#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 2.54 -3.51 0.03 4.76 -1.26 -5.01 118.16 115.70 2bui n LYS 2 Ca 0.00 0.89 -0.36 0.00 -2.87 0.00 0.00 58.31 55.97 2bui n LYS 2 Cb 0.00 -2.60 -0.06 0.00 -1.84 0.00 0.00 35.03 30.53 2bui n LYS 2 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2bui s ARG 3 N -1.68 3.85 -0.15 1.97 1.81 -1.26 -4.56 118.95 118.93 2bui s ARG 3 Ca 0.56 0.32 0.01 0.00 -1.72 0.00 0.00 55.73 54.90 2bui s ARG 3 Cb -0.51 -3.08 0.00 0.00 -0.45 0.00 0.00 34.95 30.91 2bui s ARG 3 CO 0.60 0.60 -0.17 0.00 -0.68 0.00 0.00 175.30 175.66 2bui s ALA 4 N -1.28 2.44 0.18 2.13 0.00 -1.26 -1.56 121.76 122.42 2bui s ALA 4 Ca 0.30 -1.06 0.08 0.00 0.00 0.00 0.00 51.96 51.28 2bui s ALA 4 Cb -0.15 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 2bui s ALA 4 CO 0.16 -0.04 -0.17 0.14 0.00 0.00 0.00 175.76 175.85 2bui s VAL 5 N 0.83 1.82 -0.30 0.00 -7.23 0.66 -0.92 120.40 115.27 2bui s VAL 5 Ca -0.05 -2.03 -0.13 0.00 -1.81 0.00 0.00 61.98 57.95 2bui s VAL 5 Cb -0.15 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 2bui s VAL 5 CO -0.01 -0.41 0.29 -0.63 -0.31 0.00 0.00 175.10 174.04 2bui s ILE 6 N -2.35 5.23 -0.97 -0.62 -1.09 -0.56 0.23 121.20 121.07 2bui s ILE 6 Ca 0.18 0.20 0.08 0.00 -2.23 0.00 0.00 60.65 58.88 2bui s ILE 6 Cb -0.04 -3.68 0.07 0.00 -1.58 0.00 0.00 42.46 37.23 2bui s ILE 6 CO 0.07 0.10 0.77 0.35 -1.23 0.00 0.00 174.94 175.00 2bui n THR 7 N 5.13 0.05 -3.55 2.92 -2.24 -0.36 -1.33 114.28 114.89 2bui n THR 7 Ca -0.11 -0.53 -0.13 0.00 -2.27 0.00 0.00 64.05 61.01 2bui n THR 7 Cb 0.51 1.13 -0.05 0.00 -2.10 0.00 0.00 70.33 69.81 2bui n THR 7 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bui s GLY 8 N -0.67 -0.39 0.05 3.38 0.00 -1.26 -3.86 107.32 104.57 2bui s GLY 8 Ca 0.10 1.75 -0.07 0.00 0.00 0.00 0.00 44.72 46.50 2bui s GLY 8 CO 0.10 1.00 0.13 0.48 0.00 0.00 0.00 173.10 174.81 2bui s LEU 9 N -1.14 1.69 -0.11 0.66 0.05 -1.26 0.14 118.68 118.72 2bui s LEU 9 Ca -0.05 -0.54 -0.13 0.00 0.05 0.00 0.00 54.13 53.46 2bui s LEU 9 Cb -0.00 0.72 0.03 0.00 -2.05 0.00 0.00 46.19 44.89 2bui s LEU 9 CO 0.05 -0.56 0.34 -0.83 -0.55 0.00 0.00 176.35 174.80 2bui s GLY 10 N -2.27 -0.24 -0.13 -3.48 0.00 0.10 -2.98 107.32 98.33 2bui s GLY 10 Ca -0.03 0.84 -0.19 0.00 0.00 0.00 0.00 44.72 45.34 2bui s GLY 10 CO -0.06 0.69 0.48 -1.50 0.00 0.00 0.00 173.10 172.71 2bui s ILE 11 N -0.13 0.01 -0.29 0.90 2.07 -1.26 -1.17 121.20 121.33 2bui s ILE 11 Ca -0.03 -0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.10 2bui s ILE 11 Cb -0.03 -0.72 0.09 0.00 0.13 0.00 0.00 42.46 41.93 2bui s ILE 11 CO 0.01 -0.06 0.08 -0.69 -1.91 0.00 0.00 174.94 172.38 2bui s VAL 12 N -0.30 0.86 0.31 4.00 1.01 -0.82 -3.04 120.40 122.41 2bui s VAL 12 Ca -0.05 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 60.69 2bui s VAL 12 Cb -0.03 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 2bui s VAL 12 CO 0.03 -0.58 0.10 -0.94 0.00 0.00 0.00 175.10 173.71 2bui s SER 13 N 1.64 1.83 0.61 3.32 1.04 0.12 -1.10 113.70 121.17 2bui s SER 13 Ca 0.07 -1.44 0.41 0.00 0.48 0.00 0.00 55.95 55.47 2bui s SER 13 Cb -0.17 0.15 2.16 0.00 0.10 0.00 0.00 66.02 68.26 2bui s SER 13 CO -0.22 -0.74 2.24 0.77 0.98 0.00 0.00 173.24 176.28 2bui h SER 14 N 2.19 0.00 -0.16 7.02 4.64 -1.77 -1.89 113.55 123.58 2bui h SER 14 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2bui h SER 14 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2bui h SER 14 CO 0.62 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.88 2bui n ILE 15 N -2.98 1.96 0.00 0.95 -5.35 -1.26 -4.45 119.36 108.23 2bui n ILE 15 Ca -0.02 -1.88 0.00 0.00 -0.27 0.00 0.00 62.75 60.58 2bui n ILE 15 Cb 0.10 -0.14 0.00 0.00 -1.74 0.00 0.00 39.64 37.86 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 -0.74 3.89 1.16 3.28 0.00 -0.71 -3.93 105.19 108.15 2bui n GLY 16 Ca 0.17 -0.43 0.10 0.00 0.00 0.00 0.00 46.02 45.87 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 3.65 -3.68 1.61 3.02 -1.26 0.14 115.26 118.74 2bui n ASN 17 Ca 0.00 -1.99 -0.06 0.00 -0.03 0.00 0.00 54.58 52.49 2bui n ASN 17 Cb 0.00 -0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 38.75 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 -1.05 -0.29 0.56 6.41 2.20 -1.17 -4.63 114.94 116.97 2bui s ASN 18 Ca 0.42 -0.31 0.25 0.00 -0.94 0.00 0.00 52.86 52.27 2bui s ASN 18 Cb 0.22 0.54 1.58 0.00 -2.00 0.00 0.00 41.25 41.59 2bui s ASN 18 CO 0.29 -0.96 2.20 0.06 -2.94 0.00 0.00 177.10 175.75 2bui h GLN 19 N 2.00 0.00 -0.23 3.55 3.07 -1.92 -2.39 115.11 119.19 2bui h GLN 19 Ca -0.24 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.39 2bui h GLN 19 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.81 2bui h GLN 19 CO 0.28 0.02 -0.29 1.96 0.09 0.00 0.00 178.83 180.89 2bui h GLN 20 N 0.00 0.60 -0.37 0.06 7.50 -1.99 -0.70 115.11 120.21 2bui h GLN 20 Ca -0.00 -0.34 -0.12 0.00 0.50 0.00 0.00 58.65 58.69 2bui h GLN 20 Cb 0.04 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 27.58 2bui h GLN 20 CO 0.00 0.94 -0.26 0.93 -1.50 0.00 0.00 178.83 178.94 2bui h GLU 21 N 0.30 0.77 -0.52 1.46 5.08 -1.84 -2.36 114.58 117.47 2bui h GLU 21 Ca 0.03 -0.33 -0.11 0.00 -1.00 0.00 0.00 59.36 57.95 2bui h GLU 21 Cb 0.86 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 2bui h GLU 21 CO 0.07 0.95 -0.12 0.28 -1.00 0.00 0.00 179.01 179.18 2bui h VAL 22 N 0.66 1.27 -0.10 3.13 2.07 -1.44 -1.93 116.25 119.91 2bui h VAL 22 Ca 0.08 -1.27 0.01 0.00 0.82 0.00 0.00 66.70 66.35 2bui h VAL 22 Cb 0.78 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2bui h VAL 22 CO 0.06 0.44 0.01 0.25 0.02 0.00 0.00 177.57 178.36 2bui h LEU 23 N 0.87 -0.00 -0.56 2.57 5.85 -0.91 -0.64 115.31 122.49 2bui h LEU 23 Ca 0.13 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 2bui h LEU 23 Cb 0.68 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 2bui h LEU 23 CO 0.05 0.01 0.35 0.00 -0.34 0.00 0.00 178.44 178.51 2bui h ALA 24 N 1.07 0.72 -0.30 1.25 0.00 -1.29 -1.26 119.26 119.46 2bui h ALA 24 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2bui h ALA 24 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2bui h ALA 24 CO -0.06 0.19 0.17 0.77 0.00 0.00 0.00 179.25 180.32 2bui h SER 25 N 0.76 0.37 -0.44 0.00 0.02 -1.07 -1.05 113.55 112.14 2bui h SER 25 Ca 0.20 -0.07 0.01 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 62.39 2bui h SER 25 CO -0.04 0.33 0.27 -0.07 -1.14 0.00 0.00 176.83 176.18 2bui h LEU 26 N 0.37 0.45 -1.54 5.07 3.38 -0.89 0.14 115.31 122.28 2bui h LEU 26 Ca 0.11 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2bui h LEU 26 Cb 0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2bui h LEU 26 CO -0.02 0.32 -0.23 0.03 0.09 0.00 0.00 178.44 178.63 2bui h ARG 27 N 0.55 0.00 -0.02 1.13 3.08 -0.97 -2.66 114.38 115.48 2bui h ARG 27 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2bui h ARG 27 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2bui h ARG 27 CO -0.06 0.23 -0.22 0.39 -1.07 0.00 0.00 179.97 179.24 2bui n GLU 28 N -4.26 1.46 -2.85 0.04 1.02 -0.42 -4.75 120.64 110.89 2bui n GLU 28 Ca -0.02 -1.08 -0.22 0.00 -0.02 0.00 0.00 57.16 55.82 2bui n GLU 28 Cb 0.29 -1.48 0.02 0.00 -0.02 0.00 0.00 31.44 30.25 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 1.34 -0.49 3.70 0.62 0.00 0.35 -4.93 105.19 105.78 2bui n GLY 29 Ca 0.13 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -5.51 4.49 0.32 1.61 3.52 -0.44 -5.00 118.95 117.95 2bui s ARG 30 Ca 0.22 1.39 -0.27 0.00 -0.13 0.00 0.00 55.73 56.95 2bui s ARG 30 Cb -0.10 -3.50 -0.09 0.00 -1.56 0.00 0.00 34.95 29.70 2bui s ARG 30 CO 0.27 -0.17 1.01 0.45 -0.81 0.00 0.00 175.30 176.05 2bui s SER 31 N 1.05 7.20 -0.11 -2.12 0.15 -1.26 -4.80 113.70 113.80 2bui s SER 31 Ca 0.50 2.00 0.15 0.00 0.70 0.00 0.00 55.95 59.30 2bui s SER 31 Cb -0.20 -2.60 0.48 0.00 -1.71 0.00 0.00 66.02 62.00 2bui s SER 31 CO 0.23 -0.18 1.40 0.61 1.20 0.00 0.00 173.24 176.50 2bui n GLY 32 N 0.76 3.43 3.78 9.45 0.00 0.29 -4.96 105.19 117.94 2bui n GLY 32 Ca 0.02 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.09 5.11 0.22 -0.61 -1.09 -1.26 -3.93 121.20 117.56 2bui s ILE 33 Ca 0.37 0.85 0.01 0.00 -2.23 0.00 0.00 60.65 59.64 2bui s ILE 33 Cb 0.27 -3.74 -0.05 0.00 -1.58 0.00 0.00 42.46 37.36 2bui s ILE 33 CO 0.13 0.47 0.08 0.42 -1.23 0.00 0.00 174.94 174.82 2bui s THR 34 N -0.33 0.43 0.23 2.92 -4.23 -0.41 -4.26 115.64 109.98 2bui s THR 34 Ca 0.24 -1.99 -0.30 0.00 -1.18 0.00 0.00 61.69 58.46 2bui s THR 34 Cb -0.16 -2.48 -0.09 0.00 1.34 0.00 0.00 72.50 71.12 2bui s THR 34 CO 0.11 -0.12 1.10 0.12 -0.54 0.00 0.00 174.62 175.30 2bui s PHE 35 N -3.84 3.59 -0.30 3.99 5.36 -1.26 -1.59 117.98 123.92 2bui s PHE 35 Ca 0.35 1.64 0.01 0.00 -0.96 0.00 0.00 56.93 57.97 2bui s PHE 35 Cb 0.07 -3.28 0.07 0.00 -0.34 0.00 0.00 43.02 39.54 2bui s PHE 35 CO 0.11 -0.60 -0.02 0.45 -1.46 0.00 0.00 175.22 173.70 2bui s SER 36 N -0.47 4.72 0.37 6.13 0.15 0.26 -4.89 113.70 119.97 2bui s SER 36 Ca 0.47 -1.58 0.08 0.00 0.70 0.00 0.00 55.95 55.63 2bui s SER 36 Cb -0.31 -1.64 0.74 0.00 -1.71 0.00 0.00 66.02 63.10 2bui s SER 36 CO 0.38 -0.28 1.90 -0.61 1.20 0.00 0.00 173.24 175.83 2bui h GLN 37 N 7.83 0.30 -0.33 5.44 5.75 -1.95 -2.41 115.11 129.73 2bui h GLN 37 Ca -0.16 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.27 2bui h GLN 37 Cb 1.04 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.54 2bui h GLN 37 CO 0.51 0.42 0.18 1.49 -2.65 0.00 0.00 178.83 178.79 2bui h GLU 38 N 0.29 0.47 -0.61 1.69 4.81 -1.96 0.22 114.58 119.48 2bui h GLU 38 Ca 0.06 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 2bui h GLU 38 Cb 0.37 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 2bui h GLU 38 CO 0.02 0.39 0.09 -0.07 -0.73 0.00 0.00 179.01 178.71 2bui h LEU 39 N 0.42 0.97 -0.47 1.64 3.38 -1.82 -1.84 115.31 117.59 2bui h LEU 39 Ca 0.12 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 2bui h LEU 39 Cb 0.06 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2bui h LEU 39 CO -0.02 0.99 0.12 0.50 0.09 0.00 0.00 178.44 180.13 2bui h LYS 40 N 0.92 0.75 0.00 1.13 3.64 -1.14 -2.52 116.57 119.35 2bui h LYS 40 Ca 0.18 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2bui h LYS 40 Cb 0.44 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2bui h LYS 40 CO 0.01 0.73 -0.10 -0.44 -2.27 0.00 0.00 179.45 177.38 2bui h ASP 41 N 0.63 