0.00 -0.69 -0.03 0.20 -1.34 0.00 0.00 175.55 173.69 2bui s GLY 261 N 2.49 1.80 -0.22 8.97 0.00 -0.64 -4.59 107.32 115.14 2bui s GLY 261 Ca 0.11 -0.92 -0.04 0.00 0.00 0.00 0.00 44.72 43.88 2bui s GLY 261 CO -0.15 -0.74 0.20 0.00 0.00 0.00 0.00 173.10 172.42 2bui s ALA 262 N -0.96 -0.11 0.35 3.20 0.00 -1.26 -1.88 121.76 121.10 2bui s ALA 262 Ca 0.16 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.10 2bui s ALA 262 Cb -0.11 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 2bui s ALA 262 CO 0.06 -1.32 0.08 0.25 0.00 0.00 0.00 175.76 174.83 2bui n THR 263 N 5.31 0.00 -4.04 0.00 -2.24 -0.88 -4.98 114.28 107.44 2bui n THR 263 Ca -0.05 -1.89 -0.13 0.00 -2.27 0.00 0.00 64.05 59.71 2bui n THR 263 Cb 0.48 0.57 -0.13 0.00 -2.10 0.00 0.00 70.33 69.15 2bui n THR 263 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2bui s SER 264 N -3.06 0.46 -0.04 3.42 0.15 -1.26 -1.44 113.70 111.94 2bui s SER 264 Ca 0.11 -0.21 -0.18 0.00 0.70 0.00 0.00 55.95 56.36 2bui s SER 264 Cb 0.01 -0.01 -0.32 0.00 -1.71 0.00 0.00 66.02 63.99 2bui s SER 264 CO 0.08 -0.05 0.84 0.44 1.20 0.00 0.00 173.24 175.75 2bui h ASP 265 N 5.58 0.57 -5.85 5.45 3.32 -0.90 -3.44 116.42 121.14 2bui h ASP 265 Ca -0.29 -0.93 -0.39 0.00 0.02 0.00 0.00 57.03 55.44 2bui h ASP 265 Cb 1.20 -0.18 0.13 0.00 0.22 0.00 0.00 39.33 40.70 2bui h ASP 265 CO 0.47 1.55 -0.71 0.61 -1.72 0.00 0.00 179.24 179.45 2bui n GLY 266 N 1.71 -0.50 0.00 2.75 0.00 -1.26 -4.89 105.19 102.99 2bui n GLY 266 Ca -0.18 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2bui n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bui n ALA 267 N -4.80 1.75 -2.68 4.61 0.00 -1.26 -5.13 120.51 112.99 2bui n ALA 267 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 2bui n ALA 267 Cb 0.58 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.95 2bui n ALA 267 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2bui s ASP 268 N 1.00 5.02 0.19 0.00 2.15 -1.26 -5.05 116.67 118.72 2bui s ASP 268 Ca 0.00 -0.17 0.05 0.00 0.43 0.00 0.00 52.55 52.87 2bui s ASP 268 Cb 0.00 -1.20 0.07 0.00 -0.30 0.00 0.00 42.92 41.49 2bui s ASP 268 CO 0.00 0.18 1.43 0.24 -0.17 0.00 0.00 175.17 176.86 2bui h MET 269 N 3.53 0.11 0.00 4.34 2.86 -1.99 -3.33 114.93 120.44 2bui h MET 269 Ca -0.48 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 2bui h MET 269 Cb 1.17 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.86 2bui h MET 269 CO 0.59 0.86 -0.09 1.33 1.06 0.00 0.00 176.91 180.66 2bui n VAL 270 N -3.66 0.65 -4.05 -2.22 0.24 -1.26 -1.00 118.33 107.03 2bui n VAL 270 Ca -0.02 -0.72 -0.14 0.00 -2.04 0.00 0.00 64.34 61.43 2bui n VAL 270 Cb 0.77 0.53 -0.13 0.00 -1.47 0.00 0.00 33.84 33.54 2bui n VAL 270 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bui s ALA 271 N -0.82 0.31 0.40 2.33 0.00 -1.26 -4.98 121.76 117.74 2bui s ALA 271 Ca 0.06 -0.30 -0.22 0.00 0.00 0.00 0.00 51.96 51.50 2bui s ALA 271 Cb 0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 23.12 23.04 2bui s ALA 271 CO 0.01 0.03 0.96 -1.25 0.00 0.00 0.00 175.76 175.51 2bui s PRO 272 N -0.48 4.28 -0.10 0.00 0.04 -1.26 -4.37 135.00 133.11 2bui s PRO 272 Ca -0.02 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.29 2bui s PRO 272 Cb -0.04 -2.36 -0.24 0.00 0.04 0.00 0.00 34.50 31.90 2bui s PRO 272 CO -0.00 0.01 0.42 -1.13 0.04 0.00 0.00 177.00 176.34 2bui n SER 273 N -0.31 1.34 0.00 6.66 3.41 -1.26 -5.01 113.62 118.45 2bui n SER 273 Ca 0.06 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 2bui n SER 273 Cb 0.52 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2bui n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bui n GLY 274 N 1.79 3.02 0.23 5.00 0.00 -1.26 -4.81 105.19 109.17 2bui n GLY 274 Ca -0.26 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.01 2bui n GLY 274 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2bui h GLU 275 N 0.00 0.00 -0.14 1.61 -0.00 -1.95 0.13 114.58 114.22 2bui h GLU 275 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 59.36 59.18 2bui h GLU 275 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2bui h GLU 275 CO 0.00 0.19 -0.66 0.78 -0.00 0.00 0.00 179.01 179.32 2bui h GLY 276 N 0.69 0.60 1.00 1.06 0.00 -1.87 -2.25 103.07 102.30 2bui h GLY 276 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 47.33 46.46 2bui h GLY 276 CO 0.02 0.70 -0.08 0.00 0.00 0.00 0.00 176.54 177.18 2bui h ALA 277 N 0.88 0.59 -0.06 3.60 0.00 -1.57 -1.03 119.26 121.67 2bui h ALA 277 Ca -0.02 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2bui h ALA 277 Cb 1.23 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2bui h ALA 277 CO 0.12 0.45 -0.04 0.28 0.00 0.00 0.00 179.25 180.06 2bui h VAL 278 N 0.64 0.87 -0.60 0.00 2.07 -0.72 -0.84 116.25 117.67 2bui h VAL 278 Ca 0.11 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 2bui h VAL 278 Cb 0.61 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2bui h VAL 278 CO 0.04 0.00 0.25 0.03 0.02 0.00 0.00 177.57 177.91 2bui h ARG 279 N -0.04 0.86 -0.42 1.57 3.08 -1.32 -1.77 114.38 