#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bui n LYS 2 N 0.00 1.82 -4.13 3.17 4.01 -1.26 -5.01 118.16 116.76 2bui n LYS 2 Ca 0.00 0.64 -0.32 0.00 -0.51 0.00 0.00 58.31 58.12 2bui n LYS 2 Cb 0.00 -2.25 -0.07 0.00 -0.51 0.00 0.00 35.03 32.19 2bui n LYS 2 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2bui s ARG 3 N -2.03 2.97 -0.05 1.97 0.52 -1.26 -4.42 118.95 116.66 2bui s ARG 3 Ca 0.60 -0.54 0.05 0.00 -0.52 0.00 0.00 55.73 55.31 2bui s ARG 3 Cb -0.55 -2.80 -0.02 0.00 0.52 0.00 0.00 34.95 32.10 2bui s ARG 3 CO 0.59 0.63 -0.19 0.00 0.02 0.00 0.00 175.30 176.35 2bui s ALA 4 N -1.20 2.43 0.14 2.13 0.00 -1.26 -1.34 121.76 122.66 2bui s ALA 4 Ca 0.23 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 51.21 2bui s ALA 4 Cb -0.12 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 2bui s ALA 4 CO 0.14 0.50 -0.10 0.14 0.00 0.00 0.00 175.76 176.45 2bui s VAL 5 N -0.53 1.12 -0.37 0.00 -7.23 -0.18 -0.65 120.40 112.57 2bui s VAL 5 Ca 0.07 -1.97 -0.15 0.00 -1.81 0.00 0.00 61.98 58.12 2bui s VAL 5 Cb -0.11 -1.75 -0.00 0.00 0.56 0.00 0.00 36.38 35.08 2bui s VAL 5 CO 0.01 -0.71 0.31 -0.63 -0.31 0.00 0.00 175.10 173.77 2bui s ILE 6 N -3.14 5.23 -0.38 -0.62 -1.09 0.39 -0.79 121.20 120.80 2bui s ILE 6 Ca 0.14 -0.28 0.15 0.00 -2.23 0.00 0.00 60.65 58.43 2bui s ILE 6 Cb 0.01 -3.84 0.49 0.00 -1.58 0.00 0.00 42.46 37.55 2bui s ILE 6 CO 0.00 -0.16 1.40 0.35 -1.23 0.00 0.00 174.94 175.30 2bui n THR 7 N 5.19 1.99 0.00 2.92 -2.24 -0.55 -0.67 114.28 120.92 2bui n THR 7 Ca -0.11 -1.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.03 2bui n THR 7 Cb 0.49 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2bui n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bui n GLY 8 N -0.19 1.22 3.32 3.38 0.00 -1.26 -3.79 105.19 107.87 2bui n GLY 8 Ca 0.19 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 2bui n GLY 8 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2bui s LEU 9 N 0.00 0.39 -0.03 0.99 0.05 -1.26 -0.85 118.68 117.97 2bui s LEU 9 Ca 0.00 -0.10 -0.17 0.00 0.05 0.00 0.00 54.13 53.91 2bui s LEU 9 Cb 0.00 1.78 0.03 0.00 -2.05 0.00 0.00 46.19 45.95 2bui s LEU 9 CO 0.00 -0.73 0.38 -0.83 -0.55 0.00 0.00 176.35 174.62 2bui s GLY 10 N -2.26 -0.23 -0.04 -3.48 0.00 -0.45 -3.17 107.32 97.68 2bui s GLY 10 Ca -0.03 0.55 -0.29 0.00 0.00 0.00 0.00 44.72 44.95 2bui s GLY 10 CO -0.05 0.32 0.64 -1.50 0.00 0.00 0.00 173.10 172.50 2bui s ILE 11 N -1.19 0.01 -0.22 0.90 2.07 -1.26 -1.94 121.20 119.56 2bui s ILE 11 Ca -0.12 -0.05 -0.04 0.00 -1.41 0.00 0.00 60.65 59.03 2bui s ILE 11 Cb -0.04 -0.96 0.08 0.00 0.13 0.00 0.00 42.46 41.66 2bui s ILE 11 CO 0.05 -0.03 0.10 -0.69 -1.91 0.00 0.00 174.94 172.46 2bui s VAL 12 N -1.28 0.03 0.18 4.00 1.01 -0.74 -3.01 120.40 120.60 2bui s VAL 12 Ca -0.11 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.43 2bui s VAL 12 Cb -0.01 -0.82 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 2bui s VAL 12 CO 0.09 -0.45 0.15 -1.54 0.00 0.00 0.00 175.10 173.34 2bui n SER 13 N 5.22 -0.34 0.17 3.32 3.41 0.16 -0.70 113.62 124.86 2bui n SER 13 Ca -0.07 -2.17 0.05 0.00 -0.26 0.00 0.00 58.87 56.42 2bui n SER 13 Cb 0.46 0.89 0.48 0.00 -0.26 0.00 0.00 64.21 65.77 2bui n SER 13 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2bui h SER 14 N 1.09 0.13 -0.32 4.04 0.02 -1.77 -2.88 113.55 113.87 2bui h SER 14 Ca -0.13 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2bui h SER 14 Cb 0.64 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2bui h SER 14 CO 0.18 0.24 0.00 2.30 -1.14 0.00 0.00 176.83 178.42 2bui n ILE 15 N -4.36 2.38 0.00 3.27 -5.35 -1.26 -4.45 119.36 109.59 2bui n ILE 15 Ca -0.01 -1.80 0.00 0.00 -0.27 0.00 0.00 62.75 60.67 2bui n ILE 15 Cb 0.21 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.85 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 -0.31 3.77 0.93 3.28 0.00 -1.09 -3.77 105.19 107.99 2bui n GLY 16 Ca 0.23 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 2.83 -3.76 1.61 3.02 -1.26 0.37 115.26 118.07 2bui n ASN 17 Ca 0.00 -1.91 -0.06 0.00 -0.03 0.00 0.00 54.58 52.58 2bui n ASN 17 Cb 0.00 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.05 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 -1.77 -0.26 0.23 6.41 2.20 -1.16 -4.55 114.94 116.03 2bui s ASN 18 Ca 0.34 -0.45 -0.08 0.00 -0.94 0.00 0.00 52.86 51.73 2bui s ASN 18 Cb 0.21 0.61 0.37 0.00 -2.00 0.00 0.00 41.25 40.44 2bui s ASN 18 CO 0.31 -1.11 1.67 -0.61 -2.94 0.00 0.00 177.10 174.41 2bui h GLN 19 N 2.00 0.17 0.06 3.55 4.15 -1.93 -1.95 115.11 121.17 2bui h GLN 19 Ca -0.22 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.18 2bui h GLN 19 Cb 1.25 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.90 2bui h GLN 19 CO 0.26 0.11 -0.03 1.96 -1.93 0.00 0.00 178.83 179.20 2bui h GLN 20 N 0.18 -0.08 -0.74 1.69 4.20 -1.99 -0.83 115.11 117.54 2bui h GLN 20 Ca 0.37 0.01 0.01 0.00 0.06 0.00 0.00 58.65 59.09 2bui h GLN 20 Cb 0.61 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 2bui h GLN 20 CO -0.53 0.01 0.49 0.93 -0.67 0.00 0.00 178.83 179.06 2bui h GLU 21 N -0.16 0.96 -0.30 1.46 5.08 -1.83 -2.16 114.58 117.63 2bui h GLU 21 Ca -0.01 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2bui h GLU 21 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2bui h GLU 21 CO 0.01 0.64 -0.10 0.28 -1.00 0.00 0.00 179.01 178.84 2bui h VAL 22 N 0.99 1.29 -0.23 3.13 2.07 -1.11 -1.35 116.25 121.04 2bui h VAL 22 Ca 0.27 -1.16 0.04 0.00 0.82 0.00 0.00 66.70 66.67 2bui h VAL 22 Cb -0.10 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2bui h VAL 22 CO -0.06 0.37 -0.00 0.25 0.02 0.00 0.00 177.57 178.15 2bui h LEU 23 N 0.36 -0.09 -0.27 2.57 5.85 -0.75 0.14 115.31 123.11 2bui h LEU 23 Ca 0.07 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2bui h LEU 23 Cb 0.60 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 2bui h LEU 23 CO 0.03 -0.02 0.16 0.00 -0.34 0.00 0.00 178.44 178.28 2bui h ALA 24 N 1.19 0.35 -0.53 1.25 0.00 -1.37 -1.06 119.26 119.10 2bui h ALA 24 Ca 0.11 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2bui h ALA 24 Cb 0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2bui h ALA 24 CO -0.18 -0.14 0.31 0.77 0.00 0.00 0.00 179.25 180.00 2bui h SER 25 N 0.34 0.49 -0.35 0.00 0.02 -0.84 -1.58 113.55 111.62 2bui h SER 25 Ca 0.10 0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.09 2bui h SER 25 Cb 0.03 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2bui h SER 25 CO -0.02 0.34 0.16 -0.07 -1.14 0.00 0.00 176.83 176.10 2bui h LEU 26 N 0.61 0.22 -1.78 5.07 3.38 -0.34 -1.47 115.31 121.00 2bui h LEU 26 Ca 0.22 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 2bui h LEU 26 Cb 0.05 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2bui h LEU 26 CO -0.11 0.17 -0.15 0.03 0.09 0.00 0.00 178.44 178.47 2bui h ARG 27 N 0.34 0.00 -0.13 1.13 3.08 -0.77 -3.00 114.38 115.02 2bui h ARG 27 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2bui h ARG 27 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2bui h ARG 27 CO -0.12 0.15 0.00 0.39 -1.07 0.00 0.00 179.97 179.32 2bui n GLU 28 N -4.08 2.21 -2.83 0.04 1.02 -0.64 -4.74 120.64 111.63 2bui n GLU 28 Ca -0.02 -1.96 -0.22 0.00 -0.02 0.00 0.00 57.16 54.94 2bui n GLU 28 Cb 0.23 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.23 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 1.31 -0.51 3.69 0.62 0.00 -0.60 -4.93 105.19 104.78 2bui n GLY 29 Ca 0.15 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -5.50 4.41 0.43 1.61 3.52 -0.94 -5.01 118.95 117.48 2bui s ARG 30 Ca 0.21 1.53 -0.22 0.00 -0.13 0.00 0.00 55.73 57.12 2bui s ARG 30 Cb -0.09 -3.52 -0.10 0.00 -1.56 0.00 0.00 34.95 29.67 2bui s ARG 30 CO 0.26 -0.33 0.98 0.45 -0.81 0.00 0.00 175.30 175.86 2bui s SER 31 N 1.22 6.80 -0.03 -2.12 0.15 -1.26 -4.81 113.70 113.65 2bui s SER 31 Ca 0.52 1.81 0.07 0.00 0.70 0.00 0.00 55.95 59.05 2bui s SER 31 Cb -0.22 -2.55 0.19 0.00 -1.71 0.00 0.00 66.02 61.73 2bui s SER 31 CO 0.21 -0.46 1.15 0.61 1.20 0.00 0.00 173.24 175.95 2bui n GLY 32 N -0.29 3.21 3.73 9.45 0.00 -0.10 -4.94 105.19 116.25 2bui n GLY 32 Ca 0.07 -0.35 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.36 5.10 0.26 -0.61 -1.09 -1.26 -4.11 121.20 118.14 2bui s ILE 33 Ca 0.15 1.13 0.04 0.00 -2.23 0.00 0.00 60.65 59.75 2bui s ILE 33 Cb 0.10 -3.89 -0.06 0.00 -1.58 0.00 0.00 42.46 37.03 2bui s ILE 33 CO 0.07 0.33 -0.00 0.42 -1.23 0.00 0.00 174.94 174.52 2bui s THR 34 N 0.50 1.22 0.45 2.92 -4.23 -0.89 -4.18 115.64 111.44 2bui s THR 34 Ca 0.30 -2.05 -0.22 0.00 -1.18 0.00 0.00 61.69 58.53 2bui s THR 34 Cb -0.16 -2.47 -0.08 0.00 1.34 0.00 0.00 72.50 71.12 2bui s THR 34 CO 0.14 -0.24 1.09 0.12 -0.54 0.00 0.00 174.62 175.19 2bui s PHE 35 N -3.29 3.03 -0.25 3.99 5.36 -1.26 -2.29 117.98 123.27 2bui s PHE 35 Ca 0.31 1.58 0.01 0.00 -0.96 0.00 0.00 56.93 57.87 2bui s PHE 35 Cb 0.06 -3.22 0.07 0.00 -0.34 0.00 0.00 43.02 39.59 2bui s PHE 35 CO 0.11 -1.05 -0.04 0.45 -1.46 0.00 0.00 175.22 173.23 2bui s SER 36 N -1.59 3.97 0.28 6.13 0.15 -0.07 -4.86 113.70 117.70 2bui s SER 36 Ca 0.63 -1.31 -0.02 0.00 0.70 0.00 0.00 55.95 55.95 2bui s SER 36 Cb -0.23 -1.21 0.39 0.00 -1.71 0.00 0.00 66.02 63.25 2bui s SER 36 CO 0.28 -0.26 1.84 -0.61 1.20 0.00 0.00 173.24 175.69 2bui h GLN 37 N 7.93 0.88 -0.30 5.44 5.75 -1.96 -2.77 115.11 130.08 2bui h GLN 37 Ca -0.16 -0.16 0.03 0.00 -0.15 0.00 0.00 58.65 58.20 2bui h GLN 37 Cb 1.06 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 29.44 2bui h GLN 37 CO 0.43 0.76 0.11 1.49 -2.65 0.00 0.00 178.83 178.96 2bui h GLU 38 N 0.85 0.23 -0.71 1.69 4.81 -1.97 0.29 114.58 119.78 2bui h GLU 38 Ca 0.19 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 2bui h GLU 38 Cb 0.25 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2bui h GLU 38 CO -0.01 0.15 0.19 -0.07 -0.73 0.00 0.00 179.01 178.55 2bui h LEU 39 N 0.24 1.05 -0.45 1.64 3.38 -1.84 -0.47 115.31 118.86 2bui h LEU 39 Ca 0.13 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2bui h LEU 39 Cb 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2bui h LEU 39 CO -0.13 0.99 0.09 0.50 0.09 0.00 0.00 178.44 179.98 2bui h LYS 40 N 1.06 0.74 -0.75 1.13 3.64 -1.18 -2.69 116.57 118.52 2bui h LYS 40 Ca 0.23 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2bui h LYS 40 Cb 0.34 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 2bui h LYS 40 CO -0.00 0.76 0.42 -0.44 -2.27 0.00 0.00 179.45 177.91 2bui h ASP 41 N 0.61 0.93 0.13 4.20 3.45 -0.06 -1.78 116.42 123.90 2bui h ASP 41 Ca 0.14 -0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.51 2bui h ASP 41 Cb 0.36 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 2bui h ASP 41 CO 0.01 0.75 0.00 -1.54 -1.57 0.00 0.00 179.24 176.89 2bui n SER 42 N -4.47 0.00 0.00 6.45 3.41 -0.22 -4.82 113.62 113.98 2bui n SER 42 Ca 0.07 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2bui n SER 42 Cb 0.08 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 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 -1.01 0.81 3.89 5.00 0.00 -0.67 -5.09 105.19 108.12 2bui n GLY 43 Ca 0.01 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.67 2.75 -0.01 1.61 -1.94 -1.03 -5.00 119.30 115.01 2bui s MET 44 Ca 0.00 0.37 0.15 0.00 -1.71 0.00 0.00 55.69 54.50 2bui s MET 44 Cb 0.00 -2.04 -0.19 0.00 2.01 0.00 0.00 34.83 34.61 2bui s MET 44 CO 0.00 -1.07 0.68 0.54 -0.01 0.00 0.00 175.02 175.15 2bui n ARG 45 N -3.00 0.63 -3.14 2.03 1.74 -1.26 -4.71 116.66 108.94 2bui n ARG 45 Ca 0.07 0.22 -0.42 0.00 -0.77 0.00 0.00 57.85 56.95 2bui n ARG 45 Cb 0.58 -1.77 -0.07 0.00 -1.02 0.00 0.00 32.46 30.18 2bui n ARG 45 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bui s SER 46 N -5.83 6.38 -0.33 0.55 0.15 -1.26 -4.72 113.70 108.64 2bui s SER 46 Ca -0.04 0.00 0.07 0.00 0.70 0.00 0.00 55.95 56.68 2bui s SER 46 Cb 0.08 -2.31 0.49 0.00 -1.71 0.00 0.00 66.02 62.57 2bui s SER 46 CO 0.82 -0.60 1.46 1.41 1.20 0.00 0.00 173.24 177.53 2bui n HIS 47 N 6.01 1.69 -4.15 3.44 8.25 -1.26 -4.59 115.22 124.61 2bui n HIS 47 Ca -0.02 -1.93 -0.16 0.00 -0.26 0.00 0.00 57.72 55.35 2bui n HIS 47 Cb 0.48 -0.56 -0.12 0.00 1.12 0.00 0.00 29.99 30.91 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 -3.76 0.82 0.22 1.59 -7.23 -1.26 -0.90 120.40 109.88 2bui s VAL 48 Ca 0.48 -1.08 -0.19 0.00 -1.81 0.00 0.00 61.98 59.38 2bui s VAL 48 Cb 0.42 -0.81 0.03 0.00 0.56 0.00 0.00 36.38 36.58 2bui s VAL 48 CO 0.00 -0.23 0.58 -1.66 -0.31 0.00 0.00 175.10 173.49 2bui s TRP 49 N -1.17 -0.16 -1.01 2.82 -2.14 -0.97 -4.41 118.94 111.91 2bui s TRP 49 Ca -0.05 -0.20 -0.09 0.00 2.66 0.00 0.00 56.10 58.42 2bui s TRP 49 Cb -0.09 0.48 0.25 0.00 -3.10 0.00 0.00 33.47 31.02 2bui s TRP 49 CO 0.01 -1.00 0.97 0.20 -2.66 0.00 0.00 176.95 174.48 2bui s GLY 50 N -2.88 3.08 0.32 3.67 0.00 0.74 -2.08 107.32 110.16 2bui s GLY 50 Ca 0.10 -3.72 -0.17 0.00 0.00 0.00 0.00 44.72 40.92 2bui s GLY 50 CO -0.01 1.29 0.78 0.54 0.00 0.00 0.00 173.10 175.70 2bui s ASN 51 N 1.27 6.88 -0.08 1.64 6.03 -1.26 -1.30 114.94 128.13 2bui s ASN 51 Ca 0.27 1.40 -0.29 0.00 -1.03 0.00 0.00 52.86 53.21 2bui s ASN 51 Cb -0.10 -2.42 -0.02 0.00 -3.03 0.00 0.00 41.25 35.68 2bui s ASN 51 CO -0.09 -0.19 0.97 0.68 -2.03 0.00 0.00 177.10 176.44 2bui s VAL 52 N -1.92 4.83 -1.03 3.54 -7.23 -1.26 -4.26 120.40 113.06 2bui s VAL 52 Ca 0.53 1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 62.64 2bui s