0.00 1.17 4.20 3.32 -0.38 -1.82 116.42 123.55 2bui h ASP 41 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2bui h ASP 41 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2bui h ASP 41 CO -0.00 0.10 0.00 0.77 -1.72 0.00 0.00 179.24 178.39 2bui h SER 42 N 0.00 0.00 0.00 6.45 4.64 -0.89 -3.46 113.55 120.28 2bui h SER 42 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bui h SER 42 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2bui h SER 42 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 2bui n GLY 43 N 0.40 1.02 3.89 -0.77 0.00 -0.68 -5.10 105.19 103.94 2bui n GLY 43 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.56 2.72 -0.08 1.61 -1.94 -1.13 -5.00 119.30 114.92 2bui s MET 44 Ca 0.00 0.36 0.01 0.00 -1.71 0.00 0.00 55.69 54.35 2bui s MET 44 Cb 0.00 -2.03 -0.25 0.00 2.01 0.00 0.00 34.83 34.56 2bui s MET 44 CO 0.00 -1.10 0.53 0.00 -0.01 0.00 0.00 175.02 174.45 2bui h ARG 45 N -0.68 0.17 -6.06 2.03 3.08 -1.94 -3.44 114.38 107.53 2bui h ARG 45 Ca -0.45 -0.29 -0.57 0.00 0.07 0.00 0.00 59.98 58.74 2bui h ARG 45 Cb 1.27 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 31.37 2bui h ARG 45 CO 0.64 0.94 0.54 0.45 -1.07 0.00 0.00 179.97 181.47 2bui s SER 46 N -6.69 7.07 -0.18 7.04 0.15 -1.26 -4.75 113.70 115.09 2bui s SER 46 Ca -0.14 1.32 0.13 0.00 0.70 0.00 0.00 55.95 57.97 2bui s SER 46 Cb 0.07 -2.50 0.38 0.00 -1.71 0.00 0.00 66.02 62.26 2bui s SER 46 CO 0.80 -0.48 1.20 1.41 1.20 0.00 0.00 173.24 177.37 2bui n HIS 47 N 5.43 0.00 -4.22 3.44 8.25 -1.26 -4.54 115.22 122.32 2bui n HIS 47 Ca 0.07 -1.31 -0.18 0.00 -0.26 0.00 0.00 57.72 56.05 2bui n HIS 47 Cb 0.48 -0.22 -0.13 0.00 1.12 0.00 0.00 29.99 31.25 2bui n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2bui s VAL 48 N -2.98 0.94 0.14 1.59 -7.23 -1.26 -0.57 120.40 111.03 2bui s VAL 48 Ca 0.36 -1.05 -0.19 0.00 -1.81 0.00 0.00 61.98 59.28 2bui s VAL 48 Cb 0.34 -0.90 0.05 0.00 0.56 0.00 0.00 36.38 36.44 2bui s VAL 48 CO -0.05 -0.14 0.49 -1.66 -0.31 0.00 0.00 175.10 173.44 2bui s TRP 49 N -1.04 -0.36 -0.74 2.82 -2.14 -0.62 -4.44 118.94 112.43 2bui s TRP 49 Ca -0.02 0.09 -0.15 0.00 2.66 0.00 0.00 56.10 58.68 2bui s TRP 49 Cb -0.09 0.39 0.18 0.00 -3.10 0.00 0.00 33.47 30.86 2bui s TRP 49 CO 0.01 -0.77 0.71 0.20 -2.66 0.00 0.00 176.95 174.44 2bui s GLY 50 N -2.77 2.39 0.23 3.67 0.00 -0.07 -1.29 107.32 109.48 2bui s GLY 50 Ca 0.02 -2.99 -0.03 0.00 0.00 0.00 0.00 44.72 41.72 2bui s GLY 50 CO -0.12 1.31 0.45 0.54 0.00 0.00 0.00 173.10 175.28 2bui s ASN 51 N 2.77 6.43 -0.27 1.64 6.03 -1.25 -1.42 114.94 128.87 2bui s ASN 51 Ca 0.14 0.56 -0.25 0.00 -1.03 0.00 0.00 52.86 52.28 2bui s ASN 51 Cb -0.17 -2.08 -0.00 0.00 -3.03 0.00 0.00 41.25 35.98 2bui s ASN 51 CO -0.04 -0.09 0.84 -0.69 -2.03 0.00 0.00 177.10 175.09 2bui s VAL 52 N -1.92 4.79 -1.21 3.54 1.01 -1.26 -4.06 120.40 121.29 2bui s VAL 52 Ca 0.41 1.49 -0.15 0.00 0.00 0.00 0.00 61.98 63.73 2bui s VAL 52 Cb -0.11 -4.15 0.14 0.00 0.00 0.00 0.00 36.38 32.26 2bui s VAL 52 CO 0.29 -0.16 1.48 -0.54 0.00 0.00 0.00 175.10 176.17 2bui s LYS 53 N 2.95 4.03 -0.30 2.72 3.01 -1.26 -4.87 119.74 126.02 2bui s LYS 53 Ca 0.35 -2.38 -0.15 0.00 -1.01 0.00 0.00 55.97 52.78 2bui s LYS 53 Cb -0.15 -5.16 0.16 0.00 -1.01 0.00 0.00 37.83 31.67 2bui s LYS 53 CO 0.09 -1.88 0.96 -1.17 0.51 0.00 0.00 175.35 173.86 2bui s LEU 54 N 2.27 -0.60 -0.66 3.17 2.96 -1.26 -4.98 118.68 119.59 2bui s LEU 54 Ca 0.45 0.86 -0.25 0.00 -0.22 0.00 0.00 54.13 54.97 2bui s LEU 54 Cb -0.01 1.74 0.05 0.00 0.50 0.00 0.00 46.19 48.46 2bui s LEU 54 CO 0.01 -0.12 1.09 -0.62 -1.32 0.00 0.00 176.35 175.39 2bui s ASP 55 N 2.17 6.23 0.00 3.68 3.68 -1.26 -4.87 116.67 126.30 2bui s ASP 55 Ca -0.05 -0.56 0.22 0.00 2.13 0.00 0.00 52.55 54.30 2bui s ASP 55 Cb -0.06 -2.49 1.34 0.00 -1.45 0.00 0.00 42.92 40.27 2bui s ASP 55 CO -0.17 -1.54 1.75 0.35 0.13 0.00 0.00 175.17 175.69 2bui n THR 56 N 6.21 0.00 -1.67 1.71 -2.24 -1.26 -4.88 114.28 112.16 2bui n THR 56 Ca 0.01 0.00 -0.47 0.00 -2.27 0.00 0.00 64.05 61.32 2bui n THR 56 Cb 0.47 -0.54 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 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 -0.94 0.15 -0.88 4.28 -1.04 -1.26 -1.80 114.28 112.79 2bui n THR 57 Ca 0.17 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 2bui n THR 57 Cb 0.08 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 66.96 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 3.67 1.15 0.01 3.41 0.00 -1.26 -4.87 105.19 107.30 2bui n GLY 58 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.34 2bui n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bui n LEU 59 N 0.00 0.19 -4.04 0.99 4.77 -0.75 -4.78 117.00 113.38 2bui n LEU 59 Ca 0.00 0.41 -0.21 0.00 -0.03 0.00 0.00 56.01 56.19 2bui n LEU 59 Cb 0.00 -0.43 -0.15 0.00 -2.33 0.00 0.00 43.42 40.51 2bui n LEU 59 CO 0.00 0.00 -0.45 -0.63 -1.33 0.00 0.00 177.39 174.98 2bui s ILE 60 N -3.02 0.88 0.11 -0.08 1.01 -1.26 -5.07 121.20 113.78 2bui s ILE 60 Ca 0.13 -0.44 -0.35 0.00 0.00 0.00 0.00 60.65 59.98 2bui s ILE 60 Cb 0.18 -0.76 -0.17 0.00 0.01 0.00 0.00 42.46 41.72 2bui s ILE 60 CO 0.57 0.26 1.21 -0.67 0.00 0.00 0.00 174.94 176.32 2bui n ASP 61 N 3.06 1.25 -0.32 3.58 4.64 -1.26 -4.61 116.55 122.89 2bui n ASP 61 Ca -0.16 1.13 0.02 0.00 -1.38 0.00 0.00 54.79 54.40 2bui n ASP 61 Cb 0.55 -1.16 0.16 0.00 -1.04 0.00 0.00 41.12 39.62 2bui n ASP 61 CO 0.00 0.00 0.00 -0.09 -0.82 0.00 0.00 177.20 176.29 2bui h ARG 62 N 3.79 0.94 0.00 -0.67 1.12 -1.97 0.28 114.38 117.88 2bui h ARG 62 Ca -0.46 -0.06 0.00 0.00 -1.11 0.00 0.00 59.98 58.36 2bui h ARG 62 Cb 1.35 -0.21 0.00 0.00 -0.01 0.00 0.00 29.97 31.10 2bui h ARG 62 CO 0.73 0.62 0.00 -0.22 -3.11 0.00 0.00 179.97 177.99 2bui h LYS 63 N 0.97 0.00 0.00 0.20 1.63 -2.02 -2.36 116.57 115.00 2bui h LYS 63 Ca 0.39 0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.84 2bui h LYS 63 Cb 0.22 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.79 2bui h LYS 63 CO -0.19 0.00 -2.23 0.28 -3.45 0.00 0.00 179.45 173.86 2bui n VAL 64 N -2.55 1.21 0.52 2.00 0.31 0.44 -4.54 118.33 115.72 2bui n VAL 64 Ca -0.01 -0.35 0.07 0.00 -0.01 0.00 0.00 64.34 64.04 2bui n VAL 64 Cb 0.10 -1.65 0.32 0.00 -0.91 0.00 0.00 33.84 31.70 2bui n VAL 64 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2bui n VAL 65 N -3.76 0.96 0.22 2.52 3.14 0.70 -2.84 118.33 119.27 2bui n VAL 65 Ca -0.42 0.24 0.07 0.00 -2.96 0.00 0.00 64.34 61.27 2bui n VAL 65 Cb 0.83 -0.98 0.51 0.00 -1.06 0.00 0.00 33.84 33.14 2bui n VAL 65 CO 0.00 0.00 0.00 0.08 -6.46 0.00 0.00 176.83 170.45 2bui h ARG 66 N 0.00 0.00 -0.01 1.45 0.11 -1.65 -2.21 114.38 112.07 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 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 2bui h ARG 66 CO 0.00 0.24 -0.21 1.19 0.10 0.00 0.00 179.97 181.29 2bui n PHE 67 N -3.95 0.00 -3.87 4.08 3.01 -1.13 -4.86 117.46 110.73 2bui n PHE 67 Ca -0.02 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.13 2bui n PHE 67 Cb 0.32 -0.11 -0.04 0.00 -0.01 0.00 0.00 39.48 39.64 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 -2.43 3.47 0.42 -1.08 -1.94 -0.83 -3.17 119.30 113.75 2bui s MET 68 Ca 0.27 -0.36 0.08 0.00 -1.71 0.00 0.00 55.69 53.96 2bui s MET 68 Cb 0.20 -3.02 -0.02 0.00 2.01 0.00 0.00 34.83 34.00 2bui s MET 68 CO 0.49 0.60 0.39 -1.54 -0.01 0.00 0.00 175.02 174.94 2bui s SER 69 N -2.40 5.05 0.22 3.03 1.04 -1.26 -4.91 113.70 114.46 2bui s SER 69 Ca 0.35 -0.75 -0.09 0.00 0.48 0.00 0.00 55.95 55.94 2bui s SER 69 Cb -0.13 -0.54 0.32 0.00 0.10 0.00 0.00 66.02 65.77 2bui s SER 69 CO 0.26 -0.67 1.72 0.44 0.98 0.00 0.00 173.24 175.96 2bui h ASP 70 N 1.00 0.10 -0.74 7.02 3.32 -1.94 -0.85 116.42 124.33 2bui h ASP 70 Ca -0.41 0.10 0.12 0.00 0.02 0.00 0.00 57.03 56.87 2bui h ASP 70 Cb 1.27 0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.85 2bui h ASP 70 CO 0.57 0.05 0.32 0.00 -1.72 0.00 0.00 179.24 178.46 2bui h ALA 71 N 1.48 1.03 -0.46 3.45 0.00 -1.86 0.79 119.26 123.70 2bui h ALA 71 Ca 0.33 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.22 2bui h ALA 71 Cb 0.48 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2bui h ALA 71 CO -0.38 -0.15 -0.16 0.77 0.00 0.00 0.00 179.25 179.33 2bui h SER 72 N 0.51 0.88 0.13 0.00 0.02 -1.56 -2.52 113.55 111.00 2bui h SER 72 Ca 0.39 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2bui h SER 72 Cb 0.53 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2bui h SER 72 CO -0.35 1.03 -0.06 0.40 -1.14 0.00 0.00 176.83 176.71 2bui h ILE 73 N 0.77 0.95 -0.59 3.27 2.04 0.16 -0.15 117.51 123.97 2bui h ILE 73 Ca 0.12 -0.32 0.07 0.00 1.00 0.00 0.00 64.86 65.73 2bui h ILE 73 Cb 0.68 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.86 2bui h ILE 73 CO 0.05 0.08 0.28 1.88 0.00 0.00 0.00 178.15 180.44 2bui h TYR 74 N -0.32 0.51 -0.67 1.37 0.05 -0.88 -0.93 116.97 116.09 2bui h TYR 74 Ca -0.02 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.71 2bui h TYR 74 Cb 0.26 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.83 2bui h TYR 74 CO -0.02 0.21 0.11 0.00 -1.05 0.00 0.00 178.16 177.41 2bui h ALA 75 N 1.35 0.93 0.18 3.88 0.00 -1.37 -1.58 119.26 122.64 2bui h ALA 75 Ca 0.28 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bui h ALA 75 Cb 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2bui h ALA 75 CO -0.22 0.67 -0.12 0.35 0.00 0.00 0.00 179.25 179.93 2bui h PHE 76 N 1.04 -0.31 -0.85 0.00 3.57 -0.13 0.13 116.94 120.38 2bui h PHE 76 Ca 0.21 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.71 2bui h PHE 76 Cb 0.43 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.25 2bui h PHE 76 CO 0.03 -0.19 0.56 -0.07 -2.23 0.00 0.00 178.31 176.42 2bui h LEU 77 N -0.30 0.97 -0.76 0.59 3.38 -1.13 -1.38 115.31 116.69 2bui h LEU 77 Ca -0.01 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.95 2bui h LEU 77 Cb 0.26 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 2bui h LEU 77 CO 0.01 0.70 0.50 0.28 0.09 0.00 0.00 178.44 180.02 2bui h SER 78 N 1.15 0.85 -0.60 -0.43 0.02 -0.83 -2.31 113.55 111.40 2bui h SER 78 Ca 0.31 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.17 2bui h SER 78 Cb -0.12 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 2bui h SER 78 CO -0.07 0.60 0.07 -0.03 -1.14 0.00 0.00 176.83 176.26 2bui h MET 79 N 1.00 1.03 -0.92 3.45 1.85 -0.03 -1.13 114.93 