116.35 2bui h ARG 279 Ca 0.04 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 2bui h ARG 279 Cb 0.10 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2bui h ARG 279 CO -0.09 0.70 0.11 0.00 -1.07 0.00 0.00 179.97 179.61 2bui h MET 281 N 0.54 0.52 -0.49 0.00 2.86 -0.95 -2.56 114.93 114.84 2bui h MET 281 Ca 0.13 -0.32 -0.12 0.00 -2.06 0.00 0.00 59.70 57.33 2bui h MET 281 Cb 0.31 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2bui h MET 281 CO 0.00 0.92 -0.17 0.87 1.06 0.00 0.00 176.91 179.59 2bui h LYS 282 N 0.41 0.97 -0.96 1.72 1.57 -1.22 -2.05 116.57 117.01 2bui h LYS 282 Ca 0.01 -0.38 0.01 0.00 -1.87 0.00 0.00 60.65 58.41 2bui h LYS 282 Cb 1.05 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.27 2bui h LYS 282 CO 0.10 1.06 0.62 1.98 -0.57 0.00 0.00 179.45 182.63 2bui h MET 283 N 0.85 1.27 0.00 3.15 4.05 -0.99 -0.80 114.93 122.46 2bui h MET 283 Ca 0.12 -0.09 -0.01 0.00 -0.28 0.00 0.00 59.70 59.44 2bui h MET 283 Cb 0.73 -0.28 -0.00 0.00 -0.80 0.00 0.00 31.60 31.25 2bui h MET 283 CO 0.06 0.86 -0.05 0.00 0.23 0.00 0.00 176.91 178.00 2bui h ALA 284 N 1.34 1.00 0.00 0.39 0.00 -1.23 -3.07 119.26 117.69 2bui h ALA 284 Ca 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2bui h ALA 284 Cb -0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bui h ALA 284 CO -0.07 0.07 -0.95 -1.33 0.00 0.00 0.00 179.25 176.96 2bui n MET 285 N -3.15 0.47 -1.68 0.00 2.00 -0.55 -4.19 117.12 110.02 2bui n MET 285 Ca 0.01 0.08 -0.48 0.00 0.00 0.00 0.00 57.70 57.31 2bui n MET 285 Cb 0.38 -1.74 -0.05 0.00 0.00 0.00 0.00 33.22 31.82 2bui n MET 285 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 175.97 177.55 2bui n HIS 286 N -2.39 2.34 0.00 2.03 -0.00 -0.41 -0.20 115.22 116.58 2bui n HIS 286 Ca 0.01 -0.02 0.00 0.00 0.46 0.00 0.00 57.72 58.17 2bui n HIS 286 Cb 0.50 -2.67 0.00 0.00 -0.12 0.00 0.00 29.99 27.70 2bui n HIS 286 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2bui n GLY 287 N 4.44 2.73 3.60 1.57 0.00 -1.26 -4.98 105.19 111.28 2bui n GLY 287 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 2bui n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bui s VAL 288 N -2.30 4.28 -0.90 1.61 1.01 0.72 -4.89 120.40 119.92 2bui s VAL 288 Ca 0.00 1.17 0.08 0.00 0.00 0.00 0.00 61.98 63.23 2bui s VAL 288 Cb 0.00 -4.55 0.41 0.00 0.00 0.00 0.00 36.38 32.24 2bui s VAL 288 CO 0.00 -0.93 1.18 -0.90 0.00 0.00 0.00 175.10 174.45 2bui n ASP 289 N 7.63 3.19 -4.30 3.32 5.75 -1.26 -4.87 116.55 126.00 2bui n ASP 289 Ca 0.11 -2.38 -0.26 0.00 -0.01 0.00 0.00 54.79 52.25 2bui n ASP 289 Cb 0.49 -0.53 -0.13 0.00 -1.03 0.00 0.00 41.12 39.92 2bui n ASP 289 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2bui s THR 290 N -1.83 1.84 0.53 2.12 -4.23 -1.26 -5.13 115.64 107.68 2bui s THR 290 Ca 0.28 -1.49 -0.17 0.00 -1.18 0.00 0.00 61.69 59.13 2bui s THR 290 Cb 0.20 -1.64 -0.07 0.00 1.34 0.00 0.00 72.50 72.33 2bui s THR 290 CO 0.10 0.07 1.02 -2.16 -0.54 0.00 0.00 174.62 173.11 2bui s PRO 291 N -1.70 3.73 -0.06 3.99 0.04 -1.26 -5.00 135.00 134.73 2bui s PRO 291 Ca 0.09 1.12 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 2bui s PRO 291 Cb -0.10 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 2bui s PRO 291 CO 0.04 -0.47 1.02 0.42 0.04 0.00 0.00 177.00 178.05 2bui s ILE 292 N -2.42 4.74 -0.14 0.56 -1.09 -1.26 -4.48 121.20 117.10 2bui s ILE 292 Ca 0.62 1.99 0.20 0.00 -2.23 0.00 0.00 60.65 61.23 2bui s ILE 292 Cb -0.13 -4.28 -0.16 0.00 -1.58 0.00 0.00 42.46 36.32 2bui s ILE 292 CO 0.30 0.06 0.73 0.47 -1.23 0.00 0.00 174.94 175.27 2bui n ASP 293 N 4.61 0.53 -3.72 3.58 8.00 0.43 -4.58 116.55 125.40 2bui n ASP 293 Ca 0.08 0.22 -0.12 0.00 0.71 0.00 0.00 54.79 55.67 2bui n ASP 293 Cb 0.49 0.86 -0.10 0.00 -0.02 0.00 0.00 41.12 42.35 2bui n ASP 293 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2bui s TYR 294 N -3.20 -0.50 -0.23 1.24 5.04 -1.23 -3.59 117.35 114.88 2bui s TYR 294 Ca -0.04 1.17 0.02 0.00 -2.44 0.00 0.00 57.07 55.78 2bui s TYR 294 Cb 0.10 0.19 0.05 0.00 0.35 0.00 0.00 41.96 42.65 2bui s TYR 294 CO 0.83 -0.25 -0.10 -1.17 -1.34 0.00 0.00 175.55 173.52 2bui s LEU 295 N 0.50 2.76 -0.59 6.97 1.98 0.35 -1.39 118.68 129.26 2bui s LEU 295 Ca -0.02 -1.12 -0.22 0.00 -2.89 0.00 0.00 54.13 49.87 2bui s LEU 295 Cb -0.04 -1.36 0.06 0.00 0.66 0.00 0.00 46.19 45.51 2bui s LEU 295 CO -0.03 -0.17 0.89 0.21 -1.89 0.00 0.00 176.35 175.36 2bui s ASN 296 N 1.28 6.24 0.90 3.68 3.84 0.94 -2.97 114.94 128.86 2bui s ASN 296 Ca -0.05 -0.76 -0.12 0.00 0.21 0.00 0.00 52.86 52.15 2bui s ASN 296 Cb -0.18 -2.40 0.13 0.00 -0.55 0.00 0.00 41.25 38.25 2bui s ASN 296 CO -0.07 -1.26 1.09 -0.94 -2.79 0.00 0.00 177.10 173.14 2bui s SER 297 N 3.20 3.45 0.10 -4.21 1.04 -1.15 -1.81 113.70 114.33 2bui s SER 297 Ca 0.24 1.38 -0.10 0.00 0.48 0.00 0.00 55.95 57.95 2bui s SER 297 Cb -0.16 -2.06 -0.17 0.00 0.10 0.00 0.00 66.02 63.72 2bui s SER 297 CO 0.14 -2.64 1.24 -0.74 0.98 0.00 0.00 173.24 172.22 2bui h HIS 298 N -1.55 0.86 -0.11 5.02 2.76 -1.93 -3.44 115.15 