VAL 52 Cb -0.11 -4.29 0.28 0.00 0.56 0.00 0.00 36.38 32.82 2bui s VAL 52 CO 0.17 0.07 1.18 0.29 -0.31 0.00 0.00 175.10 176.50 2bui n LYS 53 N 4.60 3.68 -3.72 4.82 5.02 -1.26 -4.96 118.16 126.34 2bui n LYS 53 Ca 0.07 -4.52 -0.13 0.00 -2.02 0.00 0.00 58.31 51.71 2bui n LYS 53 Cb 0.50 -2.49 -0.09 0.00 -0.02 0.00 0.00 35.03 32.92 2bui n LYS 53 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2bui s LEU 54 N -1.99 0.35 -0.47 -0.35 2.96 -1.26 -4.95 118.68 112.97 2bui s LEU 54 Ca 0.31 0.79 -0.19 0.00 -0.22 0.00 0.00 54.13 54.83 2bui s LEU 54 Cb -0.02 1.51 0.04 0.00 0.50 0.00 0.00 46.19 48.23 2bui s LEU 54 CO -0.01 -0.20 0.55 -0.62 -1.32 0.00 0.00 176.35 174.75 2bui s ASP 55 N 0.02 6.23 0.00 3.68 -1.08 -1.26 -4.91 116.67 119.34 2bui s ASP 55 Ca -0.02 -0.78 0.30 0.00 -0.52 0.00 0.00 52.55 51.53 2bui s ASP 55 Cb -0.03 -2.27 1.41 0.00 -1.46 0.00 0.00 42.92 40.57 2bui s ASP 55 CO 0.01 -0.76 1.95 0.35 0.52 0.00 0.00 175.17 177.25 2bui n THR 56 N 5.57 0.00 -1.66 1.71 -2.24 -1.26 -4.89 114.28 111.51 2bui n THR 56 Ca -0.06 -0.11 -0.48 0.00 -2.27 0.00 0.00 64.05 61.13 2bui n THR 56 Cb 0.46 -0.03 -0.05 0.00 -2.10 0.00 0.00 70.33 68.62 2bui n THR 56 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2bui n THR 57 N -0.56 0.17 -0.94 4.28 -1.04 -1.26 -1.59 114.28 113.34 2bui n THR 57 Ca 0.20 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 2bui n THR 57 Cb 0.24 -1.48 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 2bui n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bui n GLY 58 N 3.57 0.36 0.20 3.41 0.00 -1.26 -4.86 105.19 106.61 2bui n GLY 58 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 2bui n GLY 58 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bui h LEU 59 N 0.00 0.00 -8.36 0.99 3.38 -1.64 -3.45 115.31 106.24 2bui h LEU 59 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2bui h LEU 59 Cb 0.32 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.79 2bui h LEU 59 CO 0.00 0.03 -0.82 -0.63 0.09 0.00 0.00 178.44 177.10 2bui s ILE 60 N -3.22 1.35 0.34 1.22 1.01 -1.26 -5.09 121.20 115.56 2bui s ILE 60 Ca 0.06 -0.87 -0.27 0.00 0.00 0.00 0.00 60.65 59.56 2bui s ILE 60 Cb 0.06 -1.16 -0.12 0.00 0.01 0.00 0.00 42.46 41.25 2bui s ILE 60 CO 0.69 0.27 1.19 0.47 0.00 0.00 0.00 174.94 177.56 2bui n ASP 61 N 2.34 2.24 -0.31 3.58 8.00 -1.26 -4.69 116.55 126.46 2bui n ASP 61 Ca -0.16 1.18 0.04 0.00 0.71 0.00 0.00 54.79 56.56 2bui n ASP 61 Cb 0.54 -1.42 0.18 0.00 -0.02 0.00 0.00 41.12 40.40 2bui n ASP 61 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2bui h ARG 62 N 2.28 0.82 0.00 -1.24 9.65 -1.98 0.13 114.38 124.04 2bui h ARG 62 Ca -0.44 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 2bui h ARG 62 Cb 1.30 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 2bui h ARG 62 CO 0.61 0.54 0.00 0.87 2.80 0.00 0.00 179.97 184.80 2bui h LYS 63 N 0.85 0.00 0.01 0.20 1.79 -2.01 -2.75 116.57 114.65 2bui h LYS 63 Ca 0.42 0.00 -0.42 0.00 -2.18 0.00 0.00 60.65 58.47 2bui h LYS 63 Cb 0.37 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.96 2bui h LYS 63 CO -0.25 0.00 -2.39 0.28 -1.08 0.00 0.00 179.45 176.01 2bui n VAL 64 N -2.60 1.53 0.26 0.50 0.31 -0.45 -4.46 118.33 113.42 2bui n VAL 64 Ca 0.02 -0.44 0.15 0.00 -0.01 0.00 0.00 64.34 64.05 2bui n VAL 64 Cb 0.28 -1.72 0.66 0.00 -0.91 0.00 0.00 33.84 32.14 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 -0.59 0.27 0.00 2.52 3.04 -0.85 -3.05 116.25 117.59 2bui h VAL 65 Ca -0.62 -0.67 0.00 0.00 -1.01 0.00 0.00 66.70 64.40 2bui h VAL 65 Cb 1.72 1.53 0.00 0.00 -2.01 0.00 0.00 31.29 32.53 2bui h VAL 65 CO -0.26 0.09 0.05 0.08 -1.01 0.00 0.00 177.57 176.52 2bui h ARG 66 N 0.00 0.00 -0.01 4.17 0.11 -1.71 0.54 114.38 117.49 2bui h ARG 66 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bui h ARG 66 Cb 0.52 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.60 2bui h ARG 66 CO 0.01 0.00 -0.65 1.19 0.10 0.00 0.00 179.97 180.63 2bui n PHE 67 N -2.73 0.00 -3.69 4.08 3.01 -1.15 -4.85 117.46 112.13 2bui n PHE 67 Ca -0.02 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.14 2bui n PHE 67 Cb 0.10 -0.06 -0.04 0.00 -0.01 0.00 0.00 39.48 39.47 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 -2.77 3.56 0.40 -1.08 -1.94 0.18 -3.13 119.30 114.51 2bui s MET 68 Ca 0.14 -0.24 0.08 0.00 -1.71 0.00 0.00 55.69 53.96 2bui s MET 68 Cb 0.17 -2.85 -0.02 0.00 2.01 0.00 0.00 34.83 34.14 2bui s MET 68 CO 0.70 0.43 0.34 -1.54 -0.01 0.00 0.00 175.02 174.95 2bui s SER 69 N -2.83 5.07 0.30 3.03 1.04 -1.26 -4.89 113.70 114.15 2bui s SER 69 Ca 0.39 -0.70 0.03 0.00 0.48 0.00 0.00 55.95 56.15 2bui s SER 69 Cb -0.12 -0.66 0.62 0.00 0.10 0.00 0.00 66.02 65.96 2bui s SER 69 CO 0.27 -0.57 1.84 0.44 0.98 0.00 0.00 173.24 176.20 2bui h ASP 70 N 1.11 0.87 -0.60 7.02 3.32 -1.94 -1.42 116.42 124.78 2bui h ASP 70 Ca -0.42 0.05 0.09 0.00 0.02 0.00 0.00 57.03 56.77 2bui h ASP 70 Cb 1.26 -0.12 -0.07 0.00 0.22 0.00 0.00 39.33 40.62 2bui h ASP 70 CO 0.58 0.45 0.22 0.00 -1.72 0.00 0.00 179.24 178.78 2bui h ALA 71 N 1.56 0.78 -0.33 3.45 0.00 -1.86 -0.47 119.26 122.39 2bui h ALA 71 Ca 0.49 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.34 2bui h ALA 71 Cb 0.55 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2bui h ALA 71 CO -0.26 -0.19 -0.36 0.77 0.00 0.00 0.00 179.25 179.21 2bui h SER 72 N 0.41 0.79 0.19 0.00 0.02 -1.64 -2.46 113.55 110.85 2bui h SER 72 Ca 0.30 -0.34 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2bui h SER 72 Cb 0.37 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 2bui h SER 72 CO -0.30 1.07 -0.15 0.40 -1.14 0.00 0.00 176.83 176.70 2bui h ILE 73 N 0.62 0.67 -0.74 3.27 2.04 -0.45 0.18 117.51 123.11 2bui h ILE 73 Ca 0.06 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.96 2bui h ILE 73 Cb 0.89 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 2bui h ILE 73 CO 0.08 0.00 0.46 1.88 0.00 0.00 0.00 178.15 180.57 2bui h TYR 74 N -0.35 0.87 -0.02 1.37 0.05 -1.11 -1.62 116.97 116.15 2bui h TYR 74 Ca -0.01 0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.69 2bui h TYR 74 Cb 0.32 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2bui h TYR 74 CO -0.11 0.49 -0.46 0.00 -1.05 0.00 0.00 178.16 177.02 2bui h ALA 75 N 1.32 1.19 0.27 3.88 0.00 -1.19 -1.78 119.26 122.95 2bui h ALA 75 Ca 0.30 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2bui h ALA 75 Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2bui h ALA 75 CO -0.12 0.59 -0.13 0.35 0.00 0.00 0.00 179.25 179.94 2bui h PHE 76 N 0.05 -0.33 -0.79 0.00 3.57 0.15 -0.80 116.94 118.78 2bui h PHE 76 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2bui h PHE 76 Cb 0.84 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.64 2bui h PHE 76 CO 0.00 -0.02 0.52 -0.07 -2.23 0.00 0.00 178.31 176.52 2bui h LEU 77 N -0.67 0.80 -0.42 0.59 3.38 -1.29 -0.24 115.31 117.47 2bui h LEU 77 Ca -0.04 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2bui h LEU 77 Cb 0.47 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2bui h LEU 77 CO 0.06 0.54 0.10 0.28 0.09 0.00 0.00 178.44 179.51 2bui h SER 78 N 0.93 0.64 -0.47 -0.43 0.02 -1.20 -1.19 113.55 111.84 2bui h SER 78 Ca 0.32 -0.24 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 2bui h SER 78 Cb 0.11 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 2bui h SER 78 CO -0.10 0.71 -0.00 -0.03 -1.14 0.00 0.00 176.83 176.26 2bui h MET 79 N 0.54 0.89 -0.37 3.45 1.85 -0.55 0.57 114.93 121.30 2bui h MET 79 Ca 0.13 -0.26 0.01 0.00 -0.61 0.00 0.00 59.70 58.98 2bui h MET 79 Cb 0.32 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.23 2bui h MET 79 CO 0.00 0.89 0.23 1.49 -0.40 0.00 0.00 176.91 179.12 2bui h GLU 80 N 0.83 0.45 -0.27 0.39 4.81 -0.77 0.40 114.58 120.41 2bui h GLU 80 Ca 0.16 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 2bui h GLU 80 Cb 0.49 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2bui h GLU 80 CO 0.02 0.30 0.10 1.96 -0.73 0.00 0.00 179.01 180.66 2bui h GLN 81 N 0.46 0.41 -0.84 1.92 4.20 -0.84 -2.11 115.11 118.32 2bui h GLN 81 Ca 0.14 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.80 2bui h GLN 81 Cb -0.02 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 2bui h GLN 81 CO -0.06 0.45 0.55 0.00 -0.67 0.00 0.00 178.83 179.11 2bui h ALA 82 N 0.94 1.46 -0.32 3.87 0.00 -0.25 0.27 119.26 125.22 2bui h ALA 82 Ca 0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2bui h ALA 82 Cb 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2bui h ALA 82 CO -0.01 0.47 0.02 0.82 0.00 0.00 0.00 179.25 180.56 2bui h ILE 83 N 1.07 1.25 -0.61 0.00 2.04 0.01 -0.63 117.51 120.63 2bui h ILE 83 Ca 0.33 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2bui h ILE 83 Cb -0.01 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2bui h ILE 83 CO -0.09 0.30 0.23 0.00 0.00 0.00 0.00 178.15 178.59 2bui h ALA 84 N 0.87 0.79 -0.35 1.87 0.00 -0.75 -2.40 119.26 119.29 2bui h ALA 84 Ca 0.09 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2bui h ALA 84 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2bui h ALA 84 CO 0.01 0.42 -0.07 0.22 0.00 0.00 0.00 179.25 179.83 2bui h ASP 85 N 0.85 0.55 0.48 0.00 3.58 -0.29 -2.54 116.42 119.06 2bui h ASP 85 Ca 0.20 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.52 2bui h ASP 85 Cb 0.22 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2bui h ASP 85 CO -0.01 0.68 -0.10 0.00 -2.88 0.00 0.00 179.24 176.93 2bui n ALA 86 N -2.48 2.70 -2.69 -0.78 0.00 -0.26 -4.78 120.51 112.22 2bui n ALA 86 Ca 0.01 -0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 2bui n ALA 86 Cb 0.30 -1.38 0.02 0.00 0.00 0.00 0.00 19.45 18.40 2bui n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bui n GLY 87 N 1.31 -0.10 3.63 0.00 0.00 -0.96 -4.82 105.19 104.26 2bui n GLY 87 Ca 0.13 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.39 4.08 0.48 0.99 1.43 -0.95 -5.07 118.68 115.25 2bui s LEU 88 Ca 0.17 0.49 -0.07 0.00 -1.03 0.00 0.00 54.13 53.69 2bui s LEU 88 Cb -0.08 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 2bui s LEU 88 CO 0.21 -0.22 0.81 -0.94 0.23 0.00 0.00 176.35 176.45 2bui s SER 89 N 1.44 6.31 0.28 2.29 1.04 -1.26 -4.75 113.70 119.05 2bui s SER 89 Ca 0.20 1.04 0.02 0.00 0.48 0.00 0.00 55.95 57.68 2bui s SER 89 Cb -0.15 -2.29 0.63 0.00 0.10 0.00 0.00 66.02 64.31 2bui s SER 89 CO 0.09 -0.58 1.75 -0.65 0.98 0.00 0.00 173.24 174.83 2bui h PRO 90 N 0.37 0.58 0.00 4.02 0.11 -2.00 0.29 132.00 135.38 2bui h PRO 90 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2bui h PRO 90 Cb 1.20 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2bui h PRO 90 CO 0.62 0.39 0.00 0.93 -0.21 0.00 0.00 178.00 179.73 2bui h GLU 91 N 0.60 0.00 0.10 1.05 4.39 -1.93 -0.93 114.58 117.86 2bui h GLU 91 Ca 0.52 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.92 2bui h GLU 91 Cb 0.82 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 2bui h GLU 91 CO -0.41 0.00 -1.52 0.00 -1.16 0.00 0.00 179.01 175.92 2bui h ALA 92 N 2.05 0.33 0.00 3.43 0.00 -0.77 -3.42 119.26 120.89 2bui h ALA 92 Ca 0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 54.91 53.77 2bui h ALA 92 Cb 0.17 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2bui h ALA 92 CO 0.00 1.20 -1.15 2.48 0.00 0.00 0.00 179.25 181.78 2bui n TYR 93 N -3.41 0.00 -2.50 0.00 0.18 -1.12 -4.96 117.16 105.36 2bui n TYR 93 Ca -0.16 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.30 2bui n TYR 93 Cb 1.04 -0.08 -0.04 0.00 -0.38 0.00 0.00 39.34 39.88 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 -2.21 3.92 -0.83 -3.48 -0.21 -0.37 -3.80 119.66 112.67 2bui s GLN 94 Ca -0.01 1.11 -0.04 0.00 0.02 0.00 0.00 55.36 56.44 2bui s GLN 94 Cb 0.02 -2.13 0.03 0.00 1.00 0.00 0.00 33.01 31.93 2bui s GLN 94 CO 0.13 -0.30 0.16 0.09 -2.12 0.00 0.00 175.29 173.24 2bui n ASN 95 N -1.26 -2.86 -4.20 5.90 5.03 -0.19 -4.89 115.26 112.79 2bui n ASN 95 Ca 0.07 0.06 -0.35 0.00 0.87 0.00 0.00 54.58 55.24 2bui n ASN 95 Cb 0.54 -2.46 -0.14 0.00 -1.02 0.00 0.00 39.78 36.70 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 -2.26 4.76 0.00 6.41 3.84 -1.25 -4.93 114.94 121.51 2bui s ASN 96 Ca 0.15 -1.10 0.04 0.00 0.21 0.00 0.00 52.86 52.15 2bui s ASN 96 Cb -0.08 -1.72 0.17 0.00 -0.55 0.00 0.00 41.25 39.08 2bui s ASN 96 CO 0.18 -0.22 1.09 -0.81 -2.79 0.00 0.00 177.10 174.55 2bui n PRO 97 N 4.67 0.01 0.00 0.43 -0.04 -1.26 -1.01 135.00 137.80 2bui n PRO 97 Ca -0.14 0.40 0.13 0.00 -0.04 0.00 0.00 63.50 63.84 2bui n PRO 97 Cb 0.45 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.71 2bui n PRO 97 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2bui n ARG 98 N -1.46 1.66 -4.16 0.54 5.12 -1.26 -3.97 116.66 113.14 2bui n ARG 98 Ca 0.01 -1.18 -0.35 0.00 -1.93 0.00 0.00 57.85 54.40 2bui n ARG 98 Cb 0.04 -1.48 -0.12 0.00 -1.16 0.00 0.00 32.46 29.74 2bui n ARG 98 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2bui s VAL 99 N -2.15 3.95 0.44 1.55 1.01 -0.18 -1.27 120.40 123.75 2bui s VAL 99 Ca 0.30 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2bui s VAL 99 Cb 0.20 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 2bui s VAL 99 CO 0.39 0.45 0.07 0.61 0.00 0.00 0.00 175.10 176.61 2bui n GLY 100 N 4.05 3.44 3.19 4.51 0.00 0.12 -0.25 105.19 120.25 2bui n GLY 100 Ca -0.17 -2.24 -0.10 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 -0.38 -0.26 0.99 0.20 -0.13 -0.94 118.68 118.16 2bui s LEU 