120.18 2bui h MET 79 Ca 0.29 -0.28 0.03 0.00 -0.61 0.00 0.00 59.70 59.13 2bui h MET 79 Cb -0.07 -0.12 -0.05 0.00 0.43 0.00 0.00 31.60 31.79 2bui h MET 79 CO -0.08 0.96 0.60 0.93 -0.40 0.00 0.00 176.91 178.92 2bui h GLU 80 N 0.96 1.13 0.03 0.39 5.08 -0.77 0.31 114.58 121.71 2bui h GLU 80 Ca 0.19 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2bui h GLU 80 Cb 0.45 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2bui h GLU 80 CO 0.02 0.75 -0.02 1.96 -1.00 0.00 0.00 179.01 180.72 2bui h GLN 81 N 1.16 -0.04 -0.97 2.33 4.20 -0.91 -2.45 115.11 118.43 2bui h GLN 81 Ca 0.37 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.09 2bui h GLN 81 Cb -0.00 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.74 2bui h GLN 81 CO -0.12 0.10 0.64 0.00 -0.67 0.00 0.00 178.83 178.78 2bui h ALA 82 N 0.78 1.30 -0.26 3.87 0.00 -0.71 0.36 119.26 124.61 2bui h ALA 82 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2bui h ALA 82 Cb 0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2bui h ALA 82 CO 0.01 0.65 0.14 0.82 0.00 0.00 0.00 179.25 180.86 2bui h ILE 83 N 1.32 1.12 -0.39 0.00 2.04 -0.87 0.15 117.51 120.88 2bui h ILE 83 Ca 0.35 -0.33 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 2bui h ILE 83 Cb -0.15 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 2bui h ILE 83 CO -0.08 0.12 -0.10 0.00 0.00 0.00 0.00 178.15 178.10 2bui h ALA 84 N 1.02 0.54 -0.11 1.87 0.00 -0.99 -0.98 119.26 120.61 2bui h ALA 84 Ca 0.09 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 2bui h ALA 84 Cb 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2bui h ALA 84 CO -0.01 0.40 -0.11 0.22 0.00 0.00 0.00 179.25 179.75 2bui h ASP 85 N 0.56 0.15 1.38 0.00 3.58 -0.05 -0.91 116.42 121.12 2bui h ASP 85 Ca 0.10 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.52 2bui h ASP 85 Cb 0.62 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2bui h ASP 85 CO 0.04 0.28 -0.23 0.00 -2.88 0.00 0.00 179.24 176.45 2bui h ALA 86 N 1.74 0.86 -2.49 -0.78 0.00 -0.47 -3.44 119.26 114.67 2bui h ALA 86 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2bui h ALA 86 Cb 0.29 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.13 2bui h ALA 86 CO 0.02 0.00 -0.23 0.41 0.00 0.00 0.00 179.25 179.45 2bui n GLY 87 N 1.27 0.39 3.58 0.00 0.00 -0.35 -4.78 105.19 105.30 2bui n GLY 87 Ca 0.04 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.07 4.11 0.64 0.99 1.43 -0.69 -5.04 118.68 117.04 2bui s LEU 88 Ca 0.18 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.13 2bui s LEU 88 Cb -0.08 -2.16 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2bui s LEU 88 CO 0.22 -0.10 1.04 -0.94 0.23 0.00 0.00 176.35 176.80 2bui s SER 89 N 1.74 5.93 0.18 2.29 1.04 -1.26 -4.74 113.70 118.88 2bui s SER 89 Ca 0.08 1.27 -0.17 0.00 0.48 0.00 0.00 55.95 57.61 2bui s SER 89 Cb -0.16 -2.24 0.13 0.00 0.10 0.00 0.00 66.02 63.85 2bui s SER 89 CO 0.11 -1.03 1.64 -0.65 0.98 0.00 0.00 173.24 174.29 2bui h PRO 90 N -0.41 -0.05 0.00 4.02 0.11 -1.99 0.52 132.00 134.20 2bui h PRO 90 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2bui h PRO 90 Cb 1.22 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2bui h PRO 90 CO 0.63 -0.03 0.00 1.05 -0.21 0.00 0.00 178.00 179.43 2bui h GLU 91 N -0.05 0.00 0.00 1.05 9.09 -1.93 0.80 114.58 123.54 2bui h GLU 91 Ca 0.22 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.43 2bui h GLU 91 Cb 0.39 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.46 2bui h GLU 91 CO -0.49 0.00 -0.97 0.00 0.05 0.00 0.00 179.01 177.59 2bui h ALA 92 N 2.00 0.46 0.00 1.06 0.00 -1.25 -3.40 119.26 118.14 2bui h ALA 92 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2bui h ALA 92 Cb 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2bui h ALA 92 CO 0.00 1.14 0.00 2.48 0.00 0.00 0.00 179.25 182.87 2bui n TYR 93 N -3.28 0.00 -3.20 0.00 0.18 -0.89 -4.98 117.16 105.00 2bui n TYR 93 Ca -0.01 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.47 2bui n TYR 93 Cb 0.90 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.83 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 -0.69 3.70 -1.50 -3.48 -0.21 0.22 -4.19 119.66 113.52 2bui s GLN 94 Ca 0.00 0.19 -0.16 0.00 0.02 0.00 0.00 55.36 55.41 2bui s GLN 94 Cb 0.00 -2.56 0.15 0.00 1.00 0.00 0.00 33.01 31.59 2bui s GLN 94 CO 0.00 0.15 0.60 0.09 -2.12 0.00 0.00 175.29 174.01 2bui n ASN 95 N -0.94 -2.81 -4.04 5.90 3.02 0.38 -4.87 115.26 111.90 2bui n ASN 95 Ca -0.00 -0.79 -0.32 0.00 -0.03 0.00 0.00 54.58 53.45 2bui n ASN 95 Cb 0.54 -2.35 -0.15 0.00 -0.61 0.00 0.00 39.78 37.20 2bui n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2bui s ASN 96 N -3.02 4.18 0.25 6.41 3.84 -1.26 -4.94 114.94 120.40 2bui s ASN 96 Ca 0.62 -1.28 0.16 0.00 0.21 0.00 0.00 52.86 52.58 2bui s ASN 96 Cb -0.35 -1.44 0.89 0.00 -0.55 0.00 0.00 41.25 39.80 2bui s ASN 96 CO 0.77 -0.19 1.49 -0.81 -2.79 0.00 0.00 177.10 175.57 2bui n PRO 97 N 4.51 0.11 -0.15 0.43 -0.04 -1.26 -1.02 135.00 137.57 2bui n PRO 97 Ca -0.14 0.60 0.09 0.00 -0.04 0.00 0.00 63.50 64.02 2bui n PRO 97 Cb 0.43 -1.87 0.28 0.00 -0.04 0.00 0.00 33.50 32.30 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 -2.07 1.97 -4.05 0.54 5.12 -1.26 -3.97 116.66 112.94 2bui n ARG 98 Ca -0.01 -1.48 -0.31 0.00 -1.93 0.00 0.00 57.85 54.12 2bui n ARG 98 Cb 0.04 -1.40 -0.16 0.00 -1.16 0.00 0.00 32.46 29.79 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 -1.60 1.80 0.18 1.55 1.01 -0.19 -0.83 120.40 122.32 2bui s VAL 99 Ca 0.32 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.39 2bui s VAL 99 Cb 0.18 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.83 2bui s VAL 99 CO 0.25 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2bui n GLY 100 N 4.67 3.96 3.26 4.51 0.00 0.33 -0.16 105.19 121.76 2bui n GLY 100 Ca -0.17 -2.26 -0.09 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.42 -0.22 0.99 0.20 0.78 -1.76 118.68 118.25 2bui s LEU 101 Ca 0.00 0.94 -0.01 0.00 0.69 0.00 0.00 54.13 55.75 2bui s LEU 101 Cb 0.00 1.32 0.06 0.00 -0.43 0.00 0.00 46.19 47.14 2bui s LEU 101 CO 0.00 -0.22 -0.02 -0.63 -0.29 0.00 0.00 176.35 175.20 2bui s ILE 102 N 2.13 1.13 -0.18 6.68 1.01 -0.65 -2.88 121.20 128.44 2bui s ILE 102 Ca -0.05 -0.96 -0.25 0.00 0.00 0.00 0.00 60.65 59.39 2bui s ILE 102 Cb -0.11 -1.50 0.06 0.00 0.01 0.00 0.00 42.46 40.93 2bui s ILE 102 CO -0.13 -0.15 0.65 0.00 0.00 0.00 0.00 174.94 175.32 2bui s ALA 103 N 1.58 -1.63 0.00 9.38 0.00 -1.11 -2.95 121.76 127.03 2bui s ALA 103 Ca -0.04 1.64 0.00 0.00 0.00 0.00 0.00 51.96 53.56 2bui s ALA 103 Cb -0.18 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.20 2bui s ALA 103 CO -0.07 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2bui n GLY 104 N 2.16 3.41 3.20 0.00 0.00 -1.14 -3.26 105.19 109.55 2bui n GLY 104 Ca -0.16 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.45 0.70 0.00 1.61 1.04 -1.26 -2.20 113.70 113.15 2bui s SER 105 Ca 0.00 -1.22 -0.16 0.00 0.48 0.00 0.00 55.95 55.05 2bui s SER 105 Cb 0.00 0.23 -0.34 0.00 0.10 0.00 0.00 66.02 66.00 2bui s SER 105 CO 0.00 -0.68 0.91 1.23 0.98 0.00 0.00 173.24 175.68 2bui h GLY 106 N 2.75 0.55 -0.25 7.32 0.00 -1.80 -3.40 103.07 108.24 2bui h GLY 106 Ca -0.36 -1.42 0.00 0.00 0.00 0.00 0.00 47.33 45.55 2bui h GLY 106 CO 0.60 1.24 0.00 0.61 0.00 0.00 0.00 176.54 178.99 2bui n GLY 107 N 1.75 2.19 7.00 4.60 0.00 -1.26 -4.71 105.19 114.75 2bui n GLY 107 Ca -0.19 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.21 1.98 2.58 -0.02 0.00 -1.26 -3.93 105.19 104.32 2bui n GLY 108 Ca 0.02 0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 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 1.13 0.27 1.61 0.15 -1.25 -4.68 113.70 106.93 2bui s SER 109 Ca 0.00 -2.27 -0.02 0.00 0.70 0.00 0.00 55.95 54.36 2bui s SER 109 Cb 0.00 0.24 0.41 0.00 -1.71 0.00 0.00 66.02 64.96 2bui s SER 109 CO 0.00 -0.20 1.88 -0.65 1.20 0.00 0.00 173.24 175.47 2bui h PRO 110 N 6.20 1.14 -0.04 5.44 0.11 -1.91 -1.69 132.00 141.24 2bui h PRO 110 Ca 0.14 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 66.22 2bui h PRO 110 Cb 1.00 -0.26 -0.05 0.00 0.11 0.00 0.00 31.00 31.80 2bui h PRO 110 CO 0.24 0.75 -0.29 -0.09 -0.21 0.00 0.00 178.00 178.40 2bui h ARG 111 N 1.17 -0.40 0.00 1.05 2.43 -1.95 0.13 114.38 116.81 2bui h ARG 111 Ca 0.44 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 2bui h ARG 111 Cb 0.18 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2bui h ARG 111 CO -0.18 -0.27 0.00 0.74 -1.51 0.00 0.00 179.97 178.75 2bui h PHE 112 N -0.42 0.00 -0.34 2.20 -1.00 -1.85 0.10 116.94 115.63 2bui h PHE 112 Ca 0.07 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.73 2bui h PHE 112 Cb 0.52 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.08 2bui h PHE 112 CO -0.34 0.00 -0.26 1.96 -1.61 0.00 0.00 178.31 178.06 2bui h GLN 113 N 0.00 0.78 -0.06 1.51 4.20 -0.68 -1.87 115.11 119.00 2bui h GLN 113 Ca 0.00 -0.38 -0.21 0.00 0.06 0.00 0.00 58.65 58.12 2bui h GLN 113 Cb 0.69 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 2bui h GLN 113 CO 0.00 1.01 -0.82 0.28 -0.67 0.00 0.00 178.83 178.63 2bui h VAL 114 N 0.56 1.38 -0.40 -0.54 2.07 -0.63 -2.94 116.25 115.74 2bui h VAL 114 Ca 0.06 -2.24 0.03 0.00 0.82 0.00 0.00 66.70 65.37 2bui h VAL 114 Cb 0.83 2.22 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 2bui h VAL 114 CO 0.07 0.68 0.21 0.15 0.02 0.00 0.00 177.57 178.69 2bui h PHE 115 N 0.29 0.38 -0.50 1.57 3.57 -0.72 -0.42 116.94 121.10 2bui h PHE 115 Ca -0.05 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.49 2bui h PHE 115 Cb 1.43 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 40.02 2bui h PHE 115 CO 0.06 0.20 0.29 0.78 -2.23 0.00 0.00 178.31 177.41 2bui h GLY 116 N 0.42 0.71 1.26 2.40 0.00 -1.30 0.12 103.07 106.67 2bui h GLY 116 Ca 0.17 -0.22 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 2bui h GLY 116 CO -0.11 0.18 -0.18 0.00 0.00 0.00 0.00 176.54 176.42 2bui h ALA 117 N 1.23 0.85 -0.12 3.60 0.00 -1.30 -0.57 119.26 122.95 2bui h ALA 117 Ca 0.21 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2bui h ALA 117 Cb 0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bui h ALA 117 CO -0.10 0.64 -0.02 -0.44 0.00 0.00 0.00 179.25 179.33 2bui h ASP 118 N 0.75 0.23 -0.36 0.00 3.45 -0.76 -2.47 116.42 117.26 2bui h ASP 118 Ca 0.11 -0.35 -0.00 0.00 0.43 0.00 0.00 57.03 