116.77 2bui h HIS 298 Ca -0.50 -0.47 0.00 0.00 -2.20 0.00 0.00 60.37 57.20 2bui h HIS 298 Cb 1.29 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 30.15 2bui h HIS 298 CO 0.40 1.30 0.00 0.41 -1.30 0.00 0.00 177.93 178.74 2bui n GLY 299 N 1.03 0.00 0.01 5.26 0.00 -1.26 -4.82 105.19 105.40 2bui n GLY 299 Ca -0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.06 2bui n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bui n THR 300 N 0.06 0.03 -1.52 2.61 -2.24 -1.26 -4.53 114.28 107.43 2bui n THR 300 Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2bui n THR 300 Cb 0.00 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 2bui n THR 300 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2bui n SER 301 N -1.55 -1.19 -4.67 3.42 2.88 -1.26 -3.83 113.62 107.41 2bui n SER 301 Ca 0.06 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.31 2bui n SER 301 Cb 0.34 -0.31 -0.08 0.00 -0.75 0.00 0.00 64.21 63.42 2bui n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2bui s THR 302 N -2.58 3.88 0.11 2.46 -4.23 -1.26 -1.98 115.64 112.04 2bui s THR 302 Ca 0.00 -1.13 -0.30 0.00 -1.18 0.00 0.00 61.69 59.09 2bui s THR 302 Cb 0.00 -2.87 -0.10 0.00 1.34 0.00 0.00 72.50 70.87 2bui s THR 302 CO 0.00 0.06 1.61 -0.65 -0.54 0.00 0.00 174.62 175.10 2bui h PRO 303 N 3.26 -0.60 0.07 3.99 0.11 -1.95 -2.87 132.00 134.02 2bui h PRO 303 Ca -0.48 0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.56 2bui h PRO 303 Cb 1.17 0.14 0.01 0.00 0.11 0.00 0.00 31.00 32.43 2bui h PRO 303 CO 0.58 -0.40 -0.48 0.28 -0.21 0.00 0.00 178.00 177.78 2bui h VAL 304 N -0.62 1.60 -0.28 3.15 2.07 -2.00 -3.38 116.25 116.80 2bui h VAL 304 Ca 0.01 -2.38 0.05 0.00 0.82 0.00 0.00 66.70 65.20 2bui h VAL 304 Cb 0.62 3.18 -0.05 0.00 -1.52 0.00 0.00 31.29 33.52 2bui h VAL 304 CO -0.16 0.66 -0.04 1.23 0.02 0.00 0.00 177.57 179.27 2bui h GLY 305 N -0.57 0.23 0.36 2.17 0.00 -1.97 -2.19 103.07 101.10 2bui h GLY 305 Ca -0.08 0.07 0.08 0.00 0.00 0.00 0.00 47.33 47.39 2bui h GLY 305 CO 0.09 -0.09 0.04 -0.55 0.00 0.00 0.00 176.54 176.03 2bui h ASP 306 N 0.03 -0.10 0.80 0.19 5.19 -1.69 -2.51 116.42 118.33 2bui h ASP 306 Ca 0.13 0.09 -0.21 0.00 -0.62 0.00 0.00 57.03 56.43 2bui h ASP 306 Cb 0.19 0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.83 2bui h ASP 306 CO -0.26 -0.02 -0.96 -0.37 -3.12 0.00 0.00 179.24 174.51 2bui h VAL 307 N 0.16 1.60 -0.69 -1.35 -1.51 -1.72 -2.92 116.25 109.82 2bui h VAL 307 Ca 0.22 -3.02 0.03 0.00 -1.23 0.00 0.00 66.70 62.69 2bui h VAL 307 Cb 0.30 2.69 -0.04 0.00 -2.13 0.00 0.00 31.29 32.10 2bui h VAL 307 CO -0.33 0.87 0.43 0.11 -1.23 0.00 0.00 177.57 177.43 2bui h LYS 308 N 0.04 0.82 -0.50 5.19 1.79 -1.17 0.10 116.57 122.85 2bui h LYS 308 Ca -0.04 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 2bui h LYS 308 Cb 1.66 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 32.10 2bui h LYS 308 CO 0.14 0.54 0.18 1.49 -1.08 0.00 0.00 179.45 180.72 2bui h GLU 309 N 0.85 0.76 -0.40 3.15 4.81 -1.46 -0.79 114.58 121.49 2bui h GLU 309 Ca 0.27 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2bui h GLU 309 Cb 0.01 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2bui h GLU 309 CO -0.10 0.69 0.16 -0.07 -0.73 0.00 0.00 179.01 178.96 2bui h LEU 310 N 0.67 0.51 -0.63 1.64 3.38 -1.16 0.24 115.31 119.95 2bui h LEU 310 Ca 0.16 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2bui h LEU 310 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2bui h LEU 310 CO -0.01 0.46 -0.26 0.00 0.09 0.00 0.00 178.44 178.72 2bui h ALA 311 N 1.62 0.81 -0.44 1.53 0.00 -0.30 -1.37 119.26 121.11 2bui h ALA 311 Ca 0.14 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 2bui h ALA 311 Cb 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2bui h ALA 311 CO -0.01 0.64 -0.16 0.00 0.00 0.00 0.00 179.25 179.72 2bui h ALA 312 N 1.02 0.62 -0.61 0.00 0.00 0.06 -2.81 119.26 117.53 2bui h ALA 312 Ca 0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2bui h ALA 312 Cb 0.79 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2bui h ALA 312 CO 0.07 0.55 0.33 0.82 0.00 0.00 0.00 179.25 181.01 2bui h ILE 313 N 0.72 1.20 -0.34 0.00 2.04 -0.33 -2.42 117.51 118.40 2bui h ILE 313 Ca 0.11 -0.52 0.05 0.00 1.00 0.00 0.00 64.86 65.50 2bui h ILE 313 Cb 0.71 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 2bui h ILE 313 CO 0.05 0.22 0.05 0.03 0.00 0.00 0.00 178.15 178.51 2bui h ARG 314 N 0.83 0.16 -0.97 2.37 3.08 -1.13 -0.87 114.38 117.85 2bui h ARG 314 Ca 0.21 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2bui h ARG 314 Cb 0.06 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.03 2bui h ARG 314 CO -0.03 0.10 0.61 1.49 -1.07 0.00 0.00 179.97 181.07 2bui h GLU 315 N 0.16 1.30 -0.06 0.04 4.81 -1.26 0.41 114.58 119.98 2bui h GLU 315 Ca 0.16 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2bui h GLU 315 Cb 0.19 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 2bui h GLU 315 CO -0.22 0.89 -0.04 0.28 -0.73 0.00 0.00 179.01 179.18 2bui h VAL 316 N 1.33 1.35 -0.02 0.32 2.07 -0.94 -3.29 116.25 117.07 2bui h VAL 316 Ca 0.35 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2bui h VAL 316 Cb -0.10 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 2bui h VAL 316 CO -0.07 0.31 -0.05 0.49 0.02 0.00 0.00 177.57 178.27 2bui n PHE 317 N -4.76 0.00 0.00 1.57 3.01 -0.38 -5.01 117.46 111.90 2bui n PHE 317 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 2bui n PHE 317 Cb 0.27 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2bui n PHE 317 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2bui n GLY 318 N 1.26 2.89 2.24 1.37 0.00 0.14 -0.35 105.19 112.76 2bui n GLY 318 Ca 0.16 0.27 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 2bui n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bui n ASP 319 N 4.51 7.23 -2.68 1.61 10.43 -1.26 -4.29 116.55 132.10 2bui n ASP 319 Ca 0.00 -3.65 -0.08 0.00 2.57 0.00 0.00 54.79 53.63 2bui n ASP 319 Cb 0.00 -0.98 0.06 0.00 1.84 0.00 0.00 41.12 42.04 2bui n ASP 319 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2bui n LYS 320 N -0.72 1.16 -2.06 -1.24 5.02 0.53 -5.12 118.16 115.73 2bui n LYS 320 Ca 0.57 -2.77 -0.41 0.00 -2.02 0.00 0.00 58.31 53.68 2bui n LYS 320 Cb 0.71 -0.85 -0.02 0.00 -0.02 0.00 0.00 35.03 34.85 2bui n LYS 320 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2bui s SER 321 N -2.47 6.70 0.54 4.39 0.01 -1.26 -4.85 113.70 116.78 2bui s SER 321 Ca 0.25 2.63 -0.04 0.00 1.31 0.00 0.00 55.95 60.10 2bui s SER 321 Cb 0.44 -2.63 -0.00 0.00 0.21 0.00 0.00 66.02 64.04 2bui s SER 321 CO -0.00 -0.65 0.83 -2.16 0.41 0.00 0.00 173.24 171.66 2bui s PRO 322 N -0.54 3.04 0.48 12.44 0.04 -1.26 -4.89 135.00 144.31 2bui s PRO 322 Ca 0.57 -0.09 -0.24 0.00 0.04 0.00 0.00 61.00 61.29 2bui s PRO 322 Cb -0.41 -2.35 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 2bui s PRO 322 CO 0.44 -0.53 1.39 0.00 0.04 0.00 0.00 177.00 178.34 2bui s ALA 323 N -2.86 3.10 0.04 8.56 0.00 -1.24 -4.51 121.76 124.85 2bui s ALA 323 Ca 0.52 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.89 2bui s ALA 323 Cb -0.10 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 2bui s ALA 323 CO 0.43 -1.22 -0.06 0.42 0.00 0.00 0.00 175.76 175.33 2bui s ILE 324 N -1.25 0.40 -0.24 0.00 1.01 0.14 -0.50 121.20 120.76 2bui s ILE 324 Ca 0.64 -1.10 -0.26 0.00 0.00 0.00 0.00 60.65 59.93 2bui s ILE 324 Cb -0.42 -0.59 0.09 0.00 0.01 0.00 0.00 42.46 41.55 2bui s ILE 324 CO 0.53 -0.47 0.83 -0.94 0.00 0.00 0.00 174.94 174.89 2bui s SER 325 N -1.67 -0.62 -0.41 3.58 1.04 -1.16 -0.44 113.70 114.02 2bui s SER 325 Ca -0.10 1.12 -0.11 0.00 0.48 0.00 0.00 55.95 57.34 2bui s SER 325 Cb -0.08 1.11 0.06 0.00 0.10 0.00 0.00 66.02 67.21 2bui s SER 325 CO -0.01 -0.26 0.26 0.00 0.98 0.00 0.00 173.24 174.21 2bui s ALA 326 N 0.07 3.32 -0.22 5.32 0.00 -1.26 -2.91 121.76 126.07 2bui s ALA 326 Ca -0.00 -2.00 0.28 0.00 0.00 0.00 0.00 51.96 50.24 2bui s ALA 326 Cb -0.04 -2.68 1.15 0.00 0.00 0.00 0.00 23.12 21.55 2bui s ALA 326 CO -0.00 -1.57 1.84 1.79 0.00 0.00 0.00 175.76 177.81 2bui h THR 327 N 5.97 0.00 -0.05 0.00 1.35 -1.84 -2.97 112.91 115.37 2bui h THR 327 Ca -0.24 -0.36 0.01 0.00 -0.55 0.00 0.00 66.41 65.27 2bui h THR 327 Cb 1.09 1.22 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2bui h THR 327 CO 0.74 0.00 0.07 0.11 -0.25 0.00 0.00 175.52 176.19 2bui h LYS 328 N 0.00 0.00 -0.04 4.72 1.57 -1.82 0.71 116.57 121.72 2bui h LYS 328 Ca 0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2bui h LYS 328 Cb 0.44 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2bui h LYS 328 CO 0.00 0.00 0.03 0.00 -0.57 0.00 0.00 179.45 178.91 2bui h ALA 329 N 1.90 1.79 0.00 3.86 0.00 -1.78 0.27 119.26 125.30 2bui h ALA 329 Ca 0.02 -0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.56 2bui h ALA 329 Cb 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 2bui h ALA 329 CO -0.00 -0.05 -2.02 -1.33 0.00 0.00 0.00 179.25 175.85 2bui n MET 330 N -4.16 0.58 0.13 0.00 2.81 0.16 -4.61 117.12 112.03 2bui n MET 330 Ca -0.02 0.39 0.05 0.00 -1.81 0.00 0.00 57.70 56.30 2bui n MET 330 Cb 0.13 -1.59 0.02 0.00 -0.71 0.00 0.00 33.22 31.07 2bui n MET 330 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2bui h THR 331 N -1.00 0.53 0.00 2.03 1.35 -1.25 0.73 112.91 115.30 2bui h THR 331 Ca -0.55 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 63.49 2bui h THR 331 Cb 1.48 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 70.05 2bui h THR 331 CO -0.34 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 175.85 2bui n GLY 332 N 1.23 -2.92 3.33 5.82 0.00 0.93 -4.61 105.19 108.98 2bui n GLY 332 Ca -0.00 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2bui n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2bui s HIS 333 N -0.84 3.29 -1.77 1.61 2.46 0.12 -4.62 115.29 115.54 2bui s HIS 333 Ca 0.00 -1.22 0.05 0.00 0.47 0.00 0.00 55.06 54.36 2bui s HIS 333 Cb 0.00 -2.88 0.16 0.00 -0.13 0.00 0.00 32.58 29.73 2bui s HIS 333 CO 0.00 -0.78 1.06 -1.13 -2.47 0.00 0.00 174.74 171.42 2bui n SER 334 N 5.02 