101 Ca 0.09 0.85 -0.02 0.00 0.69 0.00 0.00 54.13 55.74 2bui s LEU 101 Cb 0.00 1.15 0.08 0.00 -0.43 0.00 0.00 46.19 47.00 2bui s LEU 101 CO 0.07 -0.22 0.06 -0.63 -0.29 0.00 0.00 176.35 175.34 2bui s ILE 102 N 2.24 0.71 -0.07 6.68 1.01 -0.41 -3.03 121.20 128.32 2bui s ILE 102 Ca -0.03 -1.00 -0.12 0.00 0.00 0.00 0.00 60.65 59.50 2bui s ILE 102 Cb -0.11 -1.37 0.03 0.00 0.01 0.00 0.00 42.46 41.02 2bui s ILE 102 CO -0.11 -0.45 0.30 0.00 0.00 0.00 0.00 174.94 174.67 2bui s ALA 103 N 1.74 -0.75 0.08 9.38 0.00 -1.17 -2.40 121.76 128.63 2bui s ALA 103 Ca 0.04 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.59 2bui s ALA 103 Cb -0.17 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.71 2bui s ALA 103 CO -0.18 -0.20 0.10 0.41 0.00 0.00 0.00 175.76 175.90 2bui n GLY 104 N 2.16 3.10 3.17 0.00 0.00 -1.07 -3.48 105.19 109.06 2bui n GLY 104 Ca -0.17 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.51 0.58 0.08 1.61 1.04 -1.26 -1.93 113.70 112.31 2bui s SER 105 Ca 0.07 -1.18 -0.02 0.00 0.48 0.00 0.00 55.95 55.30 2bui s SER 105 Cb -0.00 0.24 -0.27 0.00 0.10 0.00 0.00 66.02 66.09 2bui s SER 105 CO 0.05 -0.67 1.16 1.23 0.98 0.00 0.00 173.24 175.99 2bui h GLY 106 N 2.85 0.25 -0.26 7.32 0.00 -1.81 -3.40 103.07 108.02 2bui h GLY 106 Ca -0.35 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 46.34 2bui h GLY 106 CO 0.61 0.56 -0.13 0.61 0.00 0.00 0.00 176.54 178.18 2bui n GLY 107 N 1.50 1.40 7.00 4.60 0.00 -1.26 -4.66 105.19 113.77 2bui n GLY 107 Ca -0.07 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.49 1.36 2.56 -0.02 0.00 -1.26 -3.74 105.19 103.59 2bui n GLY 108 Ca 0.04 0.26 -0.19 0.00 0.00 0.00 0.00 46.02 46.14 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 0.53 0.34 1.61 0.15 -1.25 -4.69 113.70 106.39 2bui s SER 109 Ca 0.00 -2.43 0.06 0.00 0.70 0.00 0.00 55.95 54.27 2bui s SER 109 Cb 0.00 0.42 0.71 0.00 -1.71 0.00 0.00 66.02 65.44 2bui s SER 109 CO 0.00 -0.15 1.89 -0.65 1.20 0.00 0.00 173.24 175.54 2bui h PRO 110 N 5.68 0.79 -0.22 5.44 0.11 -1.92 -1.52 132.00 140.36 2bui h PRO 110 Ca 0.17 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.27 2bui h PRO 110 Cb 0.99 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.89 2bui h PRO 110 CO 0.23 0.52 -0.00 -0.09 -0.21 0.00 0.00 178.00 178.45 2bui h ARG 111 N 0.81 0.06 0.00 1.05 2.43 -1.94 0.07 114.38 116.87 2bui h ARG 111 Ca 0.41 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.51 2bui h ARG 111 Cb 0.48 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2bui h ARG 111 CO -0.18 0.04 -0.34 0.74 -1.51 0.00 0.00 179.97 178.73 2bui h PHE 112 N 0.06 0.00 -0.48 2.20 -1.00 -1.79 0.10 116.94 116.03 2bui h PHE 112 Ca 0.10 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.81 2bui h PHE 112 Cb 0.13 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.67 2bui h PHE 112 CO -0.19 0.34 0.03 1.96 -1.61 0.00 0.00 178.31 178.84 2bui h GLN 113 N 0.00 0.83 -0.28 1.51 4.20 -0.75 -0.77 115.11 119.85 2bui h GLN 113 Ca -0.00 -0.25 -0.17 0.00 0.06 0.00 0.00 58.65 58.29 2bui h GLN 113 Cb 1.04 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.73 2bui h GLN 113 CO 0.04 0.85 -0.50 0.28 -0.67 0.00 0.00 178.83 178.84 2bui h VAL 114 N 0.69 1.29 -0.25 -0.54 2.07 -0.77 -3.01 116.25 115.73 2bui h VAL 114 Ca 0.14 -1.70 0.03 0.00 0.82 0.00 0.00 66.70 65.99 2bui h VAL 114 Cb 0.46 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 2bui h VAL 114 CO 0.02 0.55 0.06 0.15 0.02 0.00 0.00 177.57 178.37 2bui h PHE 115 N 0.60 0.11 -0.51 1.57 3.57 -0.49 -0.48 116.94 121.32 2bui h PHE 115 Ca 0.03 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.60 2bui h PHE 115 Cb 1.07 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.75 2bui h PHE 115 CO 0.06 0.04 0.22 0.78 -2.23 0.00 0.00 178.31 177.18 2bui h GLY 116 N 0.17 0.70 1.19 2.40 0.00 -1.11 0.26 103.07 106.67 2bui h GLY 116 Ca 0.11 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.20 2bui h GLY 116 CO -0.14 0.06 -0.08 0.00 0.00 0.00 0.00 176.54 176.38 2bui h ALA 117 N 1.30 0.86 -0.22 3.60 0.00 -1.36 -0.78 119.26 122.66 2bui h ALA 117 Ca 0.23 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2bui h ALA 117 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2bui h ALA 117 CO -0.20 0.65 0.02 -0.44 0.00 0.00 0.00 179.25 179.29 2bui h ASP 118 N 0.86 0.36 -0.10 0.00 3.45 -0.55 -2.62 116.42 117.82 2bui h ASP 118 Ca 0.14 -0.28 0.01 0.00 0.43 0.00 0.00 57.03 57.33 2bui h ASP 118 Cb 0.62 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.29 2bui h ASP 118 CO 0.04 0.55 0.03 0.00 -1.57 0.00 0.00 179.24 178.28 2bui h ALA 119 N 0.82 0.10 -0.52 3.45 0.00 -0.36 -2.65 119.26 120.10 2bui h ALA 119 Ca 0.06 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2bui h ALA 119 Cb 0.35 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2bui h ALA 119 CO 0.01 -0.44 0.35 1.98 0.00 0.00 0.00 179.25 181.15 2bui h MET 120 N 0.07 0.44 -0.03 0.00 1.85 -1.12 -0.40 114.93 115.74 2bui h MET 120 Ca 0.04 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.10 2bui h MET 120 Cb 0.03 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 31.96 2bui h MET 120 CO -0.05 0.29 0.00 0.54 -0.40 0.00 0.00 176.91 177.29 2bui n ARG 121 N -4.47 1.32 -2.87 0.39 1.74 -0.99 -4.34 116.66 107.44 2bui n ARG 121 Ca 0.07 -0.47 -0.21 0.00 -0.77 0.00 0.00 57.85 56.48 2bui n ARG 121 Cb 0.26 -1.44 0.08 0.00 -1.02 0.00 0.00 32.46 30.33 2bui n ARG 121 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2bui s GLY 122 N -1.87 1.75 0.35 -0.13 0.00 -0.16 -4.99 107.32 102.27 2bui s GLY 122 Ca 0.39 -1.97 0.24 0.00 0.00 0.00 0.00 44.72 43.38 2bui s GLY 122 CO 0.32 -1.48 1.73 -0.56 0.00 0.00 0.00 173.10 173.11 2bui h PRO 123 N -0.07 0.00 0.00 2.90 0.13 -1.90 -2.60 132.00 130.46 2bui h PRO 123 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2bui h PRO 123 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2bui h PRO 123 CO 0.41 0.00 -0.81 0.54 -0.23 0.00 0.00 178.00 177.91 2bui n ARG 124 N -2.34 1.87 0.00 0.86 1.74 -1.26 -5.05 116.66 112.49 2bui n ARG 124 Ca -0.01 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2bui n ARG 124 Cb 0.07 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 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 1.38 2.68 0.36 -0.13 0.00 -0.98 -0.82 105.19 107.69 2bui n GLY 125 Ca 0.02 0.07 0.24 0.00 0.00 0.00 0.00 46.02 46.36 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 0.51 -0.23 0.99 3.38 -1.85 -0.21 115.31 117.89 2bui h LEU 126 Ca 0.00 0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.17 2bui h LEU 126 Cb 0.00 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2bui h LEU 126 CO 0.00 -0.06 -0.01 0.11 0.09 0.00 0.00 178.44 178.57 2bui h LYS 127 N 0.36 0.06 -0.45 1.13 1.79 -1.37 -2.11 116.57 115.99 2bui h LYS 127 Ca 0.71 -0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 59.12 2bui h LYS 127 Cb 1.66 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 32.28 2bui h LYS 127 CO -0.51 0.04 0.09 0.00 -1.08 0.00 0.00 179.45 177.99 2bui h ALA 128 N 1.20 0.59 -0.38 3.86 0.00 -1.08 -3.10 119.26 120.35 2bui h ALA 128 Ca 0.11 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2bui h ALA 128 Cb 0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 2bui h ALA 128 CO -0.19 0.29 -0.11 0.28 0.00 0.00 0.00 179.25 179.53 2bui h VAL 129 N 0.60 0.59 0.00 0.00 2.07 -1.07 -3.49 116.25 114.95 2bui h VAL 129 Ca 0.14 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2bui h VAL 129 Cb 0.35 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2bui h VAL 129 CO 0.01 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.21 2bui n GLY 130 N -1.31 -1.69 0.98 2.17 0.00 -0.82 -4.51 105.19 100.01 2bui n GLY 130 Ca 0.02 -1.54 0.04 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.88 2.50 0.00 1.61 -0.04 -1.26 -4.19 135.00 131.73 2bui n PRO 131 Ca 0.00 -1.45 0.00 0.00 -0.04 0.00 0.00 63.50 62.01 2bui n PRO 131 Cb 0.00 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.82 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 0.41 0.00 -0.00 0.54 4.01 -1.26 -4.76 117.16 116.10 2bui n TYR 132 Ca 0.13 -0.28 -0.11 0.00 -0.16 0.00 0.00 57.90 57.48 2bui n TYR 132 Cb 0.56 -0.03 0.03 0.00 -0.31 0.00 0.00 39.34 39.59 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 0.04 1.32 0.13 -0.72 2.07 -1.79 -3.19 116.25 114.11 2bui h VAL 133 Ca 0.00 -1.84 0.01 0.00 0.82 0.00 0.00 66.70 65.69 2bui h VAL 133 Cb 0.30 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2bui h VAL 133 CO 0.00 0.57 -0.15 0.58 0.02 0.00 0.00 177.57 178.59 2bui h VAL 134 N 0.45 0.65 0.00 2.57 2.07 -1.91 0.27 116.25 120.35 2bui h VAL 134 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2bui h VAL 134 Cb 1.15 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2bui h VAL 134 CO 0.11 0.00 -0.10 0.71 0.02 0.00 0.00 177.57 178.31 2bui h THR 135 N -0.32 0.60 0.10 2.57 1.35 -1.83 0.17 112.91 115.55 2bui h THR 135 Ca 0.01 -0.45 -0.29 0.00 -0.55 0.00 0.00 66.41 65.13 2bui h THR 135 Cb 0.32 1.28 -0.01 0.00 -1.73 0.00 0.00 68.15 68.01 2bui h THR 135 CO -0.06 0.10 -1.47 0.11 -0.25 0.00 0.00 175.52 173.95 2bui h LYS 136 N 0.00 0.21 0.02 4.72 1.57 -1.37 -3.40 116.57 118.33 2bui h LYS 136 Ca -0.00 -0.36 -0.31 0.00 -1.87 0.00 0.00 60.65 58.10 2bui h LYS 136 Cb 0.28 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 2bui h LYS 136 CO 0.01 1.07 -1.83 0.00 -0.57 0.00 0.00 179.45 178.14 2bui n ALA 137 N -2.62 1.41 -1.67 3.86 0.00 0.89 -4.18 120.51 118.20 2bui n ALA 137 Ca -0.14 -0.80 -0.40 0.00 0.00 0.00 0.00 53.44 52.09 2bui n ALA 137 Cb 1.03 -0.75 0.02 0.00 0.00 0.00 0.00 19.45 19.75 2bui n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bui n MET 138 N -3.08 1.62 -0.23 0.00 0.00 0.56 -3.91 117.12 112.08 2bui n MET 138 Ca -0.21 0.58 0.13 0.00 0.00 0.00 0.00 57.70 58.20 2bui n MET 138 Cb 1.06 -2.28 0.42 0.00 0.00 0.00 0.00 33.22 32.42 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 1.67 1.93 -0.13 3.17 0.00 -1.92 -0.35 119.26 123.62 2bui h ALA 139 Ca -0.47 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2bui h ALA 139 Cb 1.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2bui h ALA 139 CO 0.58 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.55 2bui n SER 140 N -4.53 1.25 -0.17 0.00 3.41 -1.26 -4.41 113.62 107.92 2bui n SER 140 Ca 0.16 -2.08 -0.04 0.00 -0.26 0.00 0.00 58.87 56.65 2bui n SER 140 Cb 0.48 -0.28 0.02 0.00 -0.26 0.00 0.00 64.21 64.17 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 5.31 0.11 0.38 5.00 0.00 -1.27 -1.01 103.07 111.59 2bui h GLY 141 Ca 0.00 0.31 0.12 0.00 0.00 0.00 0.00 47.33 47.77 2bui h GLY 141 CO 0.04 -0.22 0.51 -2.08 0.00 0.00 0.00 176.54 174.79 2bui h VAL 142 N -0.12 0.84 0.20 4.60 2.07 -1.84 0.40 116.25 122.40 2bui h VAL 142 Ca 0.24 -0.27 -0.27 0.00 0.82 0.00 0.00 66.70 67.23 2bui h VAL 142 Cb 0.49 -0.01 0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2bui h VAL 142 CO -0.60 0.14 -1.17 0.77 0.02 0.00 0.00 177.57 176.73 2bui h SER 143 N 0.78 0.67 -0.57 0.57 4.64 -1.42 -3.26 113.55 114.95 2bui h SER 143 Ca 0.46 -0.94 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 2bui h SER 143 Cb 0.53 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 2bui h SER 143 CO -0.30 1.56 0.27 0.00 -0.87 0.00 0.00 176.83 177.50 2bui h ALA 144 N 0.11 0.73 0.00 5.18 0.00 -0.96 0.20 119.26 124.53 2bui h ALA 144 Ca -0.20 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2bui h ALA 144 Cb 1.92 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2bui h ALA 144 CO 0.22 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2bui n LEU 146 N -1.95 2.25 -0.16 0.00 4.32 -0.97 -4.38 117.00 116.12 2bui n LEU 146 Ca 0.03 0.05 0.07 0.00 -0.02 0.00 0.00 56.01 56.14 2bui n LEU 146 Cb 0.21 -0.61 0.38 0.00 -1.62 0.00 0.00 43.42 41.78 2bui n LEU 146 CO 0.18 0.63 1.21 0.00 -1.22 0.00 0.00 177.39 178.18 2bui h ALA 147 N -0.32 1.75 0.44 -1.18 0.00 -0.67 -1.71 119.26 117.58 2bui h ALA 147 Ca -0.45 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2bui h ALA 147 Cb 1.54 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2bui h ALA 147 CO -0.17 0.13 -0.21 1.15 0.00 0.00 0.00 179.25 180.15 2bui h THR 148 N 0.69 0.19 -0.40 0.00 2.02 -1.76 -1.05 112.91 112.59 2bui h THR 148 Ca 0.30 -0.59 -0.07 0.00 0.77 0.00 0.00 66.41 66.83 2bui h THR 148 Cb 0.30 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 2bui h THR 148 CO -0.10 0.04 -0.02 1.55 0.37 0.00 0.00 175.52 177.36 2bui h PRO 149 N -1.09 0.65 0.00 6.66 0.13 -1.75 -2.46 132.00 134.14 2bui h PRO 149 Ca -0.06 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2bui h PRO 149 Cb 0.52 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2bui h PRO 149 CO 0.10 0.69 0.00 1.19 -0.23 0.00 0.00 178.00 179.75 2bui n PHE 150 N -4.23 0.00 -3.84 1.56 3.01 -0.65 -4.90 117.46 108.41 2bui n PHE 150 Ca 0.02 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.20 2bui n PHE 150 Cb 0.29 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.79 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 -0.76 -5.67 -2.57 -1.08 4.76 -0.93 -4.60 118.16 107.32 2bui n LYS 151 Ca 0.11 0.63 -0.41 0.00 -2.87 0.00 0.00 58.31 55.77 2bui n LYS 151 Cb 0.05 -5.47 -0.05 0.00 -1.84 0.00 0.00 35.03 27.73 2bui n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2bui s ILE 152 N -3.38 3.83 -0.27 -0.18 1.09 -0.42 -1.02 121.20 120.85 2bui s ILE 152 Ca 0.52 1.71 0.06 0.00 -1.10 