57.21 2bui h ASP 118 Cb 0.71 -0.06 -0.02 0.00 -0.56 0.00 0.00 39.33 39.40 2bui h ASP 118 CO 0.05 0.53 0.21 0.00 -1.57 0.00 0.00 179.24 178.46 2bui h ALA 119 N 0.71 0.46 -0.58 3.45 0.00 -0.73 -2.71 119.26 119.86 2bui h ALA 119 Ca 0.03 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.92 2bui h ALA 119 Cb 0.42 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2bui h ALA 119 CO 0.01 -0.03 0.38 1.98 0.00 0.00 0.00 179.25 181.59 2bui h MET 120 N 0.47 0.63 -0.08 0.00 1.85 -1.08 -1.00 114.93 115.72 2bui h MET 120 Ca 0.13 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.18 2bui h MET 120 Cb 0.02 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 31.91 2bui h MET 120 CO -0.02 0.42 0.00 0.54 -0.40 0.00 0.00 176.91 177.45 2bui n ARG 121 N -4.47 1.36 -2.51 0.39 1.74 -0.93 -4.22 116.66 108.01 2bui n ARG 121 Ca 0.07 -0.54 -0.20 0.00 -0.77 0.00 0.00 57.85 56.41 2bui n ARG 121 Cb 0.16 -1.34 0.10 0.00 -1.02 0.00 0.00 32.46 30.35 2bui n ARG 121 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bui n GLY 122 N 0.96 1.00 0.21 -0.13 0.00 -0.38 -4.98 105.19 101.86 2bui n GLY 122 Ca 0.15 -2.08 0.15 0.00 0.00 0.00 0.00 46.02 44.24 2bui n GLY 122 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bui h PRO 123 N 0.00 0.00 0.00 1.61 0.13 -1.90 -2.91 132.00 128.93 2bui h PRO 123 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2bui h PRO 123 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2bui h PRO 123 CO 0.33 0.00 -1.87 0.54 -0.23 0.00 0.00 178.00 176.77 2bui n ARG 124 N -2.54 0.61 0.00 0.86 1.74 -1.26 -5.06 116.66 111.01 2bui n ARG 124 Ca -0.01 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 56.90 2bui n ARG 124 Cb 0.11 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 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 1.35 3.20 0.31 -0.13 0.00 -1.10 -2.56 105.19 106.27 2bui n GLY 125 Ca -0.03 -0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.02 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 0.23 -1.47 0.99 3.38 -1.86 0.20 115.31 116.78 2bui h LEU 126 Ca 0.00 0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.24 2bui h LEU 126 Cb 0.00 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 2bui h LEU 126 CO 0.00 -0.09 0.46 0.11 0.09 0.00 0.00 178.44 179.01 2bui h LYS 127 N 0.31 0.59 -0.03 1.13 1.57 -1.89 -1.45 116.57 116.80 2bui h LYS 127 Ca 0.59 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 59.10 2bui h LYS 127 Cb 1.18 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 33.37 2bui h LYS 127 CO -0.59 0.39 -0.91 0.00 -0.57 0.00 0.00 179.45 177.77 2bui h ALA 128 N 1.64 0.34 -0.10 3.86 0.00 -0.74 -3.30 119.26 120.97 2bui h ALA 128 Ca 0.32 -0.68 0.01 0.00 0.00 0.00 0.00 54.91 54.56 2bui h ALA 128 Cb 0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2bui h ALA 128 CO -0.11 0.76 0.02 0.28 0.00 0.00 0.00 179.25 180.21 2bui h VAL 129 N 0.32 0.96 0.00 0.00 2.07 -0.80 -3.48 116.25 115.32 2bui h VAL 129 Ca -0.08 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2bui h VAL 129 Cb 1.54 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2bui h VAL 129 CO 0.17 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.38 2bui n GLY 130 N -1.13 -1.36 2.10 2.17 0.00 -0.89 -4.63 105.19 101.46 2bui n GLY 130 Ca -0.05 -1.59 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.66 3.07 0.00 1.61 -0.04 -1.26 -4.36 135.00 132.36 2bui n PRO 131 Ca 0.00 -3.00 0.00 0.00 -0.04 0.00 0.00 63.50 60.46 2bui n PRO 131 Cb 0.00 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 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 -0.56 0.00 0.06 0.54 4.01 -1.26 -4.78 117.16 115.16 2bui n TYR 132 Ca 0.49 -0.29 -0.09 0.00 -0.16 0.00 0.00 57.90 57.85 2bui n TYR 132 Cb 1.51 -0.03 0.05 0.00 -0.31 0.00 0.00 39.34 40.55 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 0.39 1.38 0.01 -0.72 2.07 -1.82 -3.21 116.25 114.34 2bui h VAL 133 Ca 0.00 -2.11 -0.00 0.00 0.82 0.00 0.00 66.70 65.41 2bui h VAL 133 Cb 0.43 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2bui h VAL 133 CO 0.00 0.63 -0.00 0.58 0.02 0.00 0.00 177.57 178.80 2bui h VAL 134 N 0.25 1.11 0.00 2.57 2.07 -1.92 -0.40 116.25 119.93 2bui h VAL 134 Ca -0.02 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 2bui h VAL 134 Cb 1.26 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2bui h VAL 134 CO 0.12 0.09 -0.16 0.71 0.02 0.00 0.00 177.57 178.34 2bui h THR 135 N -0.15 0.65 0.24 2.57 1.35 -1.82 0.35 112.91 116.09 2bui h THR 135 Ca -0.00 -0.70 -0.33 0.00 -0.55 0.00 0.00 66.41 64.83 2bui h THR 135 Cb 0.15 1.44 0.03 0.00 -1.73 0.00 0.00 68.15 68.05 2bui h THR 135 CO 0.00 0.16 -1.46 0.11 -0.25 0.00 0.00 175.52 174.08 2bui h LYS 136 N 0.00 0.50 0.00 4.72 1.57 -1.45 -3.39 116.57 118.52 2bui h LYS 136 Ca -0.00 -0.86 -0.14 0.00 -1.87 0.00 0.00 60.65 57.78 2bui h LYS 136 Cb 0.43 0.32 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 2bui h LYS 136 CO 0.02 1.41 -1.53 0.00 -0.57 0.00 0.00 179.45 178.79 2bui n ALA 137 N -2.69 2.10 -1.68 3.86 0.00 -0.18 -4.20 120.51 117.71 2bui n ALA 137 Ca -0.16 -0.57 -0.39 0.00 0.00 0.00 0.00 53.44 52.32 2bui n ALA 137 Cb 1.10 -0.87 0.04 0.00 0.00 0.00 0.00 19.45 19.72 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 -2.76 1.36 0.00 0.00 0.00 0.10 -3.75 117.12 112.07 2bui n MET 138 Ca -0.10 0.51 0.12 0.00 0.00 0.00 0.00 57.70 58.23 2bui n MET 138 Cb 0.79 -2.37 0.55 0.00 0.00 0.00 0.00 33.22 32.19 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 1.10 2.08 -0.36 3.17 0.00 -1.93 -1.70 119.26 121.62 2bui h ALA 139 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2bui h ALA 139 Cb 1.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2bui h ALA 139 CO 0.55 -0.18 0.00 -1.13 0.00 0.00 0.00 179.25 178.49 2bui n SER 140 N -4.46 2.60 -0.23 0.00 3.41 -1.26 -4.46 113.62 109.22 2bui n SER 140 Ca 0.07 -2.18 0.02 0.00 -0.26 0.00 0.00 58.87 56.52 2bui n SER 140 Cb 0.34 -0.38 0.12 0.00 -0.26 0.00 0.00 64.21 64.02 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 4.91 0.71 0.27 5.00 0.00 -1.51 0.19 103.07 112.63 2bui h GLY 141 Ca 0.00 0.11 0.13 0.00 0.00 0.00 0.00 47.33 47.56 2bui h GLY 141 CO 0.09 -0.24 0.35 -2.08 0.00 0.00 0.00 176.54 174.66 2bui h VAL 142 N 0.10 0.73 0.16 4.60 2.07 -1.85 0.11 116.25 122.18 2bui h VAL 142 Ca 0.36 -0.18 -0.32 0.00 0.82 0.00 0.00 66.70 67.38 2bui h VAL 142 Cb 0.59 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2bui h VAL 142 CO -0.60 0.10 -1.50 0.77 0.02 0.00 0.00 177.57 176.35 2bui h SER 143 N 0.53 0.54 -0.53 0.57 4.64 -1.28 -3.29 113.55 114.74 2bui h SER 143 Ca 0.40 -0.68 -0.12 0.00 -0.47 0.00 0.00 61.79 60.93 2bui h SER 143 Cb 0.55 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2bui h SER 143 CO -0.35 1.55 -0.15 0.00 -0.87 0.00 0.00 176.83 177.01 2bui h ALA 144 N 0.37 0.74 0.00 5.18 0.00 -0.74 -0.56 119.26 124.25 2bui h ALA 144 Ca -0.24 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2bui h ALA 144 Cb 2.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2bui h ALA 144 CO 0.20 0.68 0.00 0.00 0.00 0.00 0.00 179.25 180.13 2bui n LEU 146 N -1.26 2.77 -0.30 0.00 4.32 -1.12 -4.47 117.00 116.95 2bui n LEU 146 Ca 0.12 -0.03 -0.02 0.00 -0.02 0.00 0.00 56.01 56.06 2bui n LEU 146 Cb 0.18 -0.33 0.15 0.00 -1.62 0.00 0.00 43.42 41.80 2bui n LEU 146 CO 0.18 0.62 1.22 0.00 -1.22 0.00 0.00 177.39 178.19 2bui h ALA 147 N -0.04 1.30 0.34 -1.18 0.00 -1.18 -1.94 119.26 116.56 2bui h ALA 147 Ca -0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2bui h ALA 147 Cb 1.32 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2bui h ALA 147 CO -0.05 0.61 -0.16 1.15 0.00 0.00 0.00 179.25 180.80 2bui h THR 148 N 1.20 0.57 0.00 0.00 2.02 -1.78 -0.84 112.91 114.08 2bui h THR 148 Ca 0.31 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.77 2bui h THR 148 Cb -0.06 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2bui h THR 148 CO -0.06 0.11 -0.28 1.55 0.37 0.00 0.00 175.52 177.20 2bui h PRO 149 N -0.88 0.00 -0.22 6.66 0.13 -1.78 -2.66 132.00 133.26 2bui h PRO 149 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2bui h PRO 149 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2bui h PRO 149 CO 0.08 0.28 0.00 1.19 -0.23 0.00 0.00 178.00 179.32 2bui n PHE 150 N -3.76 0.29 -3.51 1.56 3.01 -0.73 -4.91 117.46 109.41 2bui n PHE 150 Ca -0.01 -0.14 -0.26 0.00 1.01 0.00 0.00 57.45 58.05 2bui n PHE 150 Cb 0.38 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.89 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 0.14 -5.56 -2.45 -1.08 4.01 -1.00 -4.64 118.16 107.57 2bui n LYS 151 Ca 0.08 0.71 -0.42 0.00 -0.51 0.00 0.00 58.31 58.17 2bui n LYS 151 Cb 0.19 -5.61 -0.03 0.00 -0.51 0.00 0.00 35.03 29.08 2bui n LYS 151 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2bui s ILE 152 N -3.21 4.17 -0.46 -0.18 -1.09 -0.33 -0.47 121.20 119.62 2bui s ILE 152 Ca 0.51 1.54 0.10 0.00 -2.23 0.00 0.00 60.65 60.57 2bui s ILE 152 Cb -0.24 -3.99 -0.12 0.00 -1.58 0.00 0.00 42.46 36.53 2bui s ILE 152 CO 0.63 0.07 0.43 1.41 -1.23 0.00 0.00 174.94 176.25 2bui n HIS 153 N 4.40 0.00 0.00 3.97 8.25 -1.24 -4.85 115.22 125.75 2bui n HIS 153 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2bui n HIS 153 Cb 0.47 -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 1.28 1.06 3.77 -1.41 0.00 0.77 -4.56 105.19 106.10 2bui n GLY 154 Ca 0.02 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 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 1.11 3.04 -0.28 1.61 -7.23 -1.26 -4.84 120.40 112.55 2bui s VAL 155 Ca 0.00 0.65 0.02 0.00 -1.81 0.00 0.00 61.98 60.84 2bui s VAL 155 Cb 0.00 -3.26 0.17 0.00 0.56 0.00 0.00 36.38 33.84 2bui s VAL 155 CO 0.00 -0.14 0.45 0.21 -0.31 0.00 0.00 175.10 175.31 2bui s ASN 156 N -1.72 -0.11 0.06 4.85 2.47 -1.25 -0.15 114.94 119.09 2bui s ASN 156 Ca 0.74 -0.11 -0.27 0.00 0.42 0.00 0.00 52.86 53.64 2bui s ASN 156 Cb -0.25 1.34 0.09 0.00 -1.45 0.00 0.00 41.25 40.98 2bui s ASN 156 CO 0.28 -0.33 1.17 -0.72 -3.72 0.00 0.00 177.10 173.78 2bui s TYR 157 N 2.62 -0.02 -0.01 0.43 1.13 -1.14 -5.01 117.35 115.34 2bui s TYR 157 Ca 0.11 -0.19 0.07 0.00 -1.41 0.00 0.00 57.07 55.66 2bui s TYR 157 Cb -0.13 0.60 -0.02 0.00 -1.10 0.00 0.00 41.96 41.31 2bui s TYR 157 CO -0.27 -0.53 -0.24 -1.12 -2.51 0.00 0.00 175.55 170.89 2bui s SER 158 N -3.22 3.29 -0.13 -0.18 0.01 -1.26 -2.73 113.70 109.48 2bui s SER 158 Ca 0.18 -0.44 -0.05 0.00 1.31 0.00 0.00 55.95 56.95 2bui s SER 158 Cb 0.01 -0.43 -0.04 0.00 0.21 0.00 0.00 66.02 65.77 2bui s SER 158 CO -0.00 0.31 0.05 -0.63 0.41 0.00 0.00 173.24 173.38 2bui s ILE 159 N -0.69 4.75 -0.06 1.44 1.01 -1.26 -4.94 121.20 121.45 2bui s ILE 159 Ca 0.11 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.71 2bui s ILE 159 Cb -0.10 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.32 2bui s ILE 159 CO 0.00 0.56 -0.10 -0.55 0.00 0.00 0.00 174.94 174.85 2bui s SER 160 N -0.49 1.53 -0.40 3.58 0.15 -1.26 -4.20 113.70 112.59 2bui s SER 160 Ca 0.10 -0.25 0.09 0.00 0.70 0.00 0.00 55.95 56.60 2bui s SER 160 Cb -0.12 -0.71 0.38 0.00 -1.71 0.00 0.00 66.02 63.86 2bui s SER 160 CO 0.02 0.01 1.22 -1.54 1.20 0.00 0.00 173.24 174.15 2bui n SER 161 N 3.88 -1.50 0.00 5.45 3.41 -1.26 -4.92 113.62 118.68 2bui n SER 161 Ca -0.24 -2.84 0.00 0.00 -0.26 0.00 0.00 58.87 55.53 2bui n SER 161 Cb 0.51 1.