1.14 0.00 9.88 3.41 -1.26 -0.89 113.62 130.91 2bui n SER 334 Ca -0.11 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.46 2bui n SER 334 Cb 0.44 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2bui n SER 334 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2bui n LEU 335 N 0.03 0.00 -0.06 1.04 4.77 -1.26 -1.90 117.00 119.61 2bui n LEU 335 Ca 0.06 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.16 2bui n LEU 335 Cb 0.21 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 41.81 2bui n LEU 335 CO 0.05 0.00 1.18 1.23 -1.33 0.00 0.00 177.39 178.52 2bui h GLY 336 N 0.00 0.51 0.79 -0.72 0.00 -1.85 -1.57 103.07 100.23 2bui h GLY 336 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2bui h GLY 336 CO 0.00 0.10 -0.18 0.00 0.00 0.00 0.00 176.54 176.45 2bui n ALA 337 N -2.53 2.90 -0.00 3.60 0.00 -0.80 -2.23 120.51 121.46 2bui n ALA 337 Ca 0.09 -0.30 -0.10 0.00 0.00 0.00 0.00 53.44 53.12 2bui n ALA 337 Cb 0.36 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.49 2bui n ALA 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bui h ALA 338 N 3.53 0.09 -0.15 0.00 0.00 -1.40 -2.03 119.26 119.30 2bui h ALA 338 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.99 2bui h ALA 338 Cb 0.42 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2bui h ALA 338 CO 0.00 -0.46 -0.36 0.78 0.00 0.00 0.00 179.25 179.21 2bui h GLY 339 N 0.04 -0.53 1.05 0.00 0.00 -1.76 0.22 103.07 102.09 2bui h GLY 339 Ca 0.05 0.44 -0.14 0.00 0.00 0.00 0.00 47.33 47.68 2bui h GLY 339 CO -0.08 -0.22 -0.33 -0.24 0.00 0.00 0.00 176.54 175.67 2bui h VAL 340 N -0.42 1.29 -0.84 4.60 3.04 -1.75 -0.66 116.25 121.50 2bui h VAL 340 Ca 0.09 -1.50 -0.00 0.00 -1.01 0.00 0.00 66.70 64.28 2bui h VAL 340 Cb 0.58 1.47 -0.04 0.00 -2.01 0.00 0.00 31.29 31.29 2bui h VAL 340 CO -0.38 0.49 0.51 1.56 -1.01 0.00 0.00 177.57 178.74 2bui h GLN 341 N 0.61 1.14 0.00 4.17 4.20 -1.16 -0.12 115.11 123.95 2bui h GLN 341 Ca 0.06 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 2bui h GLN 341 Cb 0.91 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 2bui h GLN 341 CO 0.08 0.80 -0.38 0.93 -0.67 0.00 0.00 178.83 179.60 2bui h GLU 342 N 1.16 0.00 -0.26 1.46 5.08 -0.48 -0.74 114.58 120.80 2bui h GLU 342 Ca 0.30 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.49 2bui h GLU 342 Cb -0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 2bui h GLU 342 CO -0.06 0.38 -0.53 0.00 -1.00 0.00 0.00 179.01 177.80 2bui h ALA 343 N 1.62 0.57 -0.56 3.43 0.00 -0.52 -1.86 119.26 121.93 2bui h ALA 343 Ca -0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 2bui h ALA 343 Cb 1.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2bui h ALA 343 CO 0.05 0.68 0.00 0.82 0.00 0.00 0.00 179.25 180.81 2bui h ILE 344 N 0.59 1.26 -0.83 0.00 2.04 -0.59 0.27 117.51 120.25 2bui h ILE 344 Ca 0.02 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 64.73 2bui h ILE 344 Cb 1.11 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.03 2bui h ILE 344 CO 0.11 0.40 0.39 1.88 0.00 0.00 0.00 178.15 180.93 2bui h TYR 345 N 0.87 1.21 -0.31 1.37 0.05 -1.01 0.36 116.97 119.51 2bui h TYR 345 Ca 0.16 -0.06 -0.10 0.00 0.05 0.00 0.00 58.73 58.77 2bui h TYR 345 Cb 0.54 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 2bui h TYR 345 CO 0.04 0.88 -0.24 0.77 -1.05 0.00 0.00 178.16 178.56 2bui h SER 346 N 1.19 0.62 -0.25 3.88 0.02 -1.00 -0.88 113.55 117.13 2bui h SER 346 Ca 0.29 -0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 60.86 2bui h SER 346 Cb 0.13 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 2bui h SER 346 CO -0.03 0.84 -0.43 -0.07 -1.14 0.00 0.00 176.83 176.00 2bui h LEU 347 N 0.53 0.87 -0.69 5.07 3.38 -0.36 -1.58 115.31 122.54 2bui h LEU 347 Ca 0.08 -0.41 -0.10 0.00 0.09 0.00 0.00 57.88 57.54 2bui h LEU 347 Cb 0.70 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2bui h LEU 347 CO 0.05 1.18 -0.04 -0.07 0.09 0.00 0.00 178.44 179.65 2bui h LEU 348 N 0.65 0.96 -0.72 1.67 3.38 -0.67 0.33 115.31 120.91 2bui h LEU 348 Ca 0.04 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 2bui h LEU 348 Cb 1.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2bui h LEU 348 CO 0.10 1.04 0.15 0.24 0.09 0.00 0.00 178.44 180.06 2bui h MET 349 N 0.89 1.13 -0.45 1.13 2.86 -1.06 -0.99 114.93 118.44 2bui h MET 349 Ca 0.16 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.41 2bui h MET 349 Cb 0.57 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2bui h MET 349 CO 0.03 1.00 -0.14 1.25 1.06 0.00 0.00 176.91 180.11 2bui h LEU 350 N 1.06 0.91 -0.55 1.22 5.85 -0.78 0.14 115.31 123.16 2bui h LEU 350 Ca 0.22 -0.37 -0.16 0.00 0.84 0.00 0.00 57.88 58.41 2bui h LEU 350 Cb 0.39 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2bui h LEU 350 CO 0.01 1.07 -0.55 -0.08 -0.34 0.00 0.00 178.44 178.55 2bui h GLU 351 N 0.73 0.51 -0.19 1.25 4.57 -0.15 -3.29 114.58 118.01 2bui h GLU 351 Ca 0.11 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 2bui h GLU 351 Cb 0.69 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 