0.00 0.00 60.65 61.84 2bui s ILE 152 Cb -0.26 -4.09 -0.07 0.00 -1.06 0.00 0.00 42.46 36.98 2bui s ILE 152 CO 0.82 0.35 0.25 1.41 -0.10 0.00 0.00 174.94 177.67 2bui n HIS 153 N 1.82 0.00 -0.03 3.97 8.25 -1.24 -4.88 115.22 123.11 2bui n HIS 153 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2bui n HIS 153 Cb 0.46 -0.01 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 1.22 0.99 3.76 -1.41 0.00 0.66 -4.64 105.19 105.76 2bui n GLY 154 Ca 0.01 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 2bui n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bui s VAL 155 N 0.41 2.55 -0.28 1.61 -7.23 -1.26 -4.86 120.40 111.34 2bui s VAL 155 Ca 0.00 0.40 0.01 0.00 -1.81 0.00 0.00 61.98 60.57 2bui s VAL 155 Cb 0.00 -3.19 0.16 0.00 0.56 0.00 0.00 36.38 33.91 2bui s VAL 155 CO 0.00 -0.02 0.43 0.21 -0.31 0.00 0.00 175.10 175.41 2bui s ASN 156 N -1.24 -0.02 0.07 4.85 2.47 -1.25 -0.95 114.94 118.86 2bui s ASN 156 Ca 0.70 -0.01 -0.27 0.00 0.42 0.00 0.00 52.86 53.70 2bui s ASN 156 Cb -0.34 1.30 0.09 0.00 -1.45 0.00 0.00 41.25 40.85 2bui s ASN 156 CO 0.40 -0.32 1.15 -0.72 -3.72 0.00 0.00 177.10 173.88 2bui s TYR 157 N 2.60 -0.03 0.00 0.43 1.13 -1.17 -5.02 117.35 115.30 2bui s TYR 157 Ca 0.12 -0.19 0.07 0.00 -1.41 0.00 0.00 57.07 55.66 2bui s TYR 157 Cb -0.13 0.61 -0.02 0.00 -1.10 0.00 0.00 41.96 41.31 2bui s TYR 157 CO -0.24 -0.56 -0.23 -1.12 -2.51 0.00 0.00 175.55 170.89 2bui s SER 158 N -3.17 3.35 0.03 -0.18 0.01 -1.26 -3.07 113.70 109.41 2bui s SER 158 Ca 0.17 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 56.97 2bui s SER 158 Cb 0.01 -0.45 -0.04 0.00 0.21 0.00 0.00 66.02 65.75 2bui s SER 158 CO 0.00 0.30 0.19 -0.63 0.41 0.00 0.00 173.24 173.52 2bui s ILE 159 N -0.72 5.39 -0.10 1.44 -1.09 -1.26 -4.94 121.20 119.92 2bui s ILE 159 Ca 0.11 -0.29 -0.04 0.00 -2.23 0.00 0.00 60.65 58.20 2bui s ILE 159 Cb -0.10 -3.58 0.05 0.00 -1.58 0.00 0.00 42.46 37.25 2bui s ILE 159 CO 0.01 0.23 0.22 -0.55 -1.23 0.00 0.00 174.94 173.62 2bui s SER 160 N -2.24 0.14 -0.41 3.58 0.15 -1.26 -4.09 113.70 109.57 2bui s SER 160 Ca 0.31 0.49 0.09 0.00 0.70 0.00 0.00 55.95 57.54 2bui s SER 160 Cb -0.13 0.46 0.36 0.00 -1.71 0.00 0.00 66.02 65.00 2bui s SER 160 CO 0.24 -0.20 1.11 -1.54 1.20 0.00 0.00 173.24 174.05 2bui n SER 161 N 4.80 -1.24 0.00 5.45 3.41 -1.26 -4.92 113.62 119.86 2bui n SER 161 Ca -0.15 -3.08 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 2bui n SER 161 Cb 0.51 0.94 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 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 -0.01 0.00 0.52 7.33 0.00 -1.26 -0.66 120.51 126.43 2bui n ALA 162 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.56 2bui n ALA 162 Cb 0.76 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.47 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 -1.20 3.60 -0.14 0.00 0.00 0.16 -4.39 120.51 118.55 2bui n ALA 164 Ca 0.06 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2bui n ALA 164 Cb 0.07 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 -0.88 0.00 0.54 0.00 -1.04 -0.47 -1.09 114.28 111.33 2bui n THR 165 Ca 0.04 0.71 0.07 0.00 -2.04 0.00 0.00 64.05 62.83 2bui n THR 165 Cb 0.26 -0.97 0.32 0.00 -1.82 0.00 0.00 70.33 68.12 2bui n THR 165 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2bui n SER 166 N -2.05 0.00 0.10 8.00 3.41 -0.91 -2.25 113.62 119.92 2bui n SER 166 Ca 0.00 0.38 -0.23 0.00 -0.26 0.00 0.00 58.87 58.76 2bui n SER 166 Cb 0.00 -0.44 -0.15 0.00 -0.26 0.00 0.00 64.21 63.36 2bui n SER 166 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bui h ALA 167 N 2.54 0.03 -0.11 7.33 0.00 -1.38 -3.01 119.26 124.67 2bui h ALA 167 Ca 0.00 -1.02 -0.07 0.00 0.00 0.00 0.00 54.91 53.81 2bui h ALA 167 Cb 0.21 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2bui h ALA 167 CO 0.00 0.90 -0.27 0.45 0.00 0.00 0.00 179.25 180.33 2bui h HIS 168 N 0.12 0.21 -0.35 0.00 -0.00 -0.94 -1.83 115.15 112.37 2bui h HIS 168 Ca -0.30 -0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.02 2bui h HIS 168 Cb 2.12 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 29.46 2bui h HIS 168 CO 0.11 0.45 0.16 0.00 -0.00 0.00 0.00 177.93 178.65 2bui h ILE 170 N 0.42 1.20 -0.27 0.00 2.04 -1.32 -0.18 117.51 119.41 2bui h ILE 170 Ca 0.12 -0.61 -0.10 0.00 1.00 0.00 0.00 64.86 65.27 2bui h ILE 170 Cb 0.12 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2bui h ILE 170 CO -0.01 0.23 -0.27 1.23 0.00 0.00 0.00 178.15 179.32 2bui h GLY 171 N 0.58 0.58 2.00 5.37 0.00 -1.17 -0.60 103.07 109.84 2bui h GLY 171 Ca 0.15 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 2bui h GLY 171 CO -0.01 0.45 -0.51 -0.57 0.00 0.00 0.00 176.54 175.89 2bui h ASN 172 N 0.47 0.00 -0.35 0.19 -0.73 -0.49 -1.55 115.58 113.12 2bui h ASN 172 Ca 0.06 0.00 -0.13 0.00 1.87 0.00 0.00 56.30 58.11 2bui h ASN 172 Cb 0.71 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.30 2bui h ASN 172 CO 0.05 0.51 -0.27 0.00 -0.37 0.00 0.00 177.43 177.36 2bui h ALA 173 N 1.49 0.51 -0.71 1.57 0.00 -0.38 -2.30 119.26 119.44 2bui h ALA 173 Ca -0.01 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.54 2bui h ALA 173 Cb 0.93 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2bui h ALA 173 CO 0.07 0.52 0.43 0.28 0.00 0.00 0.00 179.25 180.55 2bui h VAL 174 N 0.60 1.06 -0.76 0.00 2.07 -0.65 -2.06 116.25 116.52 2bui h VAL 174 Ca 0.07 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.31 2bui h VAL 174 Cb 0.84 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 2bui h VAL 174 CO 0.07 0.15 0.50 -0.33 0.02 0.00 0.00 177.57 177.98 2bui h GLU 175 N 0.83 1.00 -0.87 1.57 5.08 -1.08 -0.51 114.58 120.60 2bui h GLU 175 Ca 0.29 -0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.68 2bui h GLU 175 Cb 0.07 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.03 2bui h GLU 175 CO -0.13 0.67 0.57 1.96 -1.00 0.00 0.00 179.01 181.07 2bui h GLN 176 N 1.03 0.86 -0.15 2.33 1.08 -0.81 0.29 115.11 119.75 2bui h GLN 176 Ca 0.28 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 57.28 2bui h GLN 176 Cb -0.11 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.13 2bui h GLN 176 CO -0.06 0.57 -0.49 0.82 -0.95 0.00 0.00 178.83 178.72 2bui h ILE 177 N 0.89 1.34 -0.69 2.54 2.04 -1.03 -0.96 117.51 121.64 2bui h ILE 177 Ca 0.40 -1.76 -0.03 0.00 1.00 0.00 0.00 64.86 64.47 2bui h ILE 177 Cb 0.37 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2bui h ILE 177 CO -0.16 0.54 0.32 1.56 0.00 0.00 0.00 178.15 180.41 2bui h GLN 178 N 0.24 0.98 0.00 2.37 4.20 -0.40 -0.36 115.11 122.14 2bui h GLN 178 Ca -0.02 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2bui h GLN 178 Cb 1.12 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.72 2bui h GLN 178 CO 0.10 0.76 0.00 -0.07 -0.67 0.00 0.00 178.83 178.95 2bui h LEU 179 N 0.97 0.00 0.00 1.46 3.38 -0.95 -3.36 115.31 116.82 2bui h LEU 179 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2bui h LEU 179 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2bui h LEU 179 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 2bui n GLY 180 N 0.25 0.41 0.08 0.83 0.00 -0.15 -4.95 105.19 101.66 2bui n GLY 180 Ca 0.02 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 0.02 -5.05 1.61 1.57 -1.42 -3.47 116.57 109.83 2bui h LYS 181 Ca 0.00 -0.03 -0.36 0.00 -1.87 0.00 0.00 60.65 58.39 2bui h LYS 181 Cb 0.04 0.01 -0.21 0.00 0.08 0.00 0.00 32.23 32.15 2bui h LYS 181 CO 0.00 0.74 -0.76 -0.65 -0.57 0.00 0.00 179.45 178.21 2bui s GLN 182 N -2.64 0.73 -0.14 3.15 -1.52 -1.15 -4.79 119.66 113.29 2bui s GLN 182 Ca -0.03 -0.92 0.19 0.00 -1.95 0.00 0.00 55.36 52.64 2bui s GLN 182 Cb 0.09 -0.62 -0.27 0.00 -0.22 0.00 0.00 33.01 31.99 2bui s GLN 182 CO 0.82 0.13 0.19 -0.25 -0.25 0.00 0.00 175.29 175.93 2bui n ASP 183 N 1.23 0.16 -3.78 5.90 8.00 -0.40 -4.25 116.55 123.41 2bui n ASP 183 Ca -0.21 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.16 2bui n ASP 183 Cb 0.55 1.28 -0.14 0.00 -0.02 0.00 0.00 41.12 42.78 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 -2.77 -0.03 -0.09 0.53 1.01 -1.11 -0.67 121.20 118.07 2bui s ILE 184 Ca -0.09 0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 2bui s ILE 184 Cb 0.08 -0.19 0.04 0.00 0.01 0.00 0.00 42.46 42.40 2bui s ILE 184 CO 0.83 0.05 0.11 -0.69 0.00 0.00 0.00 174.94 175.23 2bui s VAL 185 N 0.73 -0.17 -0.29 2.92 1.01 0.20 0.15 120.40 124.95 2bui s VAL 185 Ca -0.06 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 2bui s VAL 185 Cb -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 36.38 36.01 2bui s VAL 185 CO -0.03 0.06 1.19 -0.36 0.00 0.00 0.00 175.10 175.96 2bui s PHE 186 N 2.21 2.92 0.03 5.22 0.40 -0.12 -1.90 117.98 126.74 2bui s PHE 186 Ca 0.04 1.04 0.06 0.00 -0.60 0.00 0.00 56.93 57.48 2bui s PHE 186 Cb -0.13 -3.75 -0.03 0.00 0.51 0.00 0.00 43.02 39.62 2bui s PHE 186 CO -0.06 -1.28 -0.17 0.00 0.70 0.00 0.00 175.22 174.42 2bui s ALA 187 N 3.92 2.64 0.00 5.36 0.00 -0.50 -1.29 121.76 131.89 2bui s ALA 187 Ca 0.51 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.31 2bui s ALA 187 Cb -0.15 -0.79 0.00 0.00 0.00 0.00 0.00 23.12 22.18 2bui s ALA 187 CO 0.18 0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.93 2bui n GLY 188 N 1.60 -0.52 0.00 0.00 0.00 -1.01 -0.03 105.19 105.24 2bui n GLY 188 Ca -0.16 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.76 3.64 -0.02 0.00 -0.46 -2.61 105.19 103.99 2bui n GLY 189 Ca 0.00 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 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 0.00 0.30 -0.26 -0.02 0.00 -0.81 -1.37 107.32 105.16 2bui s GLY 190 Ca 0.00 -0.66 -0.21 0.00 0.00 0.00 0.00 44.72 43.85 2bui s GLY 190 CO 0.00 -0.45 0.68 1.85 0.00 0.00 0.00 173.10 175.18 2bui s GLU 191 N -3.97 0.76 0.57 2.90 2.56 0.08 -4.14 118.70 117.46 2bui s GLU 191 Ca 0.18 1.04 -0.07 0.00 0.00 0.00 0.00 54.97 56.12 2bui s GLU 191 Cb -0.02 0.30 -0.01 0.00 2.00 0.00 0.00 34.13 36.40 2bui s GLU 191 CO 0.07 -0.11 0.89 -1.83 -0.56 0.00 0.00 175.26 173.72 2bui s GLU 192 N 0.79 3.17 -0.20 4.30 -1.05 -1.26 -1.25 118.70 123.20 2bui s GLU 192 Ca -0.03 0.17 0.00 0.00 -0.15 0.00 0.00 54.97 54.96 2bui s GLU 192 Cb -0.05 -2.27 0.02 0.00 -0.44 0.00 0.00 34.13 31.39 2bui s GLU 192 CO -0.06 -0.56 -0.16 -1.17 0.95 0.00 0.00 175.26 174.26 2bui s LEU 193 N -4.96 2.41 -0.03 1.83 2.96 -1.26 -4.66 118.68 114.96 2bui s LEU 193 Ca 0.52 -0.69 -0.29 0.00 -0.22 0.00 0.00 54.13 53.45 2bui s LEU 193 Cb -0.11 -1.53 0.09 0.00 0.50 0.00 0.00 46.19 45.14 2bui s LEU 193 CO 0.46 -0.03 0.76 0.00 -1.32 0.00 0.00 176.35 176.23 2bui h TRP 195 N 2.63 0.28 -0.72 0.00 5.08 -1.97 -0.71 115.95 120.55 2bui h TRP 195 Ca -0.26 -0.04 0.16 0.00 1.08 0.00 0.00 58.89 59.83 2bui h TRP 195 Cb 1.18 -0.08 -0.11 0.00 -3.00 0.00 0.00 29.16 27.16 2bui h TRP 195 CO 0.32 0.44 0.13 0.93 -1.28 0.00 0.00 178.44 178.98 2bui h GLU 196 N 0.25 0.22 0.11 0.12 3.07 -1.95 0.45 114.58 116.85 2bui h GLU 196 Ca 0.05 -0.01 -0.34 0.00 -0.50 0.00 0.00 59.36 58.55 2bui h GLU 196 Cb 0.47 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 2bui h GLU 196 CO 0.03 0.15 -1.83 1.98 -1.40 0.00 0.00 179.01 177.93 2bui h MET 197 N 0.23 0.24 -0.74 2.33 1.85 -1.89 -3.39 114.93 113.56 2bui h MET 197 Ca 0.40 -0.40 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 2bui h MET 197 Cb 0.68 0.15 -0.04 0.00 0.43 0.00 0.00 31.60 32.82 2bui h MET 197 CO -0.53 1.09 0.44 0.00 -0.40 0.00 0.00 176.91 177.51 2bui h ALA 198 N 0.31 1.38 -0.12 0.39 0.00 -0.71 -2.43 119.26 118.08 2bui h ALA 198 Ca -0.36 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 2bui h ALA 198 Cb 2.04 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 2bui h ALA 198 CO 0.11 0.53 -0.09 0.00 0.00 0.00 0.00 179.25 179.81 2bui h GLU 200 N 0.18 0.51 0.09 0.00 5.08 -1.62 0.36 114.58 119.18 2bui h GLU 200 Ca 0.04 -0.14 -0.27 0.00 -1.00 0.00 0.00 59.36 57.99 2bui h GLU 200 Cb 0.28 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.48 2bui h GLU 200 CO 0.01 0.61 -1.16 0.74 -1.00 0.00 0.00 179.01 178.21 2bui h PHE 201 N 0.47 0.74 -0.23 4.33 0.04 -1.40 -3.12 116.94 117.78 2bui h PHE 201 Ca 0.09 -0.47 -0.10 0.00 2.80 0.00 0.00 57.97 60.29 2bui h PHE 201 Cb 0.46 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2bui h PHE 201 CO 0.02 1.32 -0.30 0.22 -0.60 0.00 0.00 178.31 178.96 2bui h ASP 202 N 0.20 0.47 0.14 2.17 1.82 -1.02 -1.21 116.42 118.97 2bui h ASP 202 Ca -0.14 -0.17 -0.00 0.00 -0.39 0.00 0.00 57.03 56.32 2bui h ASP 202 Cb 1.84 -0.13 -0.00 0.00 0.68 0.00 0.00 39.33 41.72 2bui h ASP 202 CO 0.21 0.75 -0.02 0.00 -1.61 0.00 0.00 179.24 178.57 2bui h ALA 203 N 1.28 1.21 -0.46 -0.78 0.00 -0.22 -0.69 119.26 119.59 2bui h ALA 203 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2bui h ALA 203 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2bui h ALA 203 CO 0.06 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.33 2bui n MET 204 N -3.41 2.85 -1.68 0.00 0.00 -0.89 -4.97 117.12 109.03 2bui n MET 204 Ca -0.03 -2.25 -0.11 0.00 0.00 0.00 0.00 57.70 55.31 2bui n MET 204 Cb 0.12 -1.37 -0.03 0.00 0.00 0.00 0.00 33.22 31.94 2bui n MET 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2bui n GLY 205 N 0.84 0.69 0.17 3.17 0.00 -0.27 -4.93 105.19 104.85 2bui n GLY 205 Ca 0.16 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.77 2bui n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bui h ALA 206 N 0.21 0.80 -2.48 4.61 0.00 -1.46 -3.47 119.26 117.48 2bui h ALA 206 Ca -0.23 -0.19 -0.53 0.00 0.00 0.00 0.00 54.91 53.96 2bui h ALA 206 Cb 0.90 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2bui h ALA 206 CO 0.31 0.24 -0.30 -0.51 0.00 0.00 0.00 179.25 178.99 2bui s LEU 207 N -6.11 4.19 0.30 0.00 1.43 -1.26 -1.39 118.68 115.85 2bui s LEU 207 Ca 0.04 0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 53.29 2bui s LEU 207 Cb 0.07 -3.22 -0.10 0.00 0.03 0.00 0.00 46.19 42.97 2bui s LEU 207 CO 0.72 -0.08 1.31 -0.55 0.23 0.00 0.00 176.35 177.98 2bui s SER 208 N -3.25 6.80 0.00 2.29 0.15 -0.56 -4.55 113.70 114.59 2bui s SER 208 Ca 0.39 2.63 0.00 0.00 0.70 0.00 0.00 55.95 59.67 2bui s SER 208 Cb -0.11 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2bui s SER 208 CO 0.30 -0.53 0.00 0.35 1.20 0.00 0.00 173.24 174.55 2bui n THR 209 N 1.24 0.00 1.35 6.45 -2.24 -1.26 -4.29 114.28 115.53 2bui n THR 209 Ca 0.02 -0.