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.46 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 -0.24 0.00 1.67 7.33 0.00 -1.26 -0.78 120.51 127.22 2bui n ALA 162 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.58 2bui n ALA 162 Cb 0.80 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.93 2bui n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bui n ALA 164 N -0.93 3.20 -0.09 0.00 0.00 0.04 -4.35 120.51 118.37 2bui n ALA 164 Ca 0.17 -0.45 -0.02 0.00 0.00 0.00 0.00 53.44 53.14 2bui n ALA 164 Cb 0.08 -0.46 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.51 -0.15 0.27 0.00 -1.04 -1.09 -1.29 114.28 110.47 2bui n THR 165 Ca 0.05 1.34 0.15 0.00 -2.04 0.00 0.00 64.05 63.54 2bui n THR 165 Cb 0.25 -1.73 0.73 0.00 -1.82 0.00 0.00 70.33 67.76 2bui n THR 165 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2bui h SER 166 N 0.00 0.00 -0.10 8.00 4.64 -1.67 -1.71 113.55 122.72 2bui h SER 166 Ca 0.04 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.30 2bui h SER 166 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2bui h SER 166 CO -0.21 0.09 -0.17 0.00 -0.87 0.00 0.00 176.83 175.68 2bui h ALA 167 N 1.91 0.15 -0.34 5.18 0.00 -1.45 -2.48 119.26 122.23 2bui h ALA 167 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2bui h ALA 167 Cb 0.43 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2bui h ALA 167 CO 0.01 0.06 0.08 0.45 0.00 0.00 0.00 179.25 179.85 2bui h HIS 168 N -0.16 0.50 -0.49 0.00 -0.00 -0.90 -1.21 115.15 112.89 2bui h HIS 168 Ca 0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2bui h HIS 168 Cb 0.74 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 27.97 2bui h HIS 168 CO 0.10 0.45 0.32 0.00 -0.00 0.00 0.00 177.93 178.80 2bui h ILE 170 N 0.66 1.27 -0.47 0.00 2.04 -0.95 -1.87 117.51 118.19 2bui h ILE 170 Ca 0.18 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 2bui h ILE 170 Cb -0.06 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2bui h ILE 170 CO -0.04 0.37 0.23 1.23 0.00 0.00 0.00 178.15 179.95 2bui h GLY 171 N 0.63 0.72 1.18 5.37 0.00 -0.86 -1.31 103.07 108.80 2bui h GLY 171 Ca 0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2bui h GLY 171 CO 0.03 0.34 0.34 -0.57 0.00 0.00 0.00 176.54 176.68 2bui h ASN 172 N 0.62 0.96 -0.72 0.19 -1.24 -0.62 -0.98 115.58 113.78 2bui h ASN 172 Ca 0.16 -0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.06 2bui h ASN 172 Cb 0.11 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 38.88 2bui h ASN 172 CO -0.02 0.82 0.44 0.00 -1.29 0.00 0.00 177.43 177.37 2bui h ALA 173 N 1.33 0.91 -0.58 1.57 0.00 -0.88 -1.05 119.26 120.56 2bui h ALA 173 Ca 0.25 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2bui h ALA 173 Cb 0.12 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2bui h ALA 173 CO -0.03 0.38 0.34 0.28 0.00 0.00 0.00 179.25 180.22 2bui h VAL 174 N 0.98 1.03 -0.83 0.00 2.07 -0.19 -1.43 116.25 117.87 2bui h VAL 174 Ca 0.26 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.59 2bui h VAL 174 Cb -0.04 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 29.99 2bui h VAL 174 CO -0.05 0.12 0.54 -0.33 0.02 0.00 0.00 177.57 177.88 2bui h GLU 175 N 0.66 0.97 -0.65 1.57 5.08 -0.29 0.09 114.58 122.02 2bui h GLU 175 Ca 0.24 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 2bui h GLU 175 Cb 0.07 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2bui h GLU 175 CO -0.12 0.64 0.22 1.96 -1.00 0.00 0.00 179.01 180.71 2bui h GLN 176 N 1.00 0.97 -0.45 2.33 1.08 -0.17 0.76 115.11 120.63 2bui h GLN 176 Ca 0.34 -0.18 -0.14 0.00 -1.45 0.00 0.00 58.65 57.22 2bui h GLN 176 Cb 0.08 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2bui h GLN 176 CO -0.10 0.82 -0.25 0.82 -0.95 0.00 0.00 178.83 179.17 2bui h ILE 177 N 0.94 1.27 -0.07 2.54 1.08 -0.62 -1.69 117.51 120.96 2bui h ILE 177 Ca 0.21 -1.41 -0.11 0.00 -0.39 0.00 0.00 64.86 63.17 2bui h ILE 177 Cb 0.24 1.20 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 2bui h ILE 177 CO -0.01 0.48 -0.44 1.56 -0.69 0.00 0.00 178.15 179.05 2bui h GLN 178 N 0.81 0.15 -0.00 2.37 4.20 -0.47 -2.18 115.11 120.00 2bui h GLN 178 Ca 0.10 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2bui h GLN 178 Cb 0.83 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2bui h GLN 178 CO 0.07 0.57 -0.00 1.28 -0.67 0.00 0.00 178.83 180.08 2bui n LEU 179 N -4.01 0.20 -0.40 1.46 4.77 0.21 -4.51 117.00 114.72 2bui n LEU 179 Ca -0.02 -0.03 -0.05 0.00 -0.03 0.00 0.00 56.01 55.88 2bui n LEU 179 Cb 0.49 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 2bui n LEU 179 CO 0.41 0.03 -0.05 0.61 -1.33 0.00 0.00 177.39 177.07 2bui n GLY 180 N 1.06 0.67 0.16 -0.72 0.00 -0.82 -4.88 105.19 100.66 2bui n GLY 180 Ca 0.22 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.13 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 0.23 0.00 -3.62 1.61 1.57 -1.55 -3.47 116.57 111.34 2bui h LYS 181 Ca -0.11 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.52 2bui h LYS 181 Cb 0.71 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 32.82 2bui h LYS 181 CO 0.16 0.34 -0.54 -0.65 -0.57 0.00 0.00 179.45 178.18 2bui s GLN 182 N -3.04 0.43 -0.12 3.15 -1.52 -1.09 -4.83 119.66 112.66 2bui s GLN 182 Ca 0.04 -0.43 0.17 0.00 -1.95 0.00 0.00 55.36 53.19 2bui s GLN 182 Cb 0.07 0.18 -0.24 0.00 -0.22 0.00 0.00 33.01 32.80 2bui s GLN 182 CO 0.73 -0.10 0.35 -0.25 -0.25 0.00 0.00 175.29 175.77 2bui n ASP 183 N 1.54 0.34 -3.77 5.90 8.00 -0.01 -4.23 116.55 124.32 2bui n ASP 183 Ca -0.23 0.16 -0.13 0.00 0.71 0.00 0.00 54.79 55.31 2bui n ASP 183 Cb 0.56 0.68 -0.12 0.00 -0.02 0.00 0.00 41.12 42.22 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 -2.64 -0.01 -0.09 0.53 1.01 -1.09 -1.20 121.20 117.71 2bui s ILE 184 Ca -0.08 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.58 2bui s ILE 184 Cb 0.07 -0.36 0.05 0.00 0.01 0.00 0.00 42.46 42.23 2bui s ILE 184 CO 0.83 0.02 0.10 -0.69 0.00 0.00 0.00 174.94 175.20 2bui s VAL 185 N 0.42 -0.16 -0.07 2.92 1.01 -0.14 -0.51 120.40 123.86 2bui s VAL 185 Ca -0.02 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 2bui s VAL 185 Cb -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2bui s VAL 185 CO -0.02 0.04 1.16 -0.36 0.00 0.00 0.00 175.10 175.92 2bui s PHE 186 N 2.20 3.25 0.03 5.22 0.40 -0.72 -1.93 117.98 126.43 2bui s PHE 186 Ca 0.04 1.29 0.06 0.00 -0.60 0.00 0.00 56.93 57.72 2bui s PHE 186 Cb -0.13 -3.38 -0.02 0.00 0.51 0.00 0.00 43.02 40.00 2bui s PHE 186 CO -0.06 -1.09 -0.18 0.00 0.70 0.00 0.00 175.22 174.59 2bui s ALA 187 N 2.24 1.51 0.00 5.36 0.00 -0.25 -1.64 121.76 128.98 2bui s ALA 187 Ca 0.54 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2bui s ALA 187 Cb -0.23 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.59 2bui s ALA 187 CO 0.21 0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.71 2bui n GLY 188 N 2.02 -0.50 0.00 0.00 0.00 -1.15 -0.04 105.19 105.51 2bui n GLY 188 Ca -0.17 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.33 3.69 -0.02 0.00 -0.38 -2.89 105.19 104.26 2bui n GLY 189 Ca 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.99 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 0.06 -0.23 -0.02 0.00 -0.93 -0.93 107.32 105.27 2bui s GLY 190 Ca 0.00 -0.41 -0.17 0.00 0.00 0.00 0.00 44.72 44.13 2bui s GLY 190 CO 0.00 -0.27 0.60 1.85 0.00 0.00 0.00 173.10 175.28 2bui s GLU 191 N -3.93 0.65 0.71 2.90 2.56 0.26 -4.19 118.70 117.66 2bui s GLU 191 Ca 0.13 0.96 -0.10 0.00 0.00 0.00 0.00 54.97 55.96 2bui s GLU 191 Cb -0.03 0.21 0.03 0.00 2.00 0.00 0.00 34.13 36.33 2bui s GLU 191 CO 0.04 -0.12 1.08 -1.83 -0.56 0.00 0.00 175.26 173.87 2bui s GLU 192 N 0.96 2.66 -0.20 4.30 -1.05 -1.26 -1.49 118.70 122.62 2bui s GLU 192 Ca -0.05 0.28 0.01 0.00 -0.15 0.00 0.00 54.97 55.06 2bui s GLU 192 Cb -0.05 -2.06 0.04 0.00 -0.44 0.00 0.00 34.13 31.63 2bui s GLU 192 CO -0.09 -1.10 -0.09 -1.17 0.95 0.00 0.00 175.26 173.76 2bui s LEU 193 N -5.34 2.19 0.02 1.83 2.96 -1.26 -4.67 118.68 114.41 2bui s LEU 193 Ca 0.58 -0.88 -0.25 0.00 -0.22 0.00 0.00 54.13 53.36 2bui s LEU 193 Cb -0.11 -1.17 0.06 0.00 0.50 0.00 0.00 46.19 45.47 2bui s LEU 193 CO 0.50 -0.16 0.57 0.00 -1.32 0.00 0.00 176.35 175.94 2bui h TRP 195 N 2.83 0.56 -0.68 0.00 5.08 -1.97 -1.01 115.95 120.76 2bui h TRP 195 Ca -0.30 -0.03 0.12 0.00 1.08 0.00 0.00 58.89 59.76 2bui h TRP 195 Cb 1.20 -0.17 -0.13 0.00 -3.00 0.00 0.00 29.16 27.06 2bui h TRP 195 CO 0.36 0.48 -0.31 0.93 -1.28 0.00 0.00 178.44 178.62 2bui h GLU 196 N 0.55 -0.10 0.21 0.12 3.07 -1.96 0.14 114.58 116.61 2bui h GLU 196 Ca 0.13 0.01 -0.34 0.00 -0.50 0.00 0.00 59.36 58.66 2bui h GLU 196 Cb 0.20 0.02 0.02 0.00 -0.84 0.00 0.00 28.75 28.15 2bui h GLU 196 CO -0.01 -0.07 -1.59 1.98 -1.40 0.00 0.00 179.01 177.92 2bui h MET 197 N -0.11 0.45 -0.54 2.33 -1.53 -1.89 -3.38 114.93 110.27 2bui h MET 197 Ca 0.27 -0.77 0.06 0.00 -3.44 0.00 0.00 59.70 55.82 2bui h MET 197 Cb 0.56 0.29 -0.05 0.00 -0.55 0.00 0.00 31.60 31.84 2bui h MET 197 CO -0.74 1.37 0.25 0.00 0.14 0.00 0.00 176.91 177.93 2bui h ALA 198 N 0.12 0.69 -0.09 0.39 0.00 -0.68 -1.57 119.26 118.11 2bui h ALA 198 Ca -0.30 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.67 2bui h ALA 198 Cb 2.10 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 2bui h ALA 198 CO 0.21 -0.11 0.10 0.00 0.00 0.00 0.00 179.25 179.45 2bui h GLU 200 N 0.00 0.61 0.09 0.00 