2bui h GLU 351 CO 0.05 0.93 0.00 0.72 -1.18 0.00 0.00 179.01 179.53 2bui n HIS 352 N -3.95 0.23 -3.03 0.92 8.25 -0.39 -5.03 115.22 112.21 2bui n HIS 352 Ca -0.03 -0.15 -0.07 0.00 -0.26 0.00 0.00 57.72 57.21 2bui n HIS 352 Cb 0.60 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.74 2bui n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bui n GLY 353 N 1.09 -1.08 3.45 -1.41 0.00 -0.03 -4.91 105.19 102.31 2bui n GLY 353 Ca 0.13 0.47 -0.11 0.00 0.00 0.00 0.00 46.02 46.51 2bui n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bui s PHE 354 N -3.19 -0.49 -0.19 1.61 -0.12 -0.82 -1.17 117.98 113.60 2bui s PHE 354 Ca 0.23 0.35 -0.01 0.00 -0.05 0.00 0.00 56.93 57.45 2bui s PHE 354 Cb -0.03 0.54 0.01 0.00 -0.63 0.00 0.00 43.02 42.91 2bui s PHE 354 CO 0.68 -0.74 -0.13 0.42 -0.05 0.00 0.00 175.22 175.40 2bui s ILE 355 N -3.38 2.62 0.40 -4.49 1.01 0.12 -4.54 121.20 112.94 2bui s ILE 355 Ca 0.01 -0.75 -0.26 0.00 0.00 0.00 0.00 60.65 59.65 2bui s ILE 355 Cb -0.01 -2.14 -0.09 0.00 0.01 0.00 0.00 42.46 40.23 2bui s ILE 355 CO -0.10 0.49 1.26 0.00 0.00 0.00 0.00 174.94 176.59 2bui s ALA 356 N 1.32 3.23 0.57 9.38 0.00 -1.26 -2.30 121.76 132.71 2bui s ALA 356 Ca 0.04 1.16 -0.15 0.00 0.00 0.00 0.00 51.96 53.01 2bui s ALA 356 Cb -0.14 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2bui s ALA 356 CO -0.08 -0.74 1.03 -1.25 0.00 0.00 0.00 175.76 174.72 2bui s PRO 357 N -2.23 3.58 -0.64 0.00 0.04 -1.26 -4.80 135.00 129.69 2bui s PRO 357 Ca 0.57 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 62.50 2bui s PRO 357 Cb -0.36 -2.08 0.16 0.00 0.04 0.00 0.00 34.50 32.27 2bui s PRO 357 CO 0.46 -0.59 0.59 0.45 0.04 0.00 0.00 177.00 177.95 2bui s SER 358 N -3.09 6.36 0.90 6.66 0.15 0.12 -4.72 113.70 120.08 2bui s SER 358 Ca 0.60 -2.13 -0.14 0.00 0.70 0.00 0.00 55.95 54.98 2bui s SER 358 Cb -0.13 -2.20 0.15 0.00 -1.71 0.00 0.00 66.02 62.14 2bui s SER 358 CO 0.37 -0.74 1.26 0.27 1.20 0.00 0.00 173.24 175.60 2bui s ILE 359 N 1.05 2.00 -1.94 6.45 -4.36 -1.26 -4.43 121.20 118.71 2bui s ILE 359 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.48 2bui s ILE 359 Cb -0.23 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.49 2bui s ILE 359 CO -0.01 0.00 0.00 0.59 0.24 0.00 0.00 174.94 175.76 2bui n ASN 360 N -3.59 -5.73 -4.39 4.36 3.02 -1.26 -4.55 115.26 103.13 2bui n ASN 360 Ca 0.12 0.19 -0.45 0.00 -0.03 0.00 0.00 54.58 54.41 2bui n ASN 360 Cb 0.60 -4.87 -0.02 0.00 -0.61 0.00 0.00 39.78 34.88 2bui n ASN 360 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bui s ILE 361 N -2.93 5.26 -0.04 2.41 1.01 -1.26 -4.75 121.20 120.90 2bui s ILE 361 Ca 0.00 -2.23 0.12 0.00 0.00 0.00 0.00 60.65 58.54 2bui s ILE 361 Cb 0.00 -4.64 -0.06 0.00 0.01 0.00 0.00 42.46 37.77 2bui s ILE 361 CO 0.00 -1.28 1.33 -0.33 0.00 0.00 0.00 174.94 174.66 2bui h GLU 362 N 8.03 0.00 -2.24 2.79 5.08 -1.95 -3.42 114.58 122.87 2bui h GLU 362 Ca 0.15 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.24 2bui h GLU 362 Cb 1.00 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.92 2bui h GLU 362 CO 0.95 0.70 -0.58 -2.00 -1.00 0.00 0.00 179.01 177.08 2bui s GLU 363 N -2.85 0.27 0.17 2.33 2.12 -1.26 -5.06 118.70 114.42 2bui s GLU 363 Ca 0.02 0.22 -0.32 0.00 0.36 0.00 0.00 54.97 55.26 2bui s GLU 363 Cb 0.09 -0.86 -0.10 0.00 0.26 0.00 0.00 34.13 33.51 2bui s GLU 363 CO 0.78 -0.74 1.57 -1.17 -0.54 0.00 0.00 175.26 175.16 2bui s LEU 364 N 2.40 4.37 0.35 2.70 2.96 -1.26 -0.27 118.68 129.94 2bui s LEU 364 Ca 0.09 2.63 -0.28 0.00 -0.22 0.00 0.00 54.13 56.35 2bui s LEU 364 Cb -0.15 -3.60 -0.12 0.00 0.50 0.00 0.00 46.19 42.83 2bui s LEU 364 CO -0.18 -0.83 1.43 -0.67 -1.32 0.00 0.00 176.35 174.78 2bui n ASP 365 N 3.88 3.44 0.32 3.68 2.03 -0.22 -4.72 116.55 124.97 2bui n ASP 365 Ca 0.14 1.21 0.20 0.00 0.52 0.00 0.00 54.79 56.86 2bui n ASP 365 Cb 0.38 -1.57 1.11 0.00 -0.72 0.00 0.00 41.12 40.32 2bui n ASP 365 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2bui h GLU 366 N 3.03 0.00 -0.16 -0.67 4.11 -1.92 -1.01 114.58 117.98 2bui h GLU 366 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2bui h GLU 366 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2bui h GLU 366 CO 0.65 0.00 0.00 1.04 0.07 0.00 0.00 179.01 180.77 2bui n GLN 367 N -3.36 1.37 -0.04 1.06 6.02 -1.26 -2.98 117.38 118.18 2bui n GLN 367 Ca -0.03 -0.58 0.02 0.00 -0.01 0.00 0.00 57.00 56.40 2bui n GLN 367 Cb 0.08 -1.14 0.04 0.00 1.02 0.00 0.00 30.24 30.23 2bui n GLN 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bui n ALA 368 N -0.04 2.08 -1.75 -1.58 0.00 -0.38 -4.85 120.51 113.98 2bui n ALA 368 Ca 0.06 -1.