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.86 2bui n THR 209 Cb 0.42 0.99 0.40 0.00 -2.10 0.00 0.00 70.33 70.04 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 -0.14 1.67 -0.70 -0.78 5.02 -1.26 -4.34 118.16 117.63 2bui n LYS 210 Ca 0.00 -1.09 0.06 0.00 -2.02 0.00 0.00 58.31 55.26 2bui n LYS 210 Cb 0.00 -1.48 0.15 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 0.29 0.00 -0.36 2.13 4.02 -1.26 -4.82 117.16 117.16 2bui n TYR 211 Ca 0.17 -1.18 0.04 0.00 -0.01 0.00 0.00 57.90 56.92 2bui n TYR 211 Cb 0.41 -0.21 0.19 0.00 -0.02 0.00 0.00 39.34 39.71 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 0.83 0.96 0.03 7.72 2.35 -1.94 -0.18 115.58 125.35 2bui h ASN 212 Ca -0.05 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2bui h ASN 212 Cb 1.19 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 2bui h ASN 212 CO 0.02 0.57 -0.02 0.44 -1.65 0.00 0.00 177.43 176.79 2bui h ASP 213 N 1.07 0.00 -2.32 5.81 3.45 -1.95 -3.18 116.42 119.29 2bui h ASP 213 Ca 0.45 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 57.32 2bui h ASP 213 Cb 0.30 0.00 -0.40 0.00 -0.56 0.00 0.00 39.33 38.66 2bui h ASP 213 CO -0.21 0.02 -0.82 0.35 -1.57 0.00 0.00 179.24 177.00 2bui n THR 214 N -4.05 0.61 -0.33 0.35 -2.24 -0.10 -4.99 114.28 103.53 2bui n THR 214 Ca -0.03 -4.45 0.22 0.00 -2.27 0.00 0.00 64.05 57.52 2bui n THR 214 Cb 0.10 -1.99 0.44 0.00 -2.10 0.00 0.00 70.33 66.78 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 4.60 0.34 0.00 -0.78 0.11 -1.50 -1.69 132.00 133.08 2bui h PRO 215 Ca 0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2bui h PRO 215 Cb 0.79 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.83 2bui h PRO 215 CO 0.61 0.22 0.00 0.39 -0.21 0.00 0.00 178.00 179.01 2bui n GLU 216 N -5.05 0.49 -0.00 1.05 1.02 -1.26 -2.59 120.64 114.30 2bui n GLU 216 Ca 0.30 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2bui n GLU 216 Cb 0.91 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 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 -1.09 0.02 0.15 3.49 5.02 -0.64 -4.74 118.16 120.38 2bui n LYS 217 Ca 0.13 -0.77 -0.14 0.00 -2.02 0.00 0.00 58.31 55.51 2bui n LYS 217 Cb 0.09 -1.01 -0.08 0.00 -0.02 0.00 0.00 35.03 34.01 2bui n LYS 217 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bui h ALA 218 N 0.09 -0.35 -1.76 7.82 0.00 -1.52 -3.39 119.26 120.15 2bui h ALA 218 Ca 0.00 -0.14 -0.56 0.00 0.00 0.00 0.00 54.91 54.21 2bui h ALA 218 Cb 0.14 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 2bui h ALA 218 CO 0.00 -0.61 0.94 0.45 0.00 0.00 0.00 179.25 180.03 2bui s SER 219 N -5.02 6.61 -0.41 0.00 0.15 -1.26 -4.73 113.70 109.04 2bui s SER 219 Ca -0.15 0.58 0.08 0.00 0.70 0.00 0.00 55.95 57.17 2bui s SER 219 Cb 0.04 -2.55 0.27 0.00 -1.71 0.00 0.00 66.02 62.07 2bui s SER 219 CO 0.61 -1.25 0.64 -2.11 1.20 0.00 0.00 173.24 172.34 2bui n ARG 220 N 7.79 0.78 -1.65 5.44 1.85 -1.26 -4.57 116.66 125.04 2bui n ARG 220 Ca 0.13 -2.95 -0.52 0.00 -1.00 0.00 0.00 57.85 53.50 2bui n ARG 220 Cb 0.49 -1.33 -0.06 0.00 -1.05 0.00 0.00 32.46 30.51 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 1.21 0.16 0.00 8.89 -1.04 -1.26 -1.31 114.28 120.93 2bui n THR 221 Ca 0.19 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 2bui n THR 221 Cb 0.58 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 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 3.96 0.00 -2.16 -1.42 4.01 -1.26 -4.83 117.16 115.46 2bui n TYR 222 Ca 0.21 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.57 2bui n TYR 222 Cb 0.20 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 -2.93 6.10 0.63 7.72 2.15 -0.42 -0.80 116.67 129.12 2bui s ASP 223 Ca 0.00 2.43 0.40 0.00 0.43 0.00 0.00 52.55 55.81 2bui s ASP 223 Cb 0.00 -2.61 2.12 0.00 -0.30 0.00 0.00 42.92 42.13 2bui s ASP 223 CO 0.00 -0.98 2.28 0.00 -0.17 0.00 0.00 175.17 176.30 2bui h ALA 224 N 2.12 1.09 -0.41 3.66 0.00 -1.19 -2.88 119.26 121.65 2bui h ALA 224 Ca -0.50 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.18 2bui h ALA 224 Cb 1.25 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.90 2bui h ALA 224 CO 0.60 0.01 -0.08 0.72 0.00 0.00 0.00 179.25 180.50 2bui n HIS 225 N -3.23 1.30 -2.32 0.00 8.25 -1.26 -5.02 115.22 112.95 2bui n HIS 225 Ca -0.02 -1.71 -0.37 0.00 -0.26 0.00 0.00 57.72 55.35 2bui n HIS 225 Cb 0.12 -0.53 -0.02 0.00 1.12 0.00 0.00 29.99 30.68 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 -3.30 3.92 -0.16 -0.41 1.70 -1.09 -4.97 118.95 114.64 2bui s ARG 226 Ca 0.46 1.75 0.23 0.00 -0.47 0.00 0.00 55.73 57.70 2bui s ARG 226 Cb 0.41 -2.51 0.47 0.00 -0.57 0.00 0.00 34.95 32.76 2bui s ARG 226 CO -0.00 -0.41 1.14 -0.40 -1.08 0.00 0.00 175.30 174.55 2bui n ASP 227 N -0.25 1.52 0.00 -2.89 5.75 -1.26 -4.62 116.55 114.80 2bui n ASP 227 Ca 0.06 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.67 2bui n ASP 227 Cb 0.48 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 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 -0.19 3.36 3.90 6.12 0.00 -0.98 -3.64 105.19 113.75 2bui n GLY 228 Ca 0.09 -1.93 -0.28 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.86 3.31 -0.31 1.61 -0.12 -0.49 -3.55 117.98 115.57 2bui s PHE 229 Ca 0.00 0.86 -0.08 0.00 -0.05 0.00 0.00 56.93 57.66 2bui s PHE 229 Cb 0.00 -2.87 0.01 0.00 -0.63 0.00 0.00 43.02 39.53 2bui s PHE 229 CO 0.00 -0.96 0.11 0.08 -0.05 0.00 0.00 175.22 174.40 2bui s VAL 230 N -3.16 4.13 0.47 -2.49 1.01 -1.26 -1.49 120.40 117.61 2bui s VAL 230 Ca 0.56 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.57 2bui s VAL 230 Cb -0.11 -3.17 -0.07 0.00 0.00 0.00 0.00 36.38 33.03 2bui s VAL 230 CO 0.48 0.01 1.37 -0.51 0.00 0.00 0.00 175.10 176.45 2bui s ILE 231 N 1.51 2.21 0.17 2.22 2.07 -1.26 0.11 121.20 128.24 2bui s ILE 231 Ca 0.02 0.18 -0.06 0.00 -1.41 0.00 0.00 60.65 59.38 2bui s ILE 231 Cb -0.18 -3.10 -0.02 0.00 0.13 0.00 0.00 42.46 39.29 2bui s ILE 231 CO 0.04 0.02 0.22 0.00 -1.91 0.00 0.00 174.94 173.30 2bui s ALA 232 N -1.26 0.36 0.31 1.50 0.00 0.96 -0.19 121.76 123.45 2bui s ALA 232 Ca 0.64 -1.15 0.03 0.00 0.00 0.00 0.00 51.96 51.48 2bui s ALA 232 Cb -0.41 0.94 -0.05 0.00 0.00 0.00 0.00 23.12 23.60 2bui s ALA 232 CO 0.51 -0.61 0.09 0.20 0.00 0.00 0.00 175.76 175.95 2bui s GLY 233 N -3.02 2.02 0.00 0.00 0.00 -0.42 -4.06 107.32 101.85 2bui s GLY 233 Ca 0.22 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.07 2bui s GLY 233 CO 0.03 -1.73 0.00 0.61 0.00 0.00 0.00 173.10 172.01 2bui n GLY 234 N -0.63 0.66 3.54 0.20 0.00 -0.38 -4.40 105.19 104.18 2bui n GLY 234 Ca -0.02 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.07 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 0.89 -0.03 -0.02 0.00 0.13 -0.74 107.32 107.53 2bui s GLY 235 Ca 0.00 -1.13 -0.29 0.00 0.00 0.00 0.00 44.72 43.30 2bui s GLY 235 CO 0.00 -0.78 0.87 -0.32 0.00 0.00 0.00 173.10 172.87 2bui s GLY 236 N -3.10 -0.44 -0.21 0.20 0.00 -0.47 -1.78 107.32 101.52 2bui s GLY 236 Ca 0.26 1.24 -0.27 0.00 0.00 0.00 0.00 44.72 45.96 2bui s GLY 236 CO 0.13 0.54 0.71 -0.29 0.00 0.00 0.00 173.10 174.20 2bui s MET 237 N -2.51 0.89 0.13 2.90 1.75 -0.82 -1.35 119.30 120.30 2bui s MET 237 Ca 0.02 0.79 0.04 0.00 -1.25 0.00 0.00 55.69 55.28 2bui s MET 237 Cb -0.01 0.43 -0.04 0.00 2.84 0.00 0.00 34.83 38.05 2bui s MET 237 CO -0.05 -0.16 -0.10 0.14 -0.65 0.00 0.00 175.02 174.20 2bui s VAL 238 N -0.06 1.10 -0.50 10.11 -7.23 0.96 -1.34 120.40 123.43 2bui s VAL 238 Ca -0.03 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.03 2bui s VAL 238 Cb -0.04 -1.75 0.12 0.00 0.56 0.00 0.00 36.38 35.27 2bui s VAL 238 CO 0.03 -0.72 0.42 -0.69 -0.31 0.00 0.00 175.10 173.84 2bui s VAL 239 N -3.18 4.83 -0.18 1.32 1.01 -0.03 -1.41 120.40 122.77 2bui s VAL 239 Ca 0.14 -1.54 -0.25 0.00 0.00 0.00 0.00 61.98 60.34 2bui s VAL 239 Cb 0.02 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2bui s VAL 239 CO 0.00 -0.79 0.80 -0.69 0.00 0.00 0.00 175.10 174.43 2bui s VAL 240 N 1.52 4.90 0.02 2.92 1.01 -0.80 -1.48 120.40 128.49 2bui s VAL 240 Ca 0.04 1.56 0.01 0.00 0.00 0.00 0.00 61.98 63.59 2bui s VAL 240 Cb -0.28 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 2bui s VAL 240 CO 0.02 0.04 -0.04 -0.70 0.00 0.00 0.00 175.10 174.41 2bui s GLU 241 N 2.14 0.34 0.19 2.72 2.12 0.03 -0.63 118.70 125.61 2bui s GLU 241 Ca 0.37 -0.51 -0.31 0.00 0.36 0.00 0.00 54.97 54.88 2bui s GLU 241 Cb -0.16 -0.10 -0.09 0.00 0.26 0.00 0.00 34.13 34.04 2bui s GLU 241 CO 0.12 0.01 1.43 -2.00 -0.54 0.00 0.00 175.26 174.28 2bui s GLU 242 N -1.11 4.29 0.14 4.30 -6.30 0.16 -1.01 118.70 119.17 2bui s GLU 242 Ca -0.09 2.21 -0.32 0.00 -2.50 0.00 0.00 54.97 54.27 2bui s GLU 242 Cb -0.07 -3.17 -0.10 0.00 0.00 0.00 0.00 34.13 30.79 2bui s GLU 242 CO -0.00 -0.43 1.54 1.25 0.02 0.00 0.00 175.26 177.63 2bui h LEU 243 N 5.90 -1.94 -0.61 2.70 5.85 -1.57 -1.09 115.31 124.56 2bui h LEU 243 Ca -0.44 0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.62 2bui h LEU 243 Cb 1.21 0.82 -0.06 0.00 0.37 0.00 0.00 40.66 43.00 2bui h LEU 243 CO 0.83 -0.34 0.29 -0.33 -0.34 0.00 0.00 178.44 178.54 2bui h GLU 244 N -0.27 0.51 -0.85 1.25 4.39 -1.92 -1.06 114.58 116.63 2bui h GLU 244 Ca 0.10 -0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.78 2bui h GLU 244 Cb 0.53 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.02 2bui h GLU 244 CO -0.70 0.33 0.56 1.25 -1.16 0.00 0.00 179.01 179.30 2bui h HIS 245 N 0.52 1.07 -0.39 4.33 2.76 -1.84 0.24 115.15 121.84 2bui h HIS 245 Ca 0.29 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.38 2bui h HIS 245 Cb 0.28 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 2bui h HIS 245 CO -0.12 0.67 -0.20 0.00 -1.30 0.00 0.00 177.93 176.98 2bui h ALA 246 N 1.32 0.93 -0.08 5.26 0.00 -0.46 -2.92 119.26 123.31 2bui h ALA 246 Ca 0.32 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2bui h ALA 246 Cb -0.12 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2bui h ALA 246 CO -0.07 0.62 -0.31 -0.07 0.00 0.00 0.00 179.25 179.41 2bui h LEU 247 N 0.66 0.41 -2.03 0.00 3.38 -0.73 -1.47 115.31 115.53 2bui h LEU 247 Ca 0.10 -0.64 0.12 0.00 0.09 0.00 0.00 57.88 57.55 2bui h LEU 247 Cb 0.69 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2bui h LEU 247 CO 0.05 0.97 0.40 0.00 0.09 0.00 0.00 178.44 179.95 2bui h ALA 248 N 0.44 2.14 -0.42 1.53 0.00 -0.49 -0.52 119.26 121.95 2bui h ALA 248 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2bui h ALA 248 Cb 0.95 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2bui h ALA 248 CO 0.07 -0.60 0.00 2.89 0.00 0.00 0.00 179.25 181.60 2bui n ARG 249 N -3.85 3.33 -3.37 0.00 1.85 -1.11 -4.97 116.66 108.54 2bui n ARG 249 Ca 0.07 -2.69 -0.24 0.00 -1.00 0.00 0.00 57.85 53.99 2bui n ARG 249 Cb 0.58 -1.75 0.05 0.00 -1.05 0.00 0.00 32.46 30.28 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 0.32 -0.53 3.81 2.89 0.00 -0.20 -4.97 105.19 106.52 2bui n GLY 250 Ca 0.21 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 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 -3.22 2.97 -0.32 4.61 0.00 -0.56 -5.00 121.76 120.23 2bui s ALA 251 Ca 0.46 0.45 -0.27 0.00 0.00 0.00 0.00 51.96 52.60 2bui s ALA 251 Cb -0.21 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.73 2bui s ALA 251 CO 0.57 -0.11 0.97 -1.58 0.00 0.00 0.00 175.76 175.61 2bui s HIS 252 N -2.16 3.15 -0.35 0.00 5.65 -1.26 -4.85 115.29 115.47 2bui s HIS 252 Ca 0.64 1.02 -0.15 0.00 0.25 0.00 0.00 55.06 56.82 2bui s HIS 252 Cb -0.12 -3.55 -0.01 0.00 -1.18 0.00 0.00 32.58 27.72 2bui s HIS 252 CO 0.18 -0.72 0.34 0.42 -0.65 0.00 0.00 174.74 174.31 2bui s ILE 253 N 3.43 5.19 0.00 0.89 1.01 -1.26 -4.37 121.20 126.09 2bui s ILE 253 Ca 0.41 -0.09 -0.24 0.00 0.00 0.00 0.00 60.65 60.72 2bui s ILE 253 Cb -0.13 -3.83 -0.15 0.00 0.01 0.00 0.00 42.46 38.36 2bui s ILE 253 CO 0.15 -0.12 1.13 1.88 0.00 0.00 0.00 174.94 177.98 2bui h TYR 254 N 8.51 -0.51 -2.60 3.97 0.05 -1.25 -3.47 116.97 121.66 2bui h TYR 254 Ca -0.30 -0.01 0.12 0.00 0.05 0.00 0.00 58.73 58.60 2bui h TYR 254 Cb 1.14 0.17 -0.05 0.00 1.01 0.00 0.00 36.73 39.00 2bui h TYR 254 CO 0.67 -0.18 0.44 0.00 -1.05 0.00 0.00 178.16 178.03 2bui s ALA 255 N -4.71 -1.41 -0.09 3.88 0.00 -1.24 -4.74 121.76 113.44 2bui s ALA 255 Ca -0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.60 2bui s ALA 255 Cb 0.02 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.82 2bui s ALA 255 CO 0.48 -1.04 -0.04 -2.00 0.00 0.00 0.00 175.76 173.16 2bui s GLU 256 N -2.91 3.01 -0.81 0.00 2.12 