5.08 -1.45 0.24 114.58 119.14 2bui h GLU 200 Ca 0.04 -0.22 -0.28 0.00 -1.00 0.00 0.00 59.36 57.90 2bui h GLU 200 Cb 0.24 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 29.47 2bui h GLU 200 CO -0.00 0.77 -1.18 0.74 -1.00 0.00 0.00 179.01 178.34 2bui h PHE 201 N 0.54 0.95 -0.64 4.33 0.04 -1.19 -3.16 116.94 117.81 2bui h PHE 201 Ca 0.09 -0.58 -0.05 0.00 2.80 0.00 0.00 57.97 60.22 2bui h PHE 201 Cb 0.63 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 2bui h PHE 201 CO 0.03 1.42 0.18 0.22 -0.60 0.00 0.00 178.31 179.56 2bui h ASP 202 N 0.28 0.93 0.44 2.17 1.82 -1.05 -1.18 116.42 119.83 2bui h ASP 202 Ca -0.16 -0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.31 2bui h ASP 202 Cb 1.84 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 41.61 2bui h ASP 202 CO 0.22 0.88 0.00 0.00 -1.61 0.00 0.00 179.24 178.73 2bui h ALA 203 N 1.24 1.00 -0.43 -0.78 0.00 -0.51 -0.40 119.26 119.38 2bui h ALA 203 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2bui h ALA 203 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2bui h ALA 203 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2bui n MET 204 N -2.83 2.93 -1.28 0.00 0.00 -0.69 -4.97 117.12 110.28 2bui n MET 204 Ca -0.01 -2.31 -0.09 0.00 0.00 0.00 0.00 57.70 55.28 2bui n MET 204 Cb 0.16 -1.43 -0.04 0.00 0.00 0.00 0.00 33.22 31.91 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 0.67 1.08 0.12 3.17 0.00 -0.16 -4.92 105.19 105.15 2bui n GLY 205 Ca 0.16 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 1.00 -2.65 4.61 0.00 -1.47 -3.47 119.26 117.29 2bui h ALA 206 Ca -0.19 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.15 2bui h ALA 206 Cb 0.73 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2bui h ALA 206 CO 0.28 0.00 -0.33 -0.51 0.00 0.00 0.00 179.25 178.69 2bui s LEU 207 N -4.76 4.25 0.26 0.00 1.43 -1.26 -1.47 118.68 117.14 2bui s LEU 207 Ca 0.10 0.48 -0.29 0.00 -1.03 0.00 0.00 54.13 53.39 2bui s LEU 207 Cb 0.11 -3.23 -0.09 0.00 0.03 0.00 0.00 46.19 43.01 2bui s LEU 207 CO 0.60 0.02 1.18 -0.55 0.23 0.00 0.00 176.35 177.82 2bui s SER 208 N -2.76 7.10 0.00 2.29 0.15 -0.81 -4.58 113.70 115.08 2bui s SER 208 Ca 0.39 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.40 2bui s SER 208 Cb -0.12 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2bui s SER 208 CO 0.27 -0.30 0.04 0.35 1.20 0.00 0.00 173.24 174.80 2bui n THR 209 N 1.52 0.00 1.17 6.45 -2.24 -1.26 -4.26 114.28 115.66 2bui n THR 209 Ca 0.01 -0.13 0.12 0.00 -2.27 0.00 0.00 64.05 61.79 2bui n THR 209 Cb 0.44 1.23 0.24 0.00 -2.10 0.00 0.00 70.33 70.14 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 -0.17 1.35 -0.98 -0.78 5.02 -1.26 -4.36 118.16 116.98 2bui n LYS 210 Ca 0.00 -0.97 0.00 0.00 -2.02 0.00 0.00 58.31 55.32 2bui n LYS 210 Cb 0.06 -1.48 0.16 0.00 -0.02 0.00 0.00 35.03 33.75 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 0.02 0.52 0.24 2.13 4.02 -1.26 -4.78 117.16 118.05 2bui n TYR 211 Ca 0.13 -1.56 0.07 0.00 -0.01 0.00 0.00 57.90 56.53 2bui n TYR 211 Cb 0.43 -0.26 0.57 0.00 -0.02 0.00 0.00 39.34 40.06 2bui n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2bui h ASN 212 N 1.25 0.00 1.16 7.72 2.35 -1.93 -1.67 115.58 124.45 2bui h ASN 212 Ca 0.05 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.75 2bui h ASN 212 Cb 1.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 2bui h ASN 212 CO 0.15 0.14 -0.23 0.44 -1.65 0.00 0.00 177.43 176.28 2bui h ASP 213 N 0.00 0.00 -2.40 5.81 3.32 -1.95 -3.33 116.42 117.87 2bui h ASP 213 Ca -0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.45 2bui h ASP 213 Cb 0.26 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.40 2bui h ASP 213 CO 0.02 0.23 -0.77 0.35 -1.72 0.00 0.00 179.24 177.34 2bui n THR 214 N -3.30 0.87 -0.30 0.35 -2.24 -0.64 -5.00 114.28 104.02 2bui n THR 214 Ca 0.01 -4.55 0.13 0.00 -2.27 0.00 0.00 64.05 57.37 2bui n THR 214 Cb 0.49 -2.01 0.30 0.00 -2.10 0.00 0.00 70.33 67.00 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 4.69 0.24 0.00 -0.78 0.11 -1.64 -1.09 132.00 133.53 2bui h PRO 215 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2bui h PRO 215 Cb 0.78 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.83 2bui h PRO 215 CO 0.64 0.16 0.00 0.39 -0.21 0.00 0.00 178.00 178.98 2bui n GLU 216 N -5.19 0.63 0.00 1.05 1.02 -1.26 -2.44 120.64 114.44 2bui n GLU 216 Ca 0.22 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.40 2bui n GLU 216 Cb 0.69 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 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 -1.01 3.71 0.04 3.49 4.76 -0.42 -4.71 118.16 124.02 2bui n LYS 217 Ca 0.15 -0.15 -0.12 0.00 -2.87 0.00 0.00 58.31 55.32 2bui n LYS 217 Cb 0.07 -0.93 -0.07 0.00 -1.84 0.00 0.00 35.03 32.27 2bui n LYS 217 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bui h ALA 218 N 1.25 0.00 -1.88 7.82 0.00 -1.43 -3.38 119.26 121.64 2bui h ALA 218 Ca 0.00 0.01 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 2bui h ALA 218 Cb 0.22 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 2bui h ALA 218 CO 0.00 -0.50 0.72 0.45 0.00 0.00 0.00 179.25 179.92 2bui s SER 219 N -5.18 6.62 -0.38 0.00 0.15 -1.26 -4.74 113.70 108.91 2bui s SER 219 Ca -0.13 0.41 0.11 0.00 0.70 0.00 0.00 55.95 57.04 2bui s SER 219 Cb 0.06 -2.49 0.32 0.00 -1.71 0.00 0.00 66.02 62.20 2bui s SER 219 CO 0.66 -1.06 0.70 -2.11 1.20 0.00 0.00 173.24 172.63 2bui n ARG 220 N 7.28 0.91 -1.59 5.44 1.85 -1.26 -4.63 116.66 124.66 2bui n ARG 220 Ca 0.09 -3.24 -0.51 0.00 -1.00 0.00 0.00 57.85 53.19 2bui n ARG 220 Cb 0.48 -1.55 -0.05 0.00 -1.05 0.00 0.00 32.46 30.29 2bui n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2bui n THR 221 N 0.57 0.29 0.00 8.89 -1.04 -1.26 -1.06 114.28 120.67 2bui n THR 221 Ca 0.23 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 2bui n THR 221 Cb 0.63 -0.87 0.00 0.00 -1.82 0.00 0.00 70.33 68.28 2bui n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2bui n TYR 222 N 2.23 0.00 -2.17 -1.42 4.01 -1.26 -4.76 117.16 113.79 2bui n TYR 222 Ca 0.17 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.50 2bui n TYR 222 Cb 0.21 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 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 -2.69 6.85 0.64 7.72 2.15 -0.22 -1.21 116.67 129.91 2bui s ASP 223 Ca 0.00 2.58 0.34 0.00 0.43 0.00 0.00 52.55 55.90 2bui s ASP 223 Cb 0.00 -2.64 1.91 0.00 -0.30 0.00 0.00 42.92 41.89 2bui s ASP 223 CO 0.00 -0.49 2.14 0.00 -0.17 0.00 0.00 175.17 176.65 2bui h ALA 224 N 3.95 1.40 -0.40 3.66 0.00 -0.61 -2.27 119.26 124.99 2bui h ALA 224 Ca -0.48 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 2bui h ALA 224 Cb 1.22 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2bui h ALA 224 CO 0.69 -0.21 0.04 0.72 0.00 0.00 0.00 179.25 180.49 2bui n HIS 225 N -3.30 1.30 -1.95 0.00 8.25 -1.26 -5.00 115.22 113.25 2bui n HIS 225 Ca -0.01 -1.28 -0.37 0.00 -0.26 0.00 0.00 57.72 55.80 2bui n HIS 225 Cb 0.26 -0.47 0.04 0.00 1.12 0.00 0.00 29.99 30.93 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 -3.05 3.03 -0.13 -0.41 1.70 -0.86 -4.96 118.95 114.26 2bui s ARG 226 Ca 0.46 1.94 0.24 0.00 -0.47 0.00 0.00 55.73 57.89 2bui s ARG 226 Cb 0.39 -2.03 0.46 0.00 -0.57 0.00 0.00 34.95 33.20 2bui s ARG 226 CO 0.06 -1.19 1.14 -0.40 -1.08 0.00 0.00 175.30 173.83 2bui n ASP 227 N -1.41 1.22 0.00 -2.89 5.75 -1.25 -4.63 116.55 113.34 2bui n ASP 227 Ca 0.13 -2.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.89 2bui n ASP 227 Cb 0.48 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 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 -0.08 2.95 3.91 6.12 0.00 -0.80 -3.63 105.19 113.66 2bui n GLY 228 Ca 0.06 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.77 2bui n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bui s PHE 229 N -2.46 3.49 -0.36 1.61 -0.12 -0.54 -3.88 117.98 115.73 2bui s PHE 229 Ca 0.00 0.72 -0.12 0.00 -0.05 0.00 0.00 56.93 57.48 2bui s PHE 229 Cb 0.00 -2.34 0.01 0.00 -0.63 0.00 0.00 43.02 40.07 2bui s PHE 229 CO 0.00 -0.34 0.21 0.08 -0.05 0.00 0.00 175.22 175.13 2bui s VAL 230 N -2.74 4.77 0.56 -2.49 1.01 -1.26 -1.93 120.40 118.32 2bui s VAL 230 Ca 0.48 -0.67 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 2bui s VAL 230 Cb -0.10 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2bui s VAL 230 CO 0.44 -0.16 1.36 0.00 0.00 0.00 0.00 175.10 176.74 2bui n ILE 231 N 5.03 4.00 -4.05 2.22 3.06 -1.26 0.24 119.36 128.60 2bui n ILE 231 Ca -0.12 -0.50 -0.10 0.00 -2.50 0.00 0.00 62.75 59.53 2bui n ILE 231 Cb 0.47 -1.66 -0.08 0.00 0.54 0.00 0.00 39.64 38.92 2bui n ILE 231 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2bui s ALA 232 N -1.30 0.36 0.26 1.51 0.00 0.73 -0.89 121.76 122.43 2bui s ALA 232 Ca 0.73 -1.16 0.03 0.00 0.00 0.00 0.00 51.96 51.56 2bui s ALA 232 Cb -0.41 1.