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.14 2bui n ALA 368 Cb 0.14 -0.12 0.03 0.00 0.00 0.00 0.00 19.45 19.50 2bui n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bui s ALA 369 N -0.94 2.68 0.00 0.00 0.00 -1.16 -3.26 121.76 119.08 2bui s ALA 369 Ca 0.06 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2bui s ALA 369 Cb 0.03 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2bui s ALA 369 CO 0.04 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.08 2bui n GLY 370 N 0.57 0.70 3.69 0.00 0.00 -1.26 -5.02 105.19 103.87 2bui n GLY 370 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2bui n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bui s LEU 371 N 0.00 3.38 -1.19 0.99 1.43 -1.20 -5.04 118.68 117.05 2bui s LEU 371 Ca 0.00 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.54 2bui s LEU 371 Cb 0.00 -1.97 0.20 0.00 0.03 0.00 0.00 46.19 44.46 2bui s LEU 371 CO 0.00 0.04 1.38 -3.20 0.23 0.00 0.00 176.35 174.80 2bui n ASN 372 N -0.52 5.33 -4.50 2.29 5.15 -1.26 -4.94 115.26 116.80 2bui n ASN 372 Ca -0.08 -3.01 -0.42 0.00 -0.60 0.00 0.00 54.58 50.46 2bui n ASN 372 Cb 0.57 -1.51 -0.04 0.00 -0.53 0.00 0.00 39.78 38.27 2bui n ASN 372 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2bui s ILE 373 N 0.63 4.14 -0.08 -1.44 -1.09 -1.26 -0.68 121.20 121.42 2bui s ILE 373 Ca 0.39 0.07 -0.29 0.00 -2.23 0.00 0.00 60.65 58.59 2bui s ILE 373 Cb -0.04 -4.73 -0.06 0.00 -1.58 0.00 0.00 42.46 36.06 2bui s ILE 373 CO -0.02 -1.50 1.75 -0.69 -1.23 0.00 0.00 174.94 173.25 2bui s VAL 374 N 4.59 3.45 -1.11 2.92 1.01 0.42 -4.89 120.40 126.80 2bui s VAL 374 Ca 0.29 0.54 0.10 0.00 0.00 0.00 0.00 61.98 62.91 2bui s VAL 374 Cb -0.13 -3.39 0.18 0.00 0.00 0.00 0.00 36.38 33.04 2bui s VAL 374 CO 0.14 -0.09 1.02 0.35 0.00 0.00 0.00 175.10 176.52 2bui n THR 375 N 5.83 0.45 -3.82 3.92 -2.24 -1.26 0.15 114.28 117.32 2bui n THR 375 Ca 0.19 -0.73 -0.13 0.00 -2.27 0.00 0.00 64.05 61.11 2bui n THR 375 Cb 0.43 0.89 -0.15 0.00 -2.10 0.00 0.00 70.33 69.40 2bui n THR 375 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2bui s GLU 376 N -0.93 -0.01 0.13 -0.78 -1.05 -1.26 -4.56 118.70 110.24 2bui s GLU 376 Ca 0.17 0.11 -0.35 0.00 -0.15 0.00 0.00 54.97 54.75 2bui s GLU 376 Cb 0.10 -0.12 -0.16 0.00 -0.44 0.00 0.00 34.13 33.51 2bui s GLU 376 CO 0.14 -0.09 1.28 2.41 0.95 0.00 0.00 175.26 179.95 2bui n THR 377 N 3.64 0.39 -3.97 1.83 -1.04 -1.26 -4.63 114.28 109.23 2bui n THR 377 Ca -0.20 -0.10 -0.23 0.00 -2.04 0.00 0.00 64.05 61.48 2bui n THR 377 Cb 0.55 -0.87 -0.17 0.00 -1.82 0.00 0.00 70.33 68.02 2bui n THR 377 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2bui s THR 378 N 0.21 0.65 -0.02 12.58 2.01 -0.97 -4.97 115.64 125.13 2bui s THR 378 Ca 0.79 -0.10 -0.30 0.00 0.31 0.00 0.00 61.69 62.40 2bui s THR 378 Cb -0.90 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.87 2bui s THR 378 CO 0.49 0.29 1.00 -1.81 -0.69 0.00 0.00 174.62 173.89 2bui s ASP 379 N 1.52 7.33 -0.26 3.53 1.01 -1.26 0.13 116.67 128.66 2bui s ASP 379 Ca -0.01 1.65 -0.25 0.00 0.71 0.00 0.00 52.55 54.65 2bui s ASP 379 Cb -0.13 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.32 2bui s ASP 379 CO -0.04 -0.31 0.82 -0.60 0.21 0.00 0.00 175.17 175.25 2bui s ARG 380 N 1.23 0.74 -0.33 8.23 3.52 -0.32 -4.92 118.95 127.11 2bui s ARG 380 Ca 0.52 0.82 -0.29 0.00 -0.13 0.00 0.00 55.73 56.64 2bui s ARG 380 Cb -0.21 0.36 0.02 0.00 -1.56 0.00 0.00 34.95 33.56 2bui s ARG 380 CO 0.26 -0.10 1.10 -2.00 -0.81 0.00 0.00 175.30 173.75 2bui s GLU 381 N 0.21 4.02 0.17 5.12 2.12 -1.26 -2.99 118.70 126.10 2bui s GLU 381 Ca 0.00 1.05 0.05 0.00 0.36 0.00 0.00 54.97 56.43 2bui s GLU 381 Cb -0.05 -3.77 -0.04 0.00 0.26 0.00 0.00 34.13 30.54 2bui s GLU 381 CO -0.01 -0.96 0.15 -0.51 -0.54 0.00 0.00 175.26 173.39 2bui s LEU 382 N 3.79 3.84 0.00 2.70 1.43 -1.26 -5.04 118.68 124.14 2bui s LEU 382 Ca 0.47 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2bui s LEU 382 Cb -0.12 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2bui s LEU 382 CO 0.18 0.06 0.00 0.41 0.23 0.00 0.00 176.35 177.22 2bui n THR 383 N -0.44 0.00 -4.12 5.49 -1.04 -1.26 -4.88 114.28 108.02 2bui n THR 383 Ca -0.08 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.71 2bui n THR 383 Cb 0.55 -0.45 -0.17 0.00 -1.82 0.00 0.00 70.33 68.44 2bui n THR 383 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2bui s THR 384 N -1.75 0.62 0.11 12.58 2.01 -1.26 -0.63 115.64 127.32 2bui s THR 384 Ca 0.00 -0.14 0.07 0.00 0.31 0.00 0.00 61.69 61.94 2bui s THR 384 Cb 0.00 -0.65 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2bui s THR 384 CO 0.00 0.26 -0.17 0.68 -0.69 0.00 0.00 174.62 174.69 2bui s VAL 385 N 1.12 1.52 0.07 3.82 -7.23 0.03 -0.43 120.40 119.30 2bui s VAL 385 Ca -0.08 -1.60 0.08 0.00 -1.81 0.00 0.00 61.98 58.57 2bui s VAL 385 Cb -0.14 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.27 2bui s VAL 385 CO -0.01 -0.22 -0.20 -0.32 -0.31 0.00 0.00 175.10 174.03 2bui s MET 386 N -2.21 1.23 -0.03 4.82 -2.45 -0.49 -0.75 119.30 119.42 2bui s MET 386 Ca 0.07 -1.03 -0.00 0.00 -1.25 0.00 0.00 55.69 53.47 2bui s MET 386 Cb -0.08 -1.40 0.03 0.00 1.25 0.00 0.00 34.83 34.62 2bui s MET 386 CO 0.04 0.34 0.02 0.45 1.05 0.00 0.00 175.02 176.93 2bui s SER 387 N -1.53 0.50 -0.02 1.11 0.15 -0.09 -0.04 113.70 113.78 2bui s SER 387 Ca 0.06 0.02 -0.01 0.00 0.70 0.00 0.00 55.95 56.72 2bui s SER 387 Cb -0.09 -0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 2bui s SER 387 CO 0.03 -0.15 0.11 0.20 1.20 0.00 0.00 173.24 174.63 2bui s ASN 388 N 1.32 5.87 -0.18 5.45 0.01 -0.75 -1.13 114.94 125.53 2bui s ASN 388 Ca -0.06 0.21 -0.04 0.00 -0.71 0.00 0.00 52.86 52.26 2bui s ASN 388 Cb -0.13 -1.74 0.08 0.00 0.41 0.00 0.00 41.25 39.87 2bui s ASN 388 CO -0.03 0.28 0.19 -0.44 -1.51 0.00 0.00 177.10 175.59 2bui s SER 389 N -1.71 1.53 -0.02 -1.22 0.01 0.27 -3.77 113.70 108.79 2bui s SER 389 Ca 0.23 -0.25 0.06 0.00 1.31 0.00 0.00 55.95 57.30 2bui s SER 389 Cb -0.12 0.23 -0.02 0.00 0.21 0.00 0.00 66.02 66.32 2bui s SER 389 CO 0.14 -0.32 -0.21 -0.36 0.41 0.00 0.00 173.24 172.90 2bui s PHE 390 N 2.28 2.50 0.33 2.43 0.08 -1.26 -1.09 117.98 123.25 2bui s PHE 390 Ca 0.05 -0.31 0.04 0.00 0.12 0.00 0.00 56.93 56.83 2bui s PHE 390 Cb -0.15 -1.54 -0.06 0.00 -0.57 0.00 0.00 43.02 40.69 2bui s PHE 390 CO -0.11 0.09 0.06 0.20 -0.10 0.00 0.00 175.22 175.37 2bui s GLY 391 N -0.78 2.08 0.59 4.36 0.00 0.33 -4.39 107.32 109.52 2bui s GLY 391 Ca 0.11 -2.01 -0.20 0.00 0.00 0.00 0.00 44.72 42.62 2bui s GLY 391 CO 0.00 -1.81 1.31 -1.36 0.00 0.00 0.00 173.10 171.25 2bui s PHE 392 N -3.32 2.22 0.00 1.90 2.99 -1.26 -2.84 117.98 117.67 2bui s PHE 392 Ca 0.36 1.43 0.00 0.00 0.00 0.00 0.00 56.93 58.73 2bui s PHE 392 Cb 0.08 -3.72 0.00 0.00 0.00 0.00 0.00 43.02 39.38 2bui s PHE 392 CO 0.15 -2.82 0.00 0.41 -0.00 0.00 0.00 175.22 172.96 2bui n GLY 393 N 0.77 0.80 3.68 4.36 0.00 -0.17 -4.24 105.19 110.39 2bui n GLY 393 Ca 0.13 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 2bui n GLY 393 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bui n GLY 394 N -2.36 -0.52 3.63 -0.02 0.00 -1.15 -4.73 105.19 100.04 2bui n GLY 394 Ca 0.00 0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2bui n GLY 394 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2bui s THR 395 N -3.28 5.16 0.12 2.61 -1.32 -1.13 -0.23 115.64 117.55 2bui s THR 395 Ca 0.60 0.11 0.10 0.00 -1.21 0.00 0.00 61.69 61.28 2bui s THR 395 Cb -0.28 -3.39 -0.04 0.00 -1.51 0.00 0.00 72.50 67.28 2bui s THR 395 CO 0.74 0.36 -0.24 0.20 -2.21 0.00 0.00 174.62 173.46 2bui s ASN 396 N 1.03 2.99 -0.17 8.08 -0.87 -0.52 -0.51 114.94 124.97 2bui s ASN 396 Ca 0.07 -0.72 -0.12 0.00 -1.57 0.00 0.00 52.86 50.52 2bui s ASN 396 Cb -0.14 -0.19 0.05 0.00 -0.02 0.00 0.00 41.25 40.96 2bui s ASN 396 CO 0.04 0.13 0.43 0.00 -2.57 0.00 0.00 177.10 175.14 2bui s ALA 397 N -1.09 -1.10 0.01 0.60 0.00 -0.25 -2.07 121.76 117.86 2bui s ALA 397 Ca 0.11 1.45 0.02 0.00 0.00 0.00 0.00 51.96 53.53 2bui s ALA 397 Cb -0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 2bui s ALA 397 CO 0.05 -0.25 -0.05 0.95 0.00 0.00 0.00 175.76 176.46 2bui s THR 398 N 0.93 0.41 -0.00 0.00 -4.23 -0.79 -0.56 115.64 111.39 2bui s THR 398 Ca -0.06 -0.38 0.07 0.00 -1.18 0.00 0.00 61.69 60.15 2bui s THR 398 Cb -0.06 -0.38 -0.02 0.00 1.34 0.00 0.00 72.50 73.38 2bui s THR 398 CO -0.08 0.01 -0.22 -0.76 -0.54 0.00 0.00 174.62 173.03 2bui s LEU 399 N -0.40 2.07 -0.14 4.79 1.43 -0.28 -1.61 118.68 124.53 2bui s LEU 399 Ca -0.01 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 2bui s LEU 399 Cb -0.03 -1.13 0.02 0.00 0.03 0.00 0.00 46.19 45.07 2bui s LEU 399 CO -0.00 0.26 -0.16 -0.69 0.23 0.00 0.00 176.35 175.98 2bui s VAL 400 N -0.58 1.69 -0.10 -1.59 1.01 -0.57 -0.92 120.40 119.34 2bui s VAL 400 Ca 0.09 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.37 2bui s VAL 400 Cb -0.09 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 2bui s VAL 400 CO -0.00 0.48 -0.23 -0.04 0.00 0.00 0.00 175.10 175.30 2bui s MET 401 N 1.20 3.07 0.04 2.72 -1.94 0.07 -1.36 119.30 123.11 2bui s MET 401 Ca -0.00 -0.86 0.08 0.00 -1.71 0.00 0.00 55.69 53.19 2bui s MET 401 Cb -0.14 -2.33 -0.03 0.00 2.01 0.00 0.00 34.83 34.35 2bui s MET 401 CO -0.07 0.19 -0.23 0.50 -0.01 0.00 0.00 175.02 175.40 2bui s ARG 402 N 0.33 1.55 0.35 2.03 3.52 -0.07 -0.79 118.95 125.88 2bui s ARG 402 Ca -0.18 -0.99 -0.29 0.00 -0.13 0.00 0.00 55.73 54.14 2bui s ARG 402 Cb -0.18 -1.68 -0.11 0.00 -1.56 0.00 0.00 34.95 31.42 2bui s ARG 402 CO 0.09 0.43 1.49 0.21 -0.81 0.00 0.00 175.30 176.71 2bui s LYS 403 N -1.17 4.14 0.08 5.12 2.47 0.19 -0.36 119.74 130.21 2bui s LYS 403 Ca 0.09 2.53 -0.27 0.00 -1.56 0.00 0.00 55.97 56.76 2bui s LYS 403 Cb -0.09 -3.00 -0.06 0.00 -1.46 0.00 0.00 37.83 33.23 2bui s LYS 403 CO 0.02 -0.52 0.86 -1.17 0.16 0.00 0.00 175.35 174.70 2bui s LEU 404 N -1.64 4.47 0.73 5.43 2.96 -1.26 -4.81 118.68 124.56 2bui s LEU 404 Ca 0.55 1.62 -0.17 0.00 -0.22 0.00 0.00 54.13 55.91 2bui s LEU 404 Cb -0.46 -3.41 -0.10 0.00 0.50 0.00 0.00 46.19 42.72 2bui s LEU 404 CO 0.58 -0.03 -0.05 0.29 -1.32 0.00 0.00 176.35 175.83 2bui n LYS 405 N 2.80 0.09 -0.85 1.98 5.02 -1.26 -5.09 118.16 120.85 2bui n LYS 405 Ca -0.00 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 2bui n LYS 405 Cb 0.50 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 2bui n LYS 405 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63