0.68 -0.46 118.70 120.34 2bui s GLU 256 Ca 0.15 -0.50 -0.23 0.00 0.36 0.00 0.00 54.97 54.75 2bui s GLU 256 Cb -0.03 -2.72 0.07 0.00 0.26 0.00 0.00 34.13 31.71 2bui s GLU 256 CO 0.05 0.58 1.19 0.42 -0.54 0.00 0.00 175.26 176.96 2bui s ILE 257 N -0.57 4.14 -1.02 -3.70 1.01 0.18 -1.09 121.20 120.14 2bui s ILE 257 Ca 0.09 -0.44 0.25 0.00 0.00 0.00 0.00 60.65 60.56 2bui s ILE 257 Cb -0.12 -4.85 0.04 0.00 0.01 0.00 0.00 42.46 37.54 2bui s ILE 257 CO 0.02 -1.68 1.47 1.33 0.00 0.00 0.00 174.94 176.08 2bui n VAL 258 N 6.18 0.00 -3.72 2.92 0.24 -0.66 -4.58 118.33 118.71 2bui n VAL 258 Ca 0.11 -0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.27 2bui n VAL 258 Cb 0.48 0.18 -0.10 0.00 -1.47 0.00 0.00 33.84 32.94 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 -2.98 -0.32 -0.22 7.63 0.00 -1.06 -4.83 107.32 105.54 2bui s GLY 259 Ca 0.12 1.15 -0.03 0.00 0.00 0.00 0.00 44.72 45.95 2bui s GLY 259 CO 0.68 0.98 0.27 -0.47 0.00 0.00 0.00 173.10 174.55 2bui s TYR 260 N 0.08 -0.44 -0.03 1.90 5.04 -1.26 -1.13 117.35 121.50 2bui s TYR 260 Ca -0.01 0.37 -0.01 0.00 -2.44 0.00 0.00 57.07 54.97 2bui s TYR 260 Cb -0.03 -0.26 -0.04 0.00 0.35 0.00 0.00 41.96 41.98 2bui s TYR 260 CO 0.01 -0.66 0.07 0.20 -1.34 0.00 0.00 175.55 173.83 2bui s GLY 261 N 2.39 1.99 -0.24 8.97 0.00 0.61 -4.54 107.32 116.50 2bui s GLY 261 Ca 0.09 -0.84 -0.02 0.00 0.00 0.00 0.00 44.72 43.95 2bui s GLY 261 CO -0.14 -0.67 0.28 0.00 0.00 0.00 0.00 173.10 172.56 2bui s ALA 262 N -1.11 -0.50 0.36 3.20 0.00 -1.26 -1.40 121.76 121.06 2bui s ALA 262 Ca 0.20 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.37 2bui s ALA 262 Cb -0.12 -1.56 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 2bui s ALA 262 CO 0.10 -1.40 0.14 0.95 0.00 0.00 0.00 175.76 175.55 2bui s THR 263 N 2.38 0.54 0.02 0.00 -4.23 -0.73 -5.00 115.64 108.62 2bui s THR 263 Ca 0.09 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.63 2bui s THR 263 Cb -0.15 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.21 2bui s THR 263 CO -0.20 0.00 -0.11 -0.55 -0.54 0.00 0.00 174.62 173.22 2bui s SER 264 N -3.50 1.29 -0.00 3.99 0.15 -1.26 -1.09 113.70 113.29 2bui s SER 264 Ca 0.30 -0.32 -0.19 0.00 0.70 0.00 0.00 55.95 56.44 2bui s SER 264 Cb 0.04 -0.10 -0.28 0.00 -1.71 0.00 0.00 66.02 63.97 2bui s SER 264 CO 0.16 0.05 1.02 0.44 1.20 0.00 0.00 173.24 176.11 2bui h ASP 265 N 5.39 0.59 -4.36 5.45 3.32 -0.91 -3.44 116.42 122.46 2bui h ASP 265 Ca -0.34 -0.85 -0.33 0.00 0.02 0.00 0.00 57.03 55.53 2bui h ASP 265 Cb 1.18 -0.19 0.08 0.00 0.22 0.00 0.00 39.33 40.63 2bui h ASP 265 CO 0.46 1.39 -0.52 0.61 -1.72 0.00 0.00 179.24 179.46 2bui n GLY 266 N 1.39 -0.28 0.00 2.75 0.00 -1.26 -4.89 105.19 102.90 2bui n GLY 266 Ca -0.13 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.93 1.84 -2.62 4.61 0.00 -1.26 -5.14 120.51 114.01 2bui n ALA 267 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.10 2bui n ALA 267 Cb 0.57 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.93 2bui n ALA 267 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bui s ASP 268 N 1.00 4.65 0.15 0.00 -0.00 -1.26 -5.06 116.67 116.16 2bui s ASP 268 Ca 0.00 -0.29 -0.05 0.00 -0.00 0.00 0.00 52.55 52.21 2bui s ASP 268 Cb 0.00 -0.99 -0.01 0.00 -0.00 0.00 0.00 42.92 41.92 2bui s ASP 268 CO 0.00 0.19 1.40 0.24 -0.00 0.00 0.00 175.17 177.00 2bui h MET 269 N 3.63 0.55 0.00 8.23 2.86 -1.98 -3.32 114.93 124.89 2bui h MET 269 Ca -0.48 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 56.72 2bui h MET 269 Cb 1.17 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.91 2bui h MET 269 CO 0.55 1.06 0.00 1.33 1.06 0.00 0.00 176.91 180.91 2bui n VAL 270 N -3.88 0.00 -5.21 -2.22 0.24 -1.26 0.36 118.33 106.36 2bui n VAL 270 Ca -0.05 -0.40 -0.32 0.00 -2.04 0.00 0.00 64.34 61.53 2bui n VAL 270 Cb 0.71 1.12 -0.16 0.00 -1.47 0.00 0.00 33.84 34.04 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 -0.31 2.24 0.35 2.33 0.00 -1.26 -4.93 121.76 120.18 2bui s ALA 271 Ca 0.00 -1.05 -0.25 0.00 0.00 0.00 0.00 51.96 50.66 2bui s ALA 271 Cb 0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 23.12 22.32 2bui s ALA 271 CO 0.00 0.44 1.01 -1.25 0.00 0.00 0.00 175.76 175.96 2bui s PRO 272 N -0.27 4.41 0.17 0.00 0.04 -1.26 -4.26 135.00 133.83 2bui s PRO 272 Ca -0.00 1.46 0.14 0.00 0.04 0.00 0.00 61.00 62.64 2bui s PRO 272 Cb -0.13 -2.73 -0.05 0.00 0.04 0.00 0.00 34.50 31.63 2bui s PRO 272 CO 0.03 0.09 1.19 0.66 0.04 0.00 0.00 177.00 179.00 2bui h SER 273 N 2.94 0.00 0.00 6.66 4.64 -1.95 -3.48 113.55 122.36 2bui h SER 273 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2bui h SER 273 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2bui h SER 273 CO 0.64 0.61 0.00 0.61 -0.87 0.00 0.00 176.83 177.82 2bui n GLY 274 N 1.31 2.77 0.30 -0.77 0.00 -1.26 -4.79 105.19 102.74 2bui n GLY 274 Ca -0.03 -0.68 0.02 0.00 0.00 0.00 0.00 46.02 45.33 2bui n GLY 274 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bui h GLU 275 N 0.00 0.77 -0.65 1.61 4.81 -1.93 -1.22 114.58 117.96 2bui h GLU 275 Ca 0.00 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 2bui h GLU 275 Cb 0.00 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 2bui h GLU 275 CO 0.00 0.51 0.26 0.78 -0.73 0.00 0.00 179.01 179.82 2bui h GLY 276 N 0.79 1.03 1.03 1.92 0.00 -1.87 -0.40 103.07 105.57 2bui h GLY 276 Ca 0.38 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 2bui h GLY 276 CO -0.23 0.51 0.20 0.00 0.00 0.00 0.00 176.54 177.02 2bui h ALA 277 N 1.34 0.86 0.23 3.60 0.00 -1.69 0.83 119.26 124.43 2bui h ALA 277 Ca 0.22 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2bui h ALA 277 Cb 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2bui h ALA 277 CO -0.02 0.53 -0.11 0.28 0.00 0.00 0.00 179.25 179.93 2bui h VAL 278 N 0.95 0.80 -0.43 0.00 2.07 -0.60 -1.06 116.25 117.98 2bui h VAL 278 Ca 0.21 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 2bui h VAL 278 Cb 0.30 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2bui h VAL 278 CO -0.01 0.04 0.13 0.03 0.02 0.00 0.00 177.57 177.79 2bui h ARG 279 N -0.40 0.63 -0.08 1.57 3.08 -0.90 -1.88 114.38 116.40 2bui h ARG 279 Ca -0.03 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2bui h ARG 279 Cb 0.31 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 2bui h ARG 279 CO 0.05 0.55 -0.04 0.00 -1.07 0.00 0.00 179.97 179.46 2bui h MET 281 N -0.22 1.06 -0.59 0.00 2.86 -1.04 -1.82 114.93 115.19 2bui h MET 281 Ca 0.02 -0.14 -0.06 0.00 -2.06 0.00 0.00 59.70 57.45 2bui h MET 281 Cb 0.50 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 2bui h MET 281 CO 0.01 0.82 0.13 0.87 1.06 0.00 0.00 176.91 179.80 2bui h LYS 282 N 1.04 0.92 -0.32 1.72 1.57 -1.35 -1.12 116.57 119.04 2bui h LYS 282 Ca 0.26 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 2bui h LYS 282 Cb 0.09 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2bui h LYS 282 CO -0.04 0.83 -0.11 1.98 -0.57 0.00 0.00 179.45 181.54 2bui h MET 283 N 0.88 0.54 0.00 3.15 4.05 -0.86 -1.89 114.93 120.80 2bui h MET 283 Ca 0.19 -0.15 -0.11 0.00 -0.28 0.00 0.00 59.70 59.34 2bui h MET 283 Cb 0.33 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.06 2bui h MET 283 CO 0.00 0.64 -0.55 0.00 0.23 0.00 0.00 176.91 177.24 2bui h ALA 284 N 1.39 0.78 0.00 0.39 0.00 -0.84 -3.25 119.26 117.73 2bui h ALA 284 Ca 0.09 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2bui h ALA 284 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2bui h ALA 284 CO 0.03 0.68 -0.51 0.52 0.00 0.00 0.00 179.25 179.97 2bui h MET 285 N 0.00 0.00 -6.33 0.00 2.07 -0.81 -3.37 114.93 106.49 2bui h MET 285 Ca -0.01 0.00 -0.61 0.00 -2.07 0.00 0.00 59.70 57.01 2bui h MET 285 Cb 1.23 0.00 0.03 0.00 -1.87 0.00 0.00 31.60 30.99 2bui h MET 285 CO 0.07 0.00 1.00 1.58 1.07 0.00 0.00 176.91 180.63 2bui n HIS 286 N -2.82 2.29 0.00 -0.22 -0.00 -0.75 -1.25 115.22 112.48 2bui n HIS 286 Ca 0.02 0.10 0.00 0.00 0.46 0.00 0.00 57.72 58.30 2bui n HIS 286 Cb 0.53 -2.62 0.00 0.00 -0.12 0.00 0.00 29.99 27.78 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 4.11 1.97 3.58 1.57 0.00 -1.26 -4.97 105.19 110.18 2bui n GLY 287 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.33 4.05 -2.00 1.61 1.01 -0.38 -4.90 120.40 117.47 2bui s VAL 288 Ca 0.00 0.89 0.24 0.00 0.00 0.00 0.00 61.98 63.11 2bui s VAL 288 Cb 0.00 -4.71 0.69 0.00 0.00 0.00 0.00 36.38 32.36 2bui s VAL 288 CO 0.00 -1.30 1.85 -0.90 0.00 0.00 0.00 175.10 174.74 2bui n ASP 289 N 8.33 0.00 -4.56 3.32 3.85 -1.26 -4.80 116.55 121.42 2bui n ASP 289 Ca 0.08 -0.95 -0.26 0.00 -0.71 0.00 0.00 54.79 52.95 2bui n ASP 289 Cb 0.49 0.00 -0.09 0.00 -1.35 0.00 0.00 41.12 40.17 2bui n ASP 289 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 2bui s THR 290 N -2.00 3.12 0.57 2.12 -4.23 -1.26 -5.12 115.64 108.84 2bui s THR 290 Ca 0.36 -1.79 -0.15 0.00 -1.18 0.00 0.00 61.69 58.93 2bui s THR 290 Cb 0.17 -2.57 -0.05 0.00 1.34 0.00 0.00 72.50 71.39 2bui s THR 290 CO 0.28 -0.18 1.03 -2.16 -0.54 0.00 0.00 174.62 173.05 2bui s PRO 291 N -3.02 3.52 -0.42 3.99 0.04 -1.26 -4.98 135.00 132.87 2bui s PRO 291 Ca 0.26 1.08 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 2bui s PRO 291 Cb -0.08 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.42 2bui s PRO 291 CO 0.16 -0.64 1.11 0.42 0.04 0.00 0.00 177.00 178.09 2bui s ILE 292 N -2.59 4.33 -0.00 0.56 -1.09 -1.26 -4.52 121.20 116.63 2bui s ILE 292 Ca 0.61 1.42 -0.21 0.00 -2.23 0.00 0.00 60.65 60.25 2bui s ILE 292 Cb -0.14 -4.53 -0.23 0.00 -1.58 0.00 0.00 42.46 35.99 2bui s ILE 292 CO 0.37 -0.80 1.11 0.44 -1.23 0.00 0.00 174.94 174.82 2bui h ASP 293 N 8.78 0.47 -4.29 3.58 3.45 -1.33 -3.40 116.42 123.69 2bui h ASP 293 Ca -0.22 -0.74 -0.33 0.00 0.43 0.00 0.00 57.03 56.17 2bui h ASP 293 Cb 1.06 -0.14 -0.25 0.00 -0.56 0.00 0.00 39.33 39.43 2bui h ASP 293 CO 1.09 1.15 -0.75 -0.47 -1.57 0.00 0.00 179.24 178.69 2bui s TYR 294 N -3.27 0.67 -0.21 4.55 5.04 -1.19 -1.80 117.35 121.14 2bui s TYR 294 Ca -0.14 -0.28 -0.00 0.00 -2.44 0.00 0.00 57.07 54.21 2bui s TYR 294 Cb 0.03 -0.41 0.05 0.00 0.35 0.00 0.00 41.96 41.98 2bui s TYR 294 CO 0.80 -0.03 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.78 2bui s LEU 295 N -0.81 2.00 -0.53 6.97 0.20 1.00 -0.98 118.68 126.53 2bui s LEU 295 Ca -0.02 -0.95 -0.24 0.00 0.69 0.00 0.00 54.13 53.60 2bui s LEU 295 Cb -0.06 -0.98 0.04 0.00 -0.43 0.00 0.00 46.19 44.76 2bui s LEU 295 CO 0.00 -0.23 0.92 0.21 -0.29 0.00 0.00 176.35 176.95 2bui s ASN 296 N 1.56 6.36 0.71 3.68 3.84 0.12 -3.19 114.94 128.03 2bui s ASN 296 Ca -0.03 -0.30 -0.11 0.00 0.21 0.00 0.00 52.86 52.63 2bui s ASN 296 Cb -0.17 -2.43 0.02 0.00 -0.55 0.00 0.00 41.25 38.12 2bui s ASN 296 CO -0.07 -1.17 1.08 -0.94 -2.79 0.00 0.00 177.10 173.21 2bui s SER 297 N 2.72 5.33 0.19 -4.21 1.04 -1.17 -1.77 113.70 115.84 2bui s SER 297 Ca 0.31 1.28 -0.05 0.00 0.48 0.00 0.00 55.95 57.96 2bui s SER 297 Cb -0.12 -2.11 0.12 0.00 0.10 0.00 0.00 66.02 64.01 2bui s SER 297 CO 0.20 -1.43 1.57 -0.74 0.98 0.00 0.00 173.24 173.81 2bui h HIS 298 N -0.71 0.88 -0.28 5.02 2.76 -1.93 -3.43 115.15 117.45 2bui h HIS 298 Ca -0.45 -0.24 0.00 0.00 -2.20 0.00 0.00 60.37 57.48 2bui h HIS 298 Cb 1.24 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 30.01 2bui h HIS 298 CO 0.53 0.99 0.00 0.41 -1.30 0.00 0.00 177.93 178.56 2bui n GLY 299 N -0.03 0.00 0.07 5.26 0.00 -1.26 -4.84 105.19 104.38 2bui n GLY 299 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 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 0.07 0.00 -1.95 2.61 -2.24 -1.26 -4.48 114.28 107.03 2bui n THR 300 Ca 0.00 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2bui n THR 300 Cb 0.00 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 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 -1.21 -1.36 -4.76 3.42 2.88 -1.26 -3.84 113.62 107.48 2bui n SER 301 Ca 0.10 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.32 2bui n SER 301 Cb 0.31 -0.42 -0.07 0.00 -0.75 0.00 0.00 64.21 63.28 2bui n SER 301 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2bui s THR 302 N -2.51 4.56 0.12 2.46 -1.32 -1.26 -2.32 115.64 115.36 2bui s THR 302 Ca 0.00 -0.53 -0.32 0.00 -1.21 0.00 0.00 61.69 59.62 2bui s THR 302 Cb 0.00 -3.10 -0.11 0.00 -1.51 0.00 0.00 72.50 67.78 2bui s THR 302 CO 0.00 0.30 1.57 -0.65 -2.21 0.00 0.00 174.62 173.63 2bui h PRO 303 N 3.95 -0.61 0.00 7.08 0.11 -1.94 -2.73 132.00 137.86 2bui h PRO 303 Ca -0.48 0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2bui h PRO 303 Cb 1.18 0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 2bui h PRO 303 CO 0.62 -0.41 -0.04 0.28 -0.21 0.00 0.00 178.00 178.24 2bui h VAL 304 N -0.63 1.48 -0.57 3.15 2.07 -1.98 -3.37 116.25 116.38 2bui h VAL 304 Ca 0.03 -2.12 0.12 0.00 0.82 0.00 0.00 66.70 65.55 2bui h VAL 304 Cb 0.70 2.80 -0.10 0.00 -1.52 0.00 0.00 31.29 33.17 2bui h VAL 304 CO -0.33 0.50 -0.04 1.23 0.02 0.00 0.00 177.57 178.95 2bui h GLY 305 N -1.00 0.55 -0.11 2.17 0.00 -1.97 -1.55 103.07 101.16 2bui h GLY 305 Ca -0.01 0.11 0.08 0.00 0.00 0.00 0.00 47.33 47.51 2bui h GLY 305 CO -0.01 -0.19 -0.30 -0.55 0.00 0.00 0.00 176.54 175.49 2bui h ASP 306 N 0.08 -0.99 1.71 0.19 5.19 -1.66 -1.76 116.42 119.18 2bui h ASP 306 Ca 0.29 0.18 -0.03 0.00 -0.62 0.00 0.00 57.03 56.85 2bui h ASP 306 Cb 0.46 0.47 -0.00 0.00 0.18 0.00 0.00 39.33 40.44 2bui h ASP 306 CO -0.52 -0.31 -0.13 -0.37 -3.12 0.00 0.00 