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.69 2bui s ALA 232 CO 0.48 -0.65 0.03 0.20 0.00 0.00 0.00 175.76 175.81 2bui s GLY 233 N -3.04 1.74 0.00 0.00 0.00 -0.50 -4.16 107.32 101.36 2bui s GLY 233 Ca 0.24 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.09 2bui s GLY 233 CO 0.05 -1.70 0.00 0.61 0.00 0.00 0.00 173.10 172.06 2bui n GLY 234 N -0.51 0.14 3.62 0.20 0.00 -0.56 -4.39 105.19 103.71 2bui n GLY 234 Ca -0.03 -1.64 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 2bui n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bui s GLY 235 N 0.00 0.28 0.09 -0.02 0.00 -0.26 -0.57 107.32 106.83 2bui s GLY 235 Ca 0.00 -0.63 -0.26 0.00 0.00 0.00 0.00 44.72 43.83 2bui s GLY 235 CO 0.00 -0.45 0.64 -0.32 0.00 0.00 0.00 173.10 172.97 2bui s GLY 236 N -2.97 -0.60 -0.27 0.20 0.00 -0.10 -1.94 107.32 101.64 2bui s GLY 236 Ca 0.17 0.78 -0.23 0.00 0.00 0.00 0.00 44.72 45.44 2bui s GLY 236 CO 0.06 0.42 0.72 -0.29 0.00 0.00 0.00 173.10 174.01 2bui s MET 237 N -2.90 0.80 0.14 2.90 1.75 -0.31 -1.25 119.30 120.43 2bui s MET 237 Ca -0.03 1.05 0.06 0.00 -1.25 0.00 0.00 55.69 55.53 2bui s MET 237 Cb -0.01 0.34 -0.04 0.00 2.84 0.00 0.00 34.83 37.96 2bui s MET 237 CO -0.06 -0.11 -0.14 0.14 -0.65 0.00 0.00 175.02 174.20 2bui s VAL 238 N 0.70 1.45 -0.44 10.11 -7.23 0.94 0.00 120.40 125.92 2bui s VAL 238 Ca -0.02 -1.84 -0.15 0.00 -1.81 0.00 0.00 61.98 58.16 2bui s VAL 238 Cb -0.05 -1.68 0.05 0.00 0.56 0.00 0.00 36.38 35.26 2bui s VAL 238 CO -0.04 -0.45 0.34 -0.69 -0.31 0.00 0.00 175.10 173.95 2bui s VAL 239 N -2.33 5.17 -0.25 1.32 1.01 0.12 -1.09 120.40 124.35 2bui s VAL 239 Ca 0.12 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.01 2bui s VAL 239 Cb -0.04 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 2bui s VAL 239 CO 0.04 -0.44 0.59 -0.69 0.00 0.00 0.00 175.10 174.59 2bui s VAL 240 N 1.64 5.02 0.02 2.92 1.01 -0.81 -1.23 120.40 128.97 2bui s VAL 240 Ca 0.04 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.11 2bui s VAL 240 Cb -0.22 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 2bui s VAL 240 CO 0.08 0.06 -0.10 -0.70 0.00 0.00 0.00 175.10 174.43 2bui s GLU 241 N 2.36 0.73 0.23 2.72 2.12 0.14 -0.97 118.70 126.02 2bui s GLU 241 Ca 0.25 -0.59 -0.30 0.00 0.36 0.00 0.00 54.97 54.68 2bui s GLU 241 Cb -0.16 -0.67 -0.10 0.00 0.26 0.00 0.00 34.13 33.47 2bui s GLU 241 CO 0.09 0.17 1.41 -2.00 -0.54 0.00 0.00 175.26 174.39 2bui s GLU 242 N -0.92 4.30 0.18 4.30 -6.30 -0.34 -0.24 118.70 119.68 2bui s GLU 242 Ca -0.01 2.24 -0.20 0.00 -2.50 0.00 0.00 54.97 54.50 2bui s GLU 242 Cb -0.07 -3.14 0.11 0.00 0.00 0.00 0.00 34.13 31.04 2bui s GLU 242 CO 0.01 -0.39 1.61 1.25 0.02 0.00 0.00 175.26 177.76 2bui h LEU 243 N 5.26 -0.87 -0.50 2.70 5.85 -1.64 -1.39 115.31 124.71 2bui h LEU 243 Ca -0.45 0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 2bui h LEU 243 Cb 1.22 0.45 -0.02 0.00 0.37 0.00 0.00 40.66 42.67 2bui h LEU 243 CO 0.79 -0.27 0.30 -0.33 -0.34 0.00 0.00 178.44 178.58 2bui h GLU 244 N -0.16 0.67 -0.81 1.25 4.39 -1.92 -0.29 114.58 117.72 2bui h GLU 244 Ca 0.21 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.88 2bui h GLU 244 Cb 0.49 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.96 2bui h GLU 244 CO -0.56 0.49 0.52 1.25 -1.16 0.00 0.00 179.01 179.55 2bui h HIS 245 N 0.66 0.98 0.03 4.33 2.76 -1.86 0.41 115.15 122.47 2bui h HIS 245 Ca 0.18 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2bui h HIS 245 Cb -0.01 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.62 2bui h HIS 245 CO -0.03 0.58 -0.01 0.00 -1.30 0.00 0.00 177.93 177.17 2bui h ALA 246 N 1.33 -0.04 -0.63 5.26 0.00 -0.76 -3.03 119.26 121.40 2bui h ALA 246 Ca 0.32 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2bui h ALA 246 Cb -0.02 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2bui h ALA 246 CO -0.10 -0.39 0.40 -0.07 0.00 0.00 0.00 179.25 179.09 2bui h LEU 247 N -0.30 0.68 -0.73 0.00 3.38 -0.82 -1.06 115.31 116.46 2bui h LEU 247 Ca -0.00 -0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2bui h LEU 247 Cb 0.28 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 2bui h LEU 247 CO 0.01 0.48 0.33 0.00 0.09 0.00 0.00 178.44 179.35 2bui h ALA 248 N 1.25 1.02 -0.24 1.53 0.00 -0.88 -0.50 119.26 121.44 2bui h ALA 248 Ca 0.24 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2bui h ALA 248 Cb -0.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2bui h ALA 248 CO -0.08 -0.13 0.00 2.89 0.00 0.00 0.00 179.25 181.93 2bui n ARG 249 N -4.93 1.81 -2.61 0.00 1.85 -1.08 -4.93 116.66 106.77 2bui n ARG 249 Ca 0.13 -1.24 -0.13 0.00 -1.00 0.00 0.00 57.85 55.61 2bui n ARG 249 Cb 0.35 -1.37 0.02 0.00 -1.05 0.00 0.00 32.46 30.40 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 1.14 -0.06 3.77 2.89 0.00 -0.20 -4.99 105.19 107.74 2bui n GLY 250 Ca 0.15 -0.27 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.85 2.83 -0.10 4.61 0.00 -0.44 -4.99 121.76 120.82 2bui s ALA 251 Ca 0.14 0.93 -0.30 0.00 0.00 0.00 0.00 51.96 52.74 2bui s ALA 251 Cb -0.06 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 2bui s ALA 251 CO 0.18 -0.79 1.02 -1.58 0.00 0.00 0.00 175.76 174.58 2bui s HIS 252 N -1.61 3.50 -0.25 0.00 5.65 -1.26 -4.81 115.29 116.52 2bui s HIS 252 Ca 0.68 1.58 -0.07 0.00 0.25 0.00 0.00 55.06 57.50 2bui s HIS 252 Cb -0.28 -3.20 -0.03 0.00 -1.18 0.00 0.00 32.58 27.89 2bui s HIS 252 CO 0.33 -0.28 0.07 0.42 -0.65 0.00 0.00 174.74 174.64 2bui s ILE 253 N 2.02 4.35 -0.06 0.89 1.01 -1.26 -4.39 121.20 123.76 2bui s ILE 253 Ca 0.49 -0.16 -0.23 0.00 0.00 0.00 0.00 60.65 60.75 2bui s ILE 253 Cb -0.19 -3.04 -0.18 0.00 0.01 0.00 0.00 42.46 39.07 2bui s ILE 253 CO 0.18 0.34 0.91 1.88 0.00 0.00 0.00 174.94 178.25 2bui h TYR 254 N 8.21 -0.10 -2.29 3.97 0.05 -1.56 -3.47 116.97 121.77 2bui h TYR 254 Ca -0.38 -0.00 0.21 0.00 0.05 0.00 0.00 58.73 58.61 2bui h TYR 254 Cb 1.18 0.03 -0.06 0.00 1.01 0.00 0.00 36.73 38.89 2bui h TYR 254 CO 0.67 0.45 0.63 0.00 -1.05 0.00 0.00 178.16 178.86 2bui s ALA 255 N -3.48 -1.80 -0.05 3.88 0.00 -1.25 -4.64 121.76 114.42 2bui s ALA 255 Ca -0.14 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.79 2bui s ALA 255 Cb -0.00 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2bui s ALA 255 CO 0.55 -1.07 -0.09 -2.00 0.00 0.00 0.00 175.76 173.15 2bui s GLU 256 N -2.44 2.63 -0.79 0.00 2.12 0.60 -1.50 118.70 119.32 2bui s GLU 256 Ca 0.20 -0.63 -0.25 0.00 0.36 0.00 0.00 54.97 54.65 2bui s GLU 256 Cb -0.01 -2.51 0.05 0.00 0.26 0.00 0.00 34.13 31.92 2bui s GLU 256 CO 0.03 0.64 1.24 0.42 -0.54 0.00 0.00 175.26 177.05 2bui s ILE 257 N -0.83 3.94 -1.55 -3.70 -1.09 -0.10 -1.18 121.20 116.69 2bui s ILE 257 Ca 0.13 -0.09 0.26 0.00 -2.23 0.00 0.00 60.65 58.72 2bui s ILE 257 Cb -0.11 -4.89 0.16 0.00 -1.58 0.00 0.00 42.46 36.04 2bui s ILE 257 CO 0.02 -1.77 1.47 1.33 -1.23 0.00 0.00 174.94 174.76 2bui n VAL 258 N 6.33 0.00 -3.67 2.92 0.24 -0.76 -4.61 118.33 118.79 2bui n VAL 258 Ca 0.09 -0.10 -0.11 0.00 -2.04 0.00 0.00 64.34 62.17 2bui n VAL 258 Cb 0.49 0.44 -0.08 0.00 -1.47 0.00 0.00 33.84 33.22 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 -2.65 -0.47 -0.08 7.63 0.00 -1.07 -4.83 107.32 105.85 2bui s GLY 259 Ca 0.20 1.83 -0.03 0.00 0.00 0.00 0.00 44.72 46.72 2bui s GLY 259 CO 0.58 1.73 0.08 -0.47 0.00 0.00 0.00 173.10 175.03 2bui s TYR 260 N 0.87 0.05 0.01 1.90 5.04 -1.26 -1.00 117.35 122.96 2bui s TYR 260 Ca -0.04 0.16 0.05 0.00 -2.44 0.00 0.00 57.07 54.79 2bui s TYR 260 Cb -0.05 -0.50 -0.03 0.00 0.35 0.00 0.00 41.96 41.72 2bui s TYR 260 CO -0.07 -0.29 -0.13 0.20 -1.34 0.00 0.00 175.55 173.92 2bui s GLY 261 N 2.18 1.63 -0.23 8.97 0.00 -0.09 -4.38 107.32 115.41 2bui s GLY 261 Ca 0.04 -1.08 -0.03 0.00 0.00 0.00 0.00 44.72 43.64 2bui s GLY 261 CO -0.05 -0.95 0.34 0.00 0.00 0.00 0.00 173.10 172.44 2bui s ALA 262 N -0.92 -0.89 0.28 3.20 0.00 -1.26 -1.32 121.76 120.86 2bui s ALA 262 Ca 0.15 0.81 0.04 0.00 0.00 0.00 0.00 51.96 52.95 2bui s ALA 262 Cb -0.11 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.46 2bui s ALA 262 CO 0.05 -1.18 0.13 0.25 0.00 0.00 0.00 175.76 175.01 2bui n THR 263 N 5.36 0.00 -3.93 0.00 -2.24 -0.76 -4.99 114.28 107.72 2bui n THR 263 Ca -0.04 -1.72 -0.14 0.00 -2.27 0.00 0.00 64.05 59.88 2bui n THR 263 Cb 0.50 0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 69.26 2bui n THR 263 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2bui s SER 264 N -2.77 0.18 -0.01 3.42 0.15 -1.26 -1.54 113.70 111.87 2bui s SER 264 Ca 0.18 -0.02 -0.21 0.00 0.70 0.00 0.00 55.95 56.60 2bui s SER 264 Cb 0.01 -0.05 -0.23 0.00 -1.71 0.00 0.00 66.02 64.04 2bui s SER 264 CO 0.13 -0.01 1.07 0.44 1.20 0.00 0.00 173.24 176.07 2bui h ASP 265 N 6.38 0.43 -5.59 5.45 3.32 -1.33 -3.44 116.42 121.63 2bui h ASP 265 Ca -0.30 -0.77 -0.38 0.00 0.02 0.00 0.00 57.03 55.61 2bui h ASP 265 Cb 1.19 -0.13 0.13 0.00 0.22 0.00 0.00 39.33 40.74 2bui h ASP 265 CO 0.50 1.14 -0.64 0.61 -1.72 0.00 0.00 179.24 179.13 2bui n GLY 266 N 1.06 -0.47 0.00 2.75 0.00 -1.26 -4.89 105.19 102.38 2bui n GLY 266 Ca -0.10 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2bui n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bui n ALA 267 N -4.88 1.08 -2.59 4.61 0.00 -1.26 -5.13 120.51 112.32 2bui n ALA 267 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.15 2bui n ALA 267 Cb 0.56 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.91 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 4.49 0.24 0.00 -0.00 -1.26 -5.06 116.67 116.08 2bui s ASP 268 Ca 0.00 -0.33 -0.01 0.00 -0.00 0.00 0.00 52.55 52.21 2bui s ASP 268 Cb 0.00 -0.91 0.27 0.00 -0.00 0.00 0.00 42.92 42.28 2bui s ASP 268 CO 0.00 0.19 1.64 0.24 -0.00 0.00 0.00 175.17 177.24 2bui h MET 269 N 3.70 0.58 0.00 8.23 2.86 -1.99 -3.35 114.93 124.96 2bui h MET 269 Ca -0.49 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 56.90 2bui h MET 269 Cb 1.17 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.81 2bui h MET 269 CO 0.53 0.83 0.00 1.33 1.06 0.00 0.00 176.91 180.66 2bui n VAL 270 N -4.07 0.33 -4.57 -2.22 0.24 -1.26 0.08 118.33 106.86 2bui n VAL 270 Ca -0.01 -0.51 -0.23 0.00 -2.04 0.00 0.00 64.34 61.55 2bui n VAL 270 Cb 0.46 0.99 -0.14 0.00 -1.47 0.00 0.00 33.84 33.68 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 -0.33 1.36 0.54 2.33 0.00 -1.26 -4.92 121.76 119.47 2bui s ALA 271 Ca 0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 51.96 50.98 2bui s ALA 271 Cb 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 23.12 22.78 2bui s ALA 271 CO 0.00 0.30 1.01 -1.25 0.00 0.00 0.00 175.76 175.82 2bui s PRO 272 N -0.84 3.72 0.01 0.00 0.04 -1.26 -4.33 135.00 132.34 2bui s PRO 272 Ca 0.05 1.09 0.22 0.00 0.04 0.00 0.00 61.00 62.39 2bui s PRO 272 Cb -0.07 -2.10 -0.27 0.00 0.04 0.00 0.00 34.50 32.10 2bui s PRO 272 CO 0.01 -0.47 0.61 -1.13 0.04 0.00 0.00 177.00 176.05 2bui n SER 273 N -1.65 0.20 0.00 6.66 3.41 -1.26 -4.97 113.62 116.01 2bui n SER 273 Ca 0.08 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 2bui n SER 273 Cb 0.53 1.68 0.00 0.00 -0.26 0.00 0.00 64.21 66.16 2bui n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bui n GLY 274 N 1.27 1.21 0.37 5.00 0.00 -1.26 -4.66 105.19 107.11 2bui n GLY 274 Ca -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 45.96 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 1.21 -0.21 1.61 4.22 -1.95 -1.53 114.58 117.94 2bui h GLU 275 Ca 0.00 -0.10 -0.15 0.00 0.08 0.00 0.00 59.36 59.19 2bui h GLU 275 Cb 0.00 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 2bui h GLU 275 CO 0.00 0.83 -0.50 0.78 -2.18 0.00 0.00 179.01 177.94 2bui h GLY 276 N 1.25 0.63 1.64 1.92 0.00 -1.86 -3.04 103.07 103.61 2bui h GLY 276 Ca 0.33 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.86 2bui h GLY 276 CO -0.06 0.62 -0.31 0.00 0.00 0.00 0.00 176.54 176.79 2bui h ALA 277 