179.24 174.80 2bui h VAL 307 N -0.24 0.23 -0.52 -1.35 -1.51 -1.67 -2.70 116.25 108.50 2bui h VAL 307 Ca 0.17 -1.22 -0.08 0.00 -1.23 0.00 0.00 66.70 64.34 2bui h VAL 307 Cb 0.52 2.02 -0.02 0.00 -2.13 0.00 0.00 31.29 31.68 2bui h VAL 307 CO -0.51 0.12 0.01 0.50 -1.23 0.00 0.00 177.57 176.46 2bui h LYS 308 N 0.00 0.90 -0.18 5.19 1.63 -0.57 -0.99 116.57 122.55 2bui h LYS 308 Ca -0.00 -0.28 -0.18 0.00 -0.85 0.00 0.00 60.65 59.34 2bui h LYS 308 Cb 1.01 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2bui h LYS 308 CO 0.02 0.92 -0.63 1.49 -3.45 0.00 0.00 179.45 177.80 2bui h GLU 309 N 0.77 0.63 -0.95 1.90 4.81 -1.32 -2.60 114.58 117.83 2bui h GLU 309 Ca 0.15 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2bui h GLU 309 Cb 0.51 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.91 2bui h GLU 309 CO 0.02 1.06 0.59 -0.07 -0.73 0.00 0.00 179.01 179.88 2bui h LEU 310 N 0.46 1.12 -0.77 1.64 3.38 -1.24 0.44 115.31 120.34 2bui h LEU 310 Ca -0.01 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2bui h LEU 310 Cb 1.21 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 2bui h LEU 310 CO 0.12 0.84 0.15 0.00 0.09 0.00 0.00 178.44 179.64 2bui h ALA 311 N 1.33 0.99 -0.54 1.53 0.00 -1.08 0.47 119.26 121.96 2bui h ALA 311 Ca 0.34 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2bui h ALA 311 Cb -0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2bui h ALA 311 CO -0.07 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.81 2bui h ALA 312 N 1.13 0.73 -0.24 0.00 0.00 -0.99 -0.93 119.26 118.96 2bui h ALA 312 Ca 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2bui h ALA 312 Cb 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2bui h ALA 312 CO 0.00 0.57 0.11 0.82 0.00 0.00 0.00 179.25 180.76 2bui h ILE 313 N 0.85 1.14 -0.93 0.00 2.04 -0.57 0.09 117.51 120.12 2bui h ILE 313 Ca 0.15 -0.40 0.03 0.00 1.00 0.00 0.00 64.86 65.64 2bui h ILE 313 Cb 0.57 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 2bui h ILE 313 CO 0.03 0.14 0.61 -0.09 0.00 0.00 0.00 178.15 178.84 2bui h ARG 314 N 0.25 1.15 -0.42 2.37 9.65 -0.73 0.14 114.38 126.80 2bui h ARG 314 Ca 0.08 -0.07 -0.10 0.00 -1.10 0.00 0.00 59.98 58.79 2bui h ARG 314 Cb 0.12 -0.26 -0.02 0.00 -1.39 0.00 0.00 29.97 28.42 2bui h ARG 314 CO -0.01 0.76 -0.15 1.49 2.80 0.00 0.00 179.97 184.86 2bui h GLU 315 N 1.18 0.77 -0.01 0.20 4.57 -0.69 0.47 114.58 121.08 2bui h GLU 315 Ca 0.37 -0.27 -0.12 0.00 -1.18 0.00 0.00 59.36 58.15 2bui h GLU 315 Cb -0.01 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2bui h GLU 315 CO -0.11 0.88 -0.48 0.28 -1.18 0.00 0.00 179.01 178.40 2bui h VAL 316 N 0.69 1.46 -0.01 0.32 2.07 0.06 -3.36 116.25 117.47 2bui h VAL 316 Ca 0.11 -2.00 0.00 0.00 0.82 0.00 0.00 66.70 65.63 2bui h VAL 316 Cb 0.64 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2bui h VAL 316 CO 0.04 0.57 -0.55 0.49 0.02 0.00 0.00 177.57 178.15 2bui n PHE 317 N -4.31 0.00 0.00 1.57 3.01 0.39 -5.03 117.46 113.08 2bui n PHE 317 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2bui n PHE 317 Cb 0.61 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.08 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 1.43 4.11 0.91 1.37 0.00 0.17 -1.12 105.19 112.05 2bui n GLY 318 Ca 0.09 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.38 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 7.92 2.76 -3.13 1.61 10.43 -1.26 -4.45 116.55 130.43 2bui n ASP 319 Ca 0.00 -1.89 -0.34 0.00 2.57 0.00 0.00 54.79 55.14 2bui n ASP 319 Cb 0.00 -0.12 -0.00 0.00 1.84 0.00 0.00 41.12 42.84 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 1.08 4.00 -1.95 -1.24 5.02 -0.28 -5.05 118.16 119.75 2bui n LYS 320 Ca 0.17 -4.58 -0.41 0.00 -2.02 0.00 0.00 58.31 51.47 2bui n LYS 320 Cb 0.53 -2.33 -0.01 0.00 -0.02 0.00 0.00 35.03 33.20 2bui n LYS 320 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2bui s SER 321 N -2.43 6.46 0.74 4.39 0.15 -1.26 -4.88 113.70 116.88 2bui s SER 321 Ca 0.46 2.86 -0.09 0.00 0.70 0.00 0.00 55.95 59.88 2bui s SER 321 Cb 0.28 -2.66 0.07 0.00 -1.71 0.00 0.00 66.02 62.00 2bui s SER 321 CO -0.18 -0.77 1.08 -2.16 1.20 0.00 0.00 173.24 172.41 2bui s PRO 322 N -2.03 2.12 0.28 5.44 0.04 -1.26 -4.73 135.00 134.86 2bui s PRO 322 Ca 0.52 -0.11 -0.29 0.00 0.04 0.00 0.00 61.00 61.16 2bui s PRO 322 Cb -0.43 -2.09 -0.10 0.00 0.04 0.00 0.00 34.50 31.93 2bui s PRO 322 CO 0.57 -1.37 1.34 0.00 0.04 0.00 0.00 177.00 177.59 2bui s ALA 323 N -3.37 3.54 -0.02 8.56 0.00 -0.74 -4.28 121.76 125.45 2bui s ALA 323 Ca 0.61 1.24 0.04 0.00 0.00 0.00 0.00 51.96 53.86 2bui s ALA 323 Cb -0.11 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 2bui s ALA 323 CO 0.46 -0.64 -0.15 0.42 0.00 0.00 0.00 175.76 175.85 2bui s ILE 324 N -0.57 1.24 -0.18 0.00 1.01 0.15 -0.00 121.20 122.86 2bui s ILE 324 Ca 0.53 -0.65 -0.17 0.00 0.00 0.00 0.00 60.65 60.36 2bui s ILE 324 Cb -0.40 -1.05 0.05 0.00 0.01 0.00 0.00 42.46 41.07 2bui s ILE 324 CO 0.47 0.36 0.49 -0.94 0.00 0.00 0.00 174.94 175.31 2bui s SER 325 N -0.20 -0.50 -0.47 3.58 1.04 -1.19 -0.72 113.70 115.23 2bui s SER 325 Ca 0.02 0.97 -0.11 0.00 0.48 0.00 0.00 55.95 57.30 2bui s SER 325 Cb -0.08 0.98 0.10 0.00 0.10 0.00 0.00 66.02 67.12 2bui s SER 325 CO 0.00 -0.18 0.36 0.00 0.98 0.00 0.00 173.24 174.40 2bui s ALA 326 N 0.22 3.44 -0.54 5.32 0.00 -1.26 -3.01 121.76 125.92 2bui s ALA 326 Ca -0.00 -2.36 0.19 0.00 0.00 0.00 0.00 51.96 49.79 2bui s ALA 326 Cb -0.03 -2.90 0.86 0.00 0.00 0.00 0.00 23.12 21.05 2bui s ALA 326 CO 0.01 -1.82 1.57 0.25 0.00 0.00 0.00 175.76 175.76 2bui n THR 327 N 5.02 1.07 0.26 0.00 -2.24 -1.26 -2.39 114.28 114.74 2bui n THR 327 Ca -0.10 0.42 0.11 0.00 -2.27 0.00 0.00 64.05 62.21 2bui n THR 327 Cb 0.42 -1.36 0.70 0.00 -2.10 0.00 0.00 70.33 67.99 2bui n THR 327 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2bui h LYS 328 N 0.00 0.00 -0.07 -0.78 1.57 -1.83 0.57 116.57 116.03 2bui h LYS 328 Ca 0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2bui h LYS 328 Cb 0.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2bui h LYS 328 CO 0.00 0.12 0.06 0.00 -0.57 0.00 0.00 179.45 179.06 2bui h ALA 329 N 1.88 1.86 0.02 3.86 0.00 -1.72 0.43 119.26 125.60 2bui h ALA 329 Ca -0.00 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 2bui h ALA 329 Cb 0.28 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2bui h ALA 329 CO 0.02 -0.09 -1.97 -1.33 0.00 0.00 0.00 179.25 175.87 2bui n MET 330 N -4.19 0.62 0.08 0.00 2.81 -0.09 -4.58 117.12 111.76 2bui n MET 330 Ca -0.01 0.37 0.08 0.00 -1.81 0.00 0.00 57.70 56.32 2bui n MET 330 Cb 0.16 -1.63 -0.03 0.00 -0.71 0.00 0.00 33.22 31.01 2bui n MET 330 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2bui n THR 331 N -4.07 0.79 0.00 2.03 -2.24 -0.00 -0.92 114.28 109.87 2bui n THR 331 Ca -0.42 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 60.77 2bui n THR 331 Cb 0.85 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 2bui n THR 331 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bui n GLY 332 N 1.26 -0.83 3.40 3.38 0.00 0.15 -4.60 105.19 107.95 2bui n GLY 332 Ca -0.03 -1.69 -0.44 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 -1.06 3.23 -1.56 1.61 2.46 0.31 -4.67 115.29 115.61 2bui s HIS 333 Ca 0.00 -0.84 0.04 0.00 0.47 0.00 0.00 55.06 54.73 2bui s HIS 333 Cb 0.00 -3.11 0.15 0.00 -0.13 0.00 0.00 32.58 29.49 2bui s HIS 333 CO 0.00 -0.78 0.98 -1.13 -2.47 0.00 0.00 174.74 171.33 2bui n SER 334 N 5.28 1.27 0.00 9.88 3.41 -1.26 -0.03 113.62 132.17 2bui n SER 334 Ca -0.12 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.42 2bui n SER 334 Cb 0.44 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 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 0.02 0.00 0.22 1.04 4.77 -1.26 -1.41 117.00 120.37 2bui n LEU 335 Ca 0.05 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.19 2bui n LEU 335 Cb 0.25 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 42.00 2bui n LEU 335 CO 0.05 0.00 0.95 1.23 -1.33 0.00 0.00 177.39 178.29 2bui h GLY 336 N 0.00 0.00 0.07 -0.72 0.00 -1.86 -2.63 103.07 97.93 2bui h GLY 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bui h GLY 336 CO 0.00 0.00 -0.77 0.00 0.00 0.00 0.00 176.54 175.77 2bui n ALA 337 N -1.95 4.23 -0.26 3.60 0.00 -0.50 -2.15 120.51 123.47 2bui n ALA 337 Ca 0.01 -0.54 -0.02 0.00 0.00 0.00 0.00 53.44 52.88 2bui n ALA 337 Cb 0.24 -0.87 0.09 0.00 0.00 0.00 0.00 19.45 18.91 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 3.18 0.96 0.16 0.00 0.00 -1.55 -2.33 119.26 119.68 2bui h ALA 338 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2bui h ALA 338 Cb 0.54 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2bui h ALA 338 CO 0.00 0.20 -0.32 0.78 0.00 0.00 0.00 179.25 179.91 2bui h GLY 339 N 0.85 -0.64 1.11 0.00 0.00 -1.77 -0.28 103.07 102.35 2bui h GLY 339 Ca 0.30 0.38 -0.15 0.00 0.00 0.00 0.00 47.33 47.86 2bui h GLY 339 CO -0.13 -0.25 -0.32 -0.24 0.00 0.00 0.00 176.54 175.59 2bui h VAL 340 N -0.57 1.27 -0.17 4.60 3.04 -1.70 -1.90 116.25 120.82 2bui h VAL 340 Ca 0.02 -1.49 -0.01 0.00 -1.01 0.00 0.00 66.70 64.21 2bui h VAL 340 Cb 0.58 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 31.17 2bui h VAL 340 CO -0.16 0.50 0.08 1.56 -1.01 0.00 0.00 177.57 178.54 2bui h GLN 341 N 0.77 0.25 0.00 4.17 4.20 -1.34 -0.99 115.11 122.16 2bui h GLN 341 Ca 0.08 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 2bui h GLN 341 Cb 0.91 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2bui h GLN 341 CO 0.08 0.31 -0.23 0.93 -0.67 0.00 0.00 178.83 179.25 2bui h GLU 342 N 0.14 0.00 -0.05 1.46 5.08 -1.08 0.88 114.58 121.01 2bui h GLU 342 Ca 0.06 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.28 2bui h GLU 342 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2bui h GLU 342 CO -0.01 0.23 -0.58 0.00 -1.00 0.00 0.00 179.01 177.65 2bui h ALA 343 N 1.77 0.92 0.00 3.43 0.00 -0.89 -1.64 119.26 122.85 2bui h ALA 343 Ca -0.00 -0.53 -0.24 0.00 0.00 0.00 0.00 54.91 54.14 2bui h ALA 343 Cb 0.52 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2bui h ALA 343 CO 0.03 0.72 -0.98 0.82 0.00 0.00 0.00 179.25 179.84 2bui h ILE 344 N 0.13 1.37 -0.81 0.00 2.04 0.18 -0.70 117.51 119.72 2bui h ILE 344 Ca -0.00 -2.41 -0.04 0.00 1.00 0.00 0.00 64.86 63.40 2bui h ILE 344 Cb 1.07 2.42 -0.04 0.00 -0.74 0.00 0.00 36.82 39.53 2bui h ILE 344 CO 0.09 0.73 0.35 1.88 0.00 0.00 0.00 178.15 181.19 2bui h TYR 345 N 0.27 1.21 -0.48 1.37 0.05 -0.72 0.52 116.97 119.19 2bui h TYR 345 Ca -0.09 -0.08 -0.06 0.00 0.05 0.00 0.00 58.73 58.54 2bui h TYR 345 Cb 1.62 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 38.98 2bui h TYR 345 CO 0.07 0.90 0.04 0.77 -1.05 0.00 0.00 178.16 178.89 2bui h SER 346 N 1.17 0.79 -0.27 3.88 0.02 -1.21 -1.81 113.55 116.12 2bui h SER 346 Ca 0.27 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2bui h SER 346 Cb 0.18 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 2bui h SER 346 CO -0.03 0.87 0.01 -0.07 -1.14 0.00 0.00 176.83 176.47 2bui h LEU 347 N 0.68 0.56 -0.70 5.07 3.38 -0.64 -1.36 115.31 122.29 2bui h LEU 347 Ca 0.14 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 2bui h LEU 347 Cb 0.44 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2bui h LEU 347 CO 0.02 0.63 -0.60 -0.07 0.09 0.00 0.00 178.44 178.50 2bui h LEU 348 N 0.57 0.19 -0.36 1.67 3.38 -0.64 0.23 115.31 120.35 2bui h LEU 348 Ca 0.12 -0.11 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 2bui h LEU 348 Cb 0.35 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bui h LEU 348 CO 0.01 0.75 -0.68 0.24 0.09 0.00 0.00 178.44 178.84 2bui h MET 349 N 0.12 0.59 -0.16 1.13 2.86 -1.00 -0.34 114.93 118.13 2bui h MET 349 Ca -0.01 -0.44 -0.16 0.00 -2.06 0.00 0.00 59.70 57.03 2bui h MET 349 Cb 1.09 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 2bui h MET 349 CO 0.09 1.06 -0.57 1.25 1.06 0.00 0.00 176.91 179.80 2bui h LEU 350 N 0.42 0.55 -0.07 1.22 5.85 -1.10 0.39 115.31 122.57 2bui h LEU 350 Ca -0.02 -0.30 -0.25 0.00 0.84 0.00 0.00 57.88 58.15 2bui h LEU 350 Cb 1.27 -0.16 0.02 0.00 0.37 0.00 0.00 40.66 42.16 2bui h LEU 350 CO 0.13 1.00 -0.91 -0.08 -0.34 0.00 0.00 178.44 178.24 2bui h GLU 351 N 0.37 0.75 -0.59 1.25 4.57 -0.88 -3.33 114.58 116.73 2bui h GLU 351 Ca 0.00 -0.71 0.00 0.00 -1.18 0.00 0.00 59.36 57.47 2bui h GLU 351 Cb 1.11 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.88 2bui h GLU 351 CO 0.10 1.30 0.00 0.72 -1.18 0.00 0.00 179.01 179.95 2bui n HIS 352 N -3.90 0.94 -3.51 0.92 8.25 -0.15 -5.02 115.22 112.75 2bui n HIS 352 Ca -0.09 -0.54 -0.23 0.00 -0.26 0.00 0.00 57.72 56.60 2bui n HIS 352 Cb 0.82 -0.07 0.04 0.00 1.12 0.00 0.00 29.99 31.89 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 1.13 -1.10 3.52 -1.41 0.00 0.09 -4.92 105.19 102.49 2bui n GLY 353 Ca 0.21 0.50 -0.10 0.00 0.00 0.00 0.00 46.02 46.63 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 -3.33 -0.33 -0.21 1.61 -0.12 -0.94 -1.34 117.98 113.33 2bui s PHE 354 Ca 0.35 0.02 -0.01 0.00 -0.05 0.00 0.00 56.93 57.24 2bui s PHE 354 Cb -0.11 0.52 0.01 0.00 -0.63 0.00 0.00 43.02 42.81 2bui s PHE 354 CO 0.82 -0.93 -0.11 0.42 -0.05 0.00 0.00 175.22 175.38 2bui s ILE 355 N -3.82 2.75 0.45 -4.49 1.01 0.43 -4.60 121.20 112.93 2bui s ILE 355 Ca 0.05 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.67 2bui s ILE 355 Cb -0.02 -2.26 -0.08 0.00 0.01 0.00 0.00 42.46 40.12 2bui s ILE 355 CO -0.06 0.42 1.30 0.00 0.00 0.00 0.00 174.94 176.60 2bui s ALA 356 N 1.37 3.13 0.37 9.38 0.00 -1.26 -2.57 121.76 132.17 2bui s ALA 356 Ca 0.04 1.22 -0.20 0.00 0.00 0.00 0.00 51.96 53.03 2bui s ALA 356 Cb -0.14 -3.49 -0.10 0.00 0.00 0.00 0.00 23.12 19.38 2bui s ALA 356 CO -0.07 -0.93 0.87 -1.25 0.00 0.00 0.00 175.76 174.37 2bui s PRO 357 N -2.46 4.20 -0.61 0.00 0.04 -1.26 -4.74 135.00 130.17 2bui s PRO 357 Ca 0.61 0.99 -0.19 0.00 0.04 0.00 0.00 61.00 62.45 2bui s PRO 357 Cb -0.37 -2.38 0.11 0.00 0.04 0.00 0.00 34.50 31.90 2bui s PRO 357 CO 0.47 0.09 0.73 0.45 0.04 0.00 0.00 177.00 178.78 2bui s SER 358 N -2.11 6.21 0.77 6.66 0.15 -0.25 -4.76 113.70 120.37 2bui s SER 358 Ca 0.57 -1.47 -0.08 0.00 0.70 0.00 0.00 55.95 55.67 2bui s SER 358 Cb -0.11 -2.31 0.10 0.00 -1.71 0.00 0.00 66.02 62.00 2bui s SER 358 CO 0.16 -1.12 1.08 0.27 1.20 0.00 0.00 173.24 174.84 2bui s ILE 359 N 2.68 2.18 -1.66 6.45 -4.36 -1.26 -4.49 121.20 120.74 2bui s ILE 359 Ca 0.13 -0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.26 2bui s ILE 359 Cb -0.23 -2.92 0.00 0.00 1.25 0.00 0.00 42.46 40.56 2bui s ILE 359 CO 0.06 0.00 0.00 0.59 0.24 0.00 0.00 174.94 175.83 2bui n ASN 360 N -3.10 -4.90 -4.40 4.36 3.02 -1.26 -4.53 115.26 104.45 2bui n ASN 360 Ca 0.11 0.35 -0.44 0.00 -0.03 0.00 0.00 54.58 54.57 2bui n ASN 360 Cb 0.60 -3.82 -0.06 0.00 -0.61 0.00 0.00 39.78 35.89 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 -2.61 4.99 -0.16 2.41 1.01 -1.26 -4.77 121.20 120.80 2bui s ILE 361 Ca 0.00 -0.88 0.22 0.00 0.00 0.00 0.00 60.65 59.99 2bui s ILE 361 Cb 0.00 -4.31 -0.26 0.00 0.01 0.00 0.00 42.46 37.90 2bui s ILE 361 CO 0.00 -0.83 0.63 -0.62 0.00 0.00 0.00 174.94 174.12 2bui n GLU 362 N 5.86 0.58 -3.33 2.79 4.71 -1.26 -4.76 120.64 125.24 2bui n GLU 362 Ca -0.10 -0.12 -0.13 0.00 -0.01 0.00 0.00 57.16 56.81 2bui n GLU 362 Cb 0.44 -1.57 -0.07 0.00 -1.01 0.00 0.00 31.44 29.23 2bui n GLU 362 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2bui s GLU 363 N -3.44 0.57 0.31 3.49 2.12 -1.26 -5.06 118.70 115.44 2bui s GLU 363 Ca -0.05 -0.46 -0.29 0.00 0.36 0.00 0.00 54.97 54.53 2bui s GLU 363 Cb 0.13 -0.51 -0.13 0.00 0.26 0.00 0.00 34.13 33.89 2bui s GLU 363 CO 0.88 -1.14 1.30 -0.11 -0.54 0.00 0.00 175.26 175.66 2bui n LEU 364 N 4.65 3.33 -4.77 2.70 7.94 -1.26 -0.68 117.00 128.90 2bui n LEU 364 Ca 0.07 1.19 -0.40 0.00 -1.11 0.00 0.00 56.01 55.76 2bui n LEU 364 Cb 0.48 -1.46 -0.01 0.00 0.53 0.00 0.00 43.42 42.96 2bui n LEU 364 CO 0.04 -0.54 1.00 -0.62 -1.11 0.00 0.00 177.39 176.16 2bui s ASP 365 N -0.17 6.41 0.35 1.96 2.15 0.02 -4.72 116.67 122.67 2bui s ASP 365 Ca 0.59 2.75 0.03 0.00 0.43 0.00 0.00 52.55 56.35 2bui s ASP 365 Cb -0.60 -2.65 0.65 0.00 -0.30 0.00 0.00 42.92 40.02 2bui s ASP 365 CO 0.59 -0.79 1.98 1.05 -0.17 0.00 0.00 175.17 177.82 2bui h GLU 366 N 2.89 0.73 0.00 4.34 4.11 -1.91 -2.00 114.58 122.74 2bui h GLU 366 Ca -0.50 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 58.86 2bui h GLU 366 Cb 1.24 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2bui h GLU 366 CO 0.63 0.54 0.00 1.04 0.07 0.00 0.00 179.01 181.29 2bui n GLN 367 N -4.40 0.39 -0.00 1.06 6.02 -1.26 -1.55 117.38 117.64 2bui n GLN 367 Ca 0.05 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.14 2bui n GLN 367 Cb 0.10 -1.30 -0.10 0.00 1.02 0.00 0.00 30.24 29.95 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 -0.80 4.66 -1.77 -1.58 0.00 -0.75 -4.80 120.51 115.47 2bui n ALA 368 Ca 0.06 -0.59 -0.40 0.00 0.00 0.00 0.00 53.44 52.51 2bui n ALA 368 Cb 0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 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 -3.01 3.41 0.00 0.00 0.00 -0.59 -2.20 121.76 119.36 2bui s ALA 369 Ca 0.08 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2bui s ALA 369 Cb 0.16 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2bui s ALA 369 CO 0.86 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2bui n GLY 370 N 0.64 0.88 3.60 0.00 0.00 -1.26 -5.05 105.19 103.99 2bui n GLY 370 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 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 2.98 -0.90 0.99 1.43 -0.93 -4.76 118.68 117.49 2bui s LEU 371 Ca 0.00 -0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 52.12 2bui s LEU 371 Cb 0.00 -1.45 0.23 0.00 0.03 0.00 0.00 46.19 45.01 2bui s LEU 371 CO 0.00 -0.07 0.85 0.21 0.23 0.00 0.00 176.35 177.57 2bui s ASN 372 N -3.65 6.89 -0.44 2.29 2.47 -1.26 -5.01 114.94 116.23 2bui s ASN 372 Ca 0.32 -2.92 -0.18 0.00 0.42 0.00 0.00 52.86 50.50 2bui s ASN 372 Cb -0.04 -2.21 0.03 0.00 -1.45 0.00 0.00 41.25 37.58 2bui s ASN 372 CO 0.19 -0.50 0.49 -0.63 -3.72 0.00 0.00 177.10 172.92 2bui s ILE 373 N -0.20 5.03 -0.17 -5.21 1.01 -1.26 0.35 121.20 120.75 2bui s ILE 373 Ca 0.21 -0.33 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 2bui s ILE 373 Cb -0.10 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.27 2bui s ILE 373 CO -0.09 -0.50 0.96 -0.69 0.00 0.00 0.00 174.94 174.62 2bui s VAL 374 N 2.27 4.78 -0.64 2.92 1.01 0.10 -4.93 120.40 125.91 2bui s VAL 374 Ca 0.14 1.89 0.09 0.00 0.00 0.00 0.00 61.98 64.10 2bui s VAL 374 Cb -0.17 -4.25 0.25 0.00 0.00 0.00 0.00 36.38 32.21 2bui s VAL 374 CO 0.14 -0.05 1.21 0.35 0.00 0.00 0.00 175.10 176.74 2bui n THR 375 N 4.89 1.12 -3.80 3.92 -2.24 -1.26 -1.09 114.28 115.82 2bui n THR 375 Ca 0.08 -1.09 -0.13 0.00 -2.27 0.00 0.00 64.05 60.64 2bui n THR 375 Cb 0.48 0.43 -0.12 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.18 0.23 0.11 -0.78 -1.05 -1.26 -4.53 118.70 110.24 2bui s GLU 376 Ca 0.19 0.29 -0.36 0.00 -0.15 0.00 0.00 54.97 54.95 2bui s GLU 376 Cb 0.11 0.10 -0.16 0.00 -0.44 0.00 0.00 34.13 33.75 2bui s GLU 376 CO 0.11 -0.04 1.43 2.41 0.95 0.00 0.00 175.26 180.13 2bui n THR 377 N 3.04 0.01 -3.79 1.83 -1.04 -1.26 -4.63 114.28 108.44 2bui n THR 377 Ca -0.13 -0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.63 2bui n THR 377 Cb 0.58 -1.09 -0.17 0.00 -1.82 0.00 0.00 70.33 67.83 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 0.70 0.54 0.13 12.58 2.01 -1.06 -4.95 115.64 125.58 2bui s THR 378 Ca 0.83 -0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.42 2bui s THR 378 Cb -0.85 -0.74 -0.07 0.00 0.01 0.00 0.00 72.50 70.84 2bui s THR 378 CO 0.44 0.18 1.24 -1.81 -0.69 0.00 0.00 174.62 173.98 2bui s ASP 379 N 1.90 7.02 -0.18 3.53 1.01 -1.26 -0.42 116.67 128.26 2bui s ASP 379 Ca 0.04 2.18 -0.28 0.00 0.71 0.00 0.00 52.55 55.19 2bui s ASP 379 Cb -0.13 -2.59 0.10 0.00 1.01 0.00 0.00 42.92 41.30 2bui s ASP 379 CO -0.06 -0.47 0.84 -0.60 0.21 0.00 0.00 175.17 175.09 2bui s ARG 380 N 0.51 0.77 -0.63 8.23 3.52 -0.45 -4.92 118.95 125.97 2bui s ARG 380 Ca 0.57 0.48 -0.27 0.00 -0.13 0.00 0.00 55.73 56.38 2bui s ARG 380 Cb -0.32 0.37 0.03 0.00 -1.56 0.00 0.00 34.95 33.47 2bui s ARG 380 CO 0.33 -0.18 1.20 -2.00 -0.81 0.00 0.00 175.30 173.83 2bui s GLU 381 N -0.49 3.38 0.18 5.12 2.12 -1.26 -3.39 118.70 124.36 2bui s GLU 381 Ca -0.03 0.02 -0.06 0.00 0.36 0.00 0.00 54.97 55.27 2bui s GLU 381 Cb -0.02 -4.08 -0.06 0.00 0.26 0.00 0.00 34.13 30.23 2bui s GLU 381 CO 0.02 -1.82 0.43 -0.51 -0.54 0.00 0.00 175.26 172.84 2bui s LEU 382 N 5.11 4.23 0.00 2.70 1.43 -1.26 -5.00 118.68 125.89 2bui s LEU 382 Ca 0.39 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.16 2bui s LEU 382 Cb -0.08 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2bui s LEU 382 CO 0.21 -0.00 0.00 0.41 0.23 0.00 0.00 176.35 177.20 2bui n THR 383 N -0.08 0.00 -4.62 5.49 -1.04 -1.26 -4.93 114.28 107.83 2bui n THR 383 Ca -0.02 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.72 2bui n THR 383 Cb 0.52 -0.75 -0.17 0.00 -1.82 0.00 0.00 70.33 68.12 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 -1.83 1.39 0.16 12.58 2.01 -1.26 -1.18 115.64 127.50 2bui s THR 384 Ca 0.00 -0.61 0.07 0.00 0.31 0.00 0.00 61.69 61.46 2bui s THR 384 Cb 0.00 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 2bui s THR 384 CO 0.00 0.41 -0.14 0.68 -0.69 0.00 0.00 174.62 174.88 2bui s VAL 385 N 0.75 1.53 0.05 3.82 -7.23 0.58 -0.76 120.40 119.15 2bui s VAL 385 Ca -0.12 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.12 2bui s VAL 385 Cb -0.16 -1.80 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 2bui s VAL 385 CO 0.02 -0.50 -0.12 -0.32 -0.31 0.00 0.00 175.10 173.87 2bui s MET 386 N -3.17 0.75 -0.04 4.82 -2.45 -0.15 -0.54 119.30 118.52 2bui s MET 386 Ca 0.16 -0.80 -0.01 0.00 -1.25 0.00 0.00 55.69 53.79 2bui s MET 386 Cb -0.03 -0.69 0.03 0.00 1.25 0.00 0.00 34.83 35.39 2bui s MET 386 CO 0.05 0.16 0.04 0.45 1.05 0.00 0.00 175.02 176.76 2bui s SER 387 N -1.42 1.00 0.02 1.11 0.15 -0.17 0.15 113.70 114.55 2bui s SER 387 Ca -0.03 0.03 -0.02 0.00 0.70 0.00 0.00 55.95 56.63 2bui s SER 387 Cb -0.09 -0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 63.98 2bui s SER 387 CO 0.01 -0.20 0.20 0.20 1.20 0.00 0.00 173.24 174.65 2bui s ASN 388 N 1.83 6.37 -0.12 5.45 0.01 -0.73 -1.74 114.94 126.01 2bui s ASN 388 Ca 0.01 0.32 -0.04 0.00 -0.71 0.00 0.00 52.86 52.44 2bui s ASN 388 Cb -0.12 -1.98 0.06 0.00 0.41 0.00 0.00 41.25 39.61 2bui s ASN 388 CO -0.03 0.22 0.22 -0.44 -1.51 0.00 0.00 177.10 175.56 2bui s SER 389 N -2.19 0.64 -0.01 -1.22 0.01 0.26 -3.71 113.70 107.48 2bui s SER 389 Ca 0.31 0.39 0.06 0.00 1.31 0.00 0.00 55.95 58.01 2bui s SER 389 Cb -0.13 0.50 -0.01 0.00 0.21 0.00 0.00 66.02 66.59 2bui s SER 389 CO 0.23 -0.25 -0.18 -0.36 0.41 0.00 0.00 173.24 173.08 2bui s PHE 390 N 2.36 1.62 0.30 2.43 0.08 -1.26 -0.52 117.98 122.99 2bui s PHE 390 Ca 0.03 -0.31 0.02 0.00 0.12 0.00 0.00 56.93 56.79 2bui s PHE 390 Cb -0.12 -1.04 -0.04 0.00 -0.57 0.00 0.00 43.02 41.24 2bui s PHE 390 CO -0.08 -0.02 0.12 0.20 -0.10 0.00 0.00 175.22 175.34 2bui s GLY 391 N -0.49 1.98 0.50 4.36 0.00 0.18 -4.37 107.32 109.47 2bui s GLY 391 Ca 0.07 -1.78 -0.23 0.00 0.00 0.00 0.00 44.72 42.78 2bui s GLY 391 CO -0.00 -1.64 1.27 0.69 0.00 0.00 0.00 173.10 173.42 2bui n PHE 392 N -0.58 2.04 -0.23 1.90 0.99 -1.26 -2.63 117.46 117.70 2bui n PHE 392 Ca -0.00 0.46 0.00 0.00 -0.00 0.00 0.00 57.45 57.91 2bui n PHE 392 Cb 0.66 -2.34 0.00 0.00 -1.00 0.00 0.00 39.48 36.80 2bui n PHE 392 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2bui n GLY 393 N 0.85 0.78 2.88 1.37 0.00 0.16 -4.25 105.19 106.98 2bui n GLY 393 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.14 -0.11 3.67 -0.02 0.00 -1.08 -4.71 105.19 100.80 2bui n GLY 394 Ca 0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.16 5.23 0.01 2.61 -1.32 -1.10 -0.26 115.64 117.64 2bui s THR 395 Ca 0.36 0.13 0.07 0.00 -1.21 0.00 0.00 61.69 61.04 2bui s THR 395 Cb -0.16 -3.41 -0.02 0.00 -1.51 0.00 0.00 72.50 67.40 2bui s THR 395 CO 0.45 0.40 -0.22 0.20 -2.21 0.00 0.00 174.62 173.24 2bui s ASN 396 N 0.74 2.56 -0.07 8.08 0.01 -0.25 -0.65 114.94 125.38 2bui s ASN 396 Ca 0.07 -0.45 -0.04 0.00 -0.71 0.00 0.00 52.86 51.73 2bui s ASN 396 Cb -0.13 -0.26 0.03 0.00 0.41 0.00 0.00 41.25 41.31 2bui s ASN 396 CO 0.02 0.23 0.16 0.00 -1.51 0.00 0.00 177.10 175.99 2bui s ALA 397 N -0.62 -0.32 -0.04 0.60 0.00 0.32 -1.77 121.76 119.92 2bui s ALA 397 Ca 0.08 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.70 2bui s ALA 397 Cb -0.09 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.63 2bui s ALA 397 CO 0.00 -0.14 -0.06 0.99 0.00 0.00 0.00 175.76 176.56 2bui s THR 398 N 0.89 0.61 -0.00 0.00 2.01 -0.49 -0.58 115.64 118.08 2bui s THR 398 Ca -0.07 -0.20 0.07 0.00 0.31 0.00 0.00 61.69 61.80 2bui s THR 398 Cb -0.09 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 2bui s THR 398 CO -0.05 0.23 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.14 2bui s LEU 399 N 0.67 2.39 -0.14 4.42 1.43 -0.71 -0.29 118.68 126.45 2bui s LEU 399 Ca -0.09 -0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 52.60 2bui s LEU 399 Cb -0.13 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.69 2bui s LEU 399 CO 0.01 0.30 -0.09 -0.69 0.23 0.00 0.00 176.35 176.10 2bui s VAL 400 N -0.75 1.23 -0.10 -1.59 1.01 -0.29 -0.99 120.40 118.93 2bui s VAL 400 Ca 0.12 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2bui s VAL 400 Cb -0.10 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 2bui s VAL 400 CO 0.01 0.35 -0.12 -0.04 0.00 0.00 0.00 175.10 175.30 2bui s MET 401 N 1.62 3.04 0.04 2.72 -1.94 0.30 -1.65 119.30 123.42 2bui s MET 401 Ca 0.04 -0.66 0.03 0.00 -1.71 0.00 0.00 55.69 53.39 2bui s MET 401 Cb -0.13 -2.56 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 2bui s MET 401 CO -0.09 0.41 -0.10 0.50 -0.01 0.00 0.00 175.02 175.73 2bui s ARG 402 N -0.14 0.66 0.78 2.03 3.52 -0.25 -0.31 118.95 125.25 2bui s ARG 402 Ca -0.00 -0.69 -0.13 0.00 -0.13 0.00 0.00 55.73 54.77 2bui s ARG 402 Cb -0.13 -0.56 0.07 0.00 -1.56 0.00 0.00 34.95 32.76 2bui s ARG 402 CO 0.03 0.13 1.16 0.15 -0.81 0.00 0.00 175.30 175.97 2bui s LYS 403 N -1.25 1.88 0.18 5.12 1.02 -0.33 -0.23 119.74 126.14 2bui s LYS 403 Ca -0.04 1.58 -0.07 0.00 0.02 0.00 0.00 55.97 57.47 2bui s LYS 403 Cb -0.08 -1.82 -0.06 0.00 -0.52 0.00 0.00 37.83 35.35 2bui s LYS 403 CO 0.01 -1.99 0.45 -1.17 -0.92 0.00 0.00 175.35 171.72 2bui s LEU 404 N -5.66 4.22 0.00 3.17 2.96 -1.26 -4.76 118.68 117.35 2bui s LEU 404 Ca 0.70 0.71 0.00 0.00 -0.22 0.00 0.00 54.13 55.32 2bui s LEU 404 Cb -0.25 -3.46 0.00 0.00 0.50 0.00 0.00 46.19 42.98 2bui s LEU 404 CO 0.50 -0.00 0.00 0.29 -1.32 0.00 0.00 176.35 175.82