N 1.00 1.10 -0.25 3.60 0.00 -1.80 -1.31 119.26 121.59 2bui h ALA 277 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2bui h ALA 277 Cb 1.03 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2bui h ALA 277 CO 0.10 0.56 0.13 0.28 0.00 0.00 0.00 179.25 180.32 2bui h VAL 278 N 0.36 1.13 -0.38 0.00 2.07 -1.21 -1.30 116.25 116.91 2bui h VAL 278 Ca 0.05 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 2bui h VAL 278 Cb 0.72 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2bui h VAL 278 CO 0.05 0.13 -0.12 0.03 0.02 0.00 0.00 177.57 177.68 2bui h ARG 279 N 0.28 0.67 -0.04 1.57 3.08 -1.40 -1.59 114.38 116.95 2bui h ARG 279 Ca 0.09 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 2bui h ARG 279 Cb 0.09 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 2bui h ARG 279 CO -0.01 0.77 0.02 0.00 -1.07 0.00 0.00 179.97 179.67 2bui h MET 281 N -0.04 1.04 -0.76 0.00 2.86 -1.16 -2.00 114.93 114.87 2bui h MET 281 Ca 0.01 -0.36 -0.04 0.00 -2.06 0.00 0.00 59.70 57.25 2bui h MET 281 Cb 0.10 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 2bui h MET 281 CO -0.00 1.05 0.31 0.87 1.06 0.00 0.00 176.91 180.20 2bui h LYS 282 N 0.93 1.13 -0.72 1.72 1.57 -1.13 -0.91 116.57 119.16 2bui h LYS 282 Ca 0.15 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2bui h LYS 282 Cb 0.63 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 2bui h LYS 282 CO 0.04 0.92 0.30 1.98 -0.57 0.00 0.00 179.45 182.13 2bui h MET 283 N 1.10 1.06 0.00 3.15 4.05 -0.75 -1.81 114.93 121.72 2bui h MET 283 Ca 0.25 -0.18 -0.03 0.00 -0.28 0.00 0.00 59.70 59.46 2bui h MET 283 Cb 0.21 -0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 30.83 2bui h MET 283 CO -0.02 0.86 -0.16 0.00 0.23 0.00 0.00 176.91 177.82 2bui h ALA 284 N 1.14 1.21 -0.00 0.39 0.00 -0.81 -2.66 119.26 118.53 2bui h ALA 284 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bui h ALA 284 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2bui h ALA 284 CO -0.02 0.21 -0.30 -1.33 0.00 0.00 0.00 179.25 177.81 2bui n MET 285 N -3.59 0.55 -1.68 0.00 2.00 -0.40 -4.13 117.12 109.88 2bui n MET 285 Ca -0.01 -0.30 -0.46 0.00 0.00 0.00 0.00 57.70 56.92 2bui n MET 285 Cb 0.30 -1.49 -0.04 0.00 0.00 0.00 0.00 33.22 31.99 2bui n MET 285 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2bui n HIS 286 N -0.96 2.38 -0.97 2.03 8.25 -0.92 -0.60 115.22 124.43 2bui n HIS 286 Ca 0.10 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 2bui n HIS 286 Cb 0.33 -2.68 0.00 0.00 1.12 0.00 0.00 29.99 28.76 2bui n HIS 286 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bui n GLY 287 N 4.30 0.78 3.30 -1.41 0.00 -1.26 -4.96 105.19 105.95 2bui n GLY 287 Ca 0.21 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.20 5.15 -1.21 1.61 1.01 0.23 -4.91 120.40 119.08 2bui s VAL 288 Ca 0.00 -1.62 0.17 0.00 0.00 0.00 0.00 61.98 60.53 2bui s VAL 288 Cb 0.00 -4.30 0.67 0.00 0.00 0.00 0.00 36.38 32.76 2bui s VAL 288 CO 0.00 -0.88 1.57 0.47 0.00 0.00 0.00 175.10 176.26 2bui n ASP 289 N 5.09 4.45 -4.92 3.32 8.00 -1.26 -4.89 116.55 126.34 2bui n ASP 289 Ca -0.11 -2.40 -0.31 0.00 0.71 0.00 0.00 54.79 52.68 2bui n ASP 289 Cb 0.41 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.12 40.91 2bui n ASP 289 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2bui s THR 290 N -1.81 5.36 0.54 -3.53 -4.23 -1.26 -5.08 115.64 105.63 2bui s THR 290 Ca 0.48 -0.33 -0.19 0.00 -1.18 0.00 0.00 61.69 60.47 2bui s THR 290 Cb 0.30 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.46 2bui s THR 290 CO 0.23 0.13 1.08 -2.16 -0.54 0.00 0.00 174.62 173.36 2bui s PRO 291 N -2.52 3.50 -0.47 3.99 0.04 -1.26 -4.96 135.00 133.33 2bui s PRO 291 Ca 0.36 1.42 -0.28 0.00 0.04 0.00 0.00 61.00 62.53 2bui s PRO 291 Cb -0.13 -2.04 0.03 0.00 0.04 0.00 0.00 34.50 32.40 2bui s PRO 291 CO 0.27 -0.69 1.10 0.42 0.04 0.00 0.00 177.00 178.14 2bui s ILE 292 N -2.02 4.26 -0.01 0.56 -1.09 -1.26 -4.41 121.20 117.23 2bui s ILE 292 Ca 0.68 1.17 0.13 0.00 -2.23 0.00 0.00 60.65 60.41 2bui s ILE 292 Cb -0.19 -4.57 0.00 0.00 -1.58 0.00 0.00 42.46 36.12 2bui s ILE 292 CO 0.27 -0.96 1.46 0.44 -1.23 0.00 0.00 174.94 174.92 2bui h ASP 293 N 9.15 0.00 -3.48 3.58 3.32 -1.13 -3.42 116.42 124.44 2bui h ASP 293 Ca -0.23 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.72 2bui h ASP 293 Cb 1.06 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.36 2bui h ASP 293 CO 1.11 0.61 -0.22 -0.47 -1.72 0.00 0.00 179.24 178.55 2bui s TYR 294 N -3.03 -0.61 -0.23 4.55 5.04 -1.18 -3.65 117.35 118.24 2bui s TYR 294 Ca 0.02 1.35 0.01 0.00 -2.44 0.00 0.00 57.07 56.01 2bui s TYR 294 Cb 0.09 0.26 0.03 0.00 0.35 0.00 0.00 41.96 42.70 2bui s TYR 294 CO 0.75 -0.32 -0.13 -1.17 -1.34 0.00 0.00 175.55 173.35 2bui s LEU 295 N 0.95 2.87 -0.62 6.97 0.20 -0.16 -0.57 118.68 128.33 2bui s LEU 295 Ca -0.06 -0.95 -0.21 0.00 0.69 0.00 0.00 54.13 53.60 2bui s LEU 295 Cb -0.06 -1.56 0.08 0.00 -0.43 0.00 0.00 46.19 44.22 2bui s LEU 295 CO -0.08 -0.10 0.85 0.21 -0.29 0.00 0.00 176.35 176.94 2bui s ASN 296 N 1.24 6.19 0.83 3.68 3.84 0.13 -3.15 114.94 127.71 2bui s ASN 296 Ca -0.01 -1.08 -0.11 0.00 0.21 0.00 0.00 52.86 51.87 2bui s ASN 296 Cb -0.16 -2.37 0.09 0.00 -0.55 0.00 0.00 41.25 38.26 2bui s ASN 296 CO -0.08 -1.27 1.09 -0.94 -2.79 0.00 0.00 177.10 173.11 2bui s SER 297 N 3.52 4.02 0.18 -4.21 1.04 -1.17 -1.99 113.70 115.08 2bui s SER 297 Ca 0.19 1.59 -0.01 0.00 0.48 0.00 0.00 55.95 58.19 2bui s SER 297 Cb -0.19 -2.29 0.05 0.00 0.10 0.00 0.00 66.02 63.70 2bui s SER 297 CO 0.10 -2.31 1.43 -0.74 0.98 0.00 0.00 173.24 172.70 2bui h HIS 298 N -1.32 0.53 0.00 5.02 2.76 -1.93 -3.43 115.15 116.77 2bui h HIS 298 Ca -0.47 -0.24 0.00 0.00 -2.20 0.00 0.00 60.37 57.46 2bui h HIS 298 Cb 1.26 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 30.14 2bui h HIS 298 CO 0.49 1.00 0.00 0.41 -1.30 0.00 0.00 177.93 178.52 2bui n GLY 299 N 0.58 0.00 0.30 5.26 0.00 -1.26 -4.81 105.19 105.26 2bui n GLY 299 Ca -0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 0.00 -2.21 2.61 -2.24 -1.26 -4.50 114.28 106.68 2bui n THR 300 Ca 0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2bui n THR 300 Cb 0.00 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 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 -0.45 -1.65 -4.56 3.42 2.88 -1.26 -3.77 113.62 108.23 2bui n SER 301 Ca 0.14 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.37 2bui n SER 301 Cb 0.35 -0.46 -0.11 0.00 -0.75 0.00 0.00 64.21 63.24 2bui n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2bui s THR 302 N -2.73 3.39 0.11 2.46 -4.23 -1.26 -1.90 115.64 111.48 2bui s THR 302 Ca 0.00 -0.99 -0.33 0.00 -1.18 0.00 0.00 61.69 59.18 2bui s THR 302 Cb 0.00 -2.50 -0.13 0.00 1.34 0.00 0.00 72.50 71.22 2bui s THR 302 CO 0.00 0.31 1.54 -0.65 -0.54 0.00 0.00 174.62 175.28 2bui h PRO 303 N 4.28 -0.55 0.04 3.99 0.11 -1.94 -2.61 132.00 135.31 2bui h PRO 303 Ca -0.48 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 2bui h PRO 303 Cb 1.16 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2bui h PRO 303 CO 0.52 -0.37 -0.02 0.28 -0.21 0.00 0.00 178.00 178.20 2bui h VAL 304 N -0.57 1.34 -0.22 3.15 2.07 -1.99 -3.37 116.25 116.65 2bui h VAL 304 Ca 0.03 -1.36 0.05 0.00 0.82 0.00 0.00 66.70 66.25 2bui h VAL 304 Cb 0.67 2.22 -0.05 0.00 -1.52 0.00 0.00 31.29 32.60 2bui h VAL 304 CO -0.43 0.34 -0.13 1.23 0.02 0.00 0.00 177.57 178.60 2bui h GLY 305 N -0.67 0.05 -0.10 2.17 0.00 -1.97 -2.12 103.07 100.43 2bui h GLY 305 Ca -0.01 0.16 0.08 0.00 0.00 0.00 0.00 47.33 47.56 2bui h GLY 305 CO 0.01 -0.14 -0.29 -0.55 0.00 0.00 0.00 176.54 175.56 2bui h ASP 306 N -0.11 -0.97 0.79 0.19 5.19 -1.63 -2.11 116.42 117.77 2bui h ASP 306 Ca 0.12 0.18 -0.17 0.00 -0.62 0.00 0.00 57.03 56.54 2bui h ASP 306 Cb 0.30 0.46 -0.02 0.00 0.18 0.00 0.00 39.33 40.25 2bui h ASP 306 CO -0.29 -0.30 -0.80 -0.37 -3.12 0.00 0.00 179.24 174.36 2bui h VAL 307 N -0.23 1.57 -0.39 -1.35 -1.51 -1.71 -2.76 116.25 109.87 2bui h VAL 307 Ca 0.17 -2.72 0.03 0.00 -1.23 0.00 0.00 66.70 62.95 2bui h VAL 307 Cb 0.51 2.47 -0.03 0.00 -2.13 0.00 0.00 31.29 32.11 2bui h VAL 307 CO -0.51 0.78 0.19 0.50 -1.23 0.00 0.00 177.57 177.30 2bui h LYS 308 N 0.00 0.38 -0.46 5.19 1.63 -0.93 0.75 116.57 123.14 2bui h LYS 308 Ca -0.01 -0.02 -0.08 0.00 -0.85 0.00 0.00 60.65 59.68 2bui h LYS 308 Cb 1.41 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.93 2bui h LYS 308 CO 0.10 0.25 -0.06 1.49 -3.45 0.00 0.00 179.45 177.79 2bui h GLU 309 N 0.39 0.79 -0.20 1.90 4.81 -1.39 -1.89 114.58 118.99 2bui h GLU 309 Ca 0.16 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 2bui h GLU 309 Cb 0.07 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2bui h GLU 309 CO -0.12 0.83 -0.11 -0.07 -0.73 0.00 0.00 179.01 178.82 2bui h LEU 310 N 0.72 0.29 -0.26 1.64 3.38 -1.05 -0.59 115.31 119.45 2bui h LEU 310 Ca 0.13 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2bui h LEU 310 Cb 0.52 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2bui h LEU 310 CO 0.03 0.44 -0.16 0.00 0.09 0.00 0.00 178.44 178.84 2bui h ALA 311 N 1.59 0.36 -0.75 1.53 0.00 -0.33 -1.67 119.26 119.99 2bui h ALA 311 Ca 0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2bui h ALA 311 Cb 0.38 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2bui h ALA 311 CO 0.02 0.26 0.37 0.00 0.00 0.00 0.00 179.25 179.90 2bui h ALA 312 N 0.72 0.97 -0.59 0.00 0.00 -0.88 -1.37 119.26 118.10 2bui h ALA 312 Ca 0.05 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2bui h ALA 312 Cb 0.68 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2bui h ALA 312 CO 0.04 0.53 0.37 0.82 0.00 0.00 0.00 179.25 181.02 2bui h ILE 313 N 1.06 1.10 -0.40 0.00 2.04 -1.02 -1.07 117.51 119.22 2bui h ILE 313 Ca 0.26 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.89 2bui h ILE 313 Cb 0.11 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2bui h ILE 313 CO -0.03 0.13 0.20 0.03 0.00 0.00 0.00 178.15 178.49 2bui h ARG 314 N 0.74 0.40 -0.86 2.37 3.08 -0.67 -0.24 114.38 119.20 2bui h ARG 314 Ca 0.23 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.27 2bui h ARG 314 Cb -0.02 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 2bui h ARG 314 CO -0.08 0.27 0.57 1.49 -1.07 0.00 0.00 179.97 181.14 2bui h GLU 315 N 0.42 1.11 -0.01 0.04 4.57 -0.68 0.61 114.58 120.63 2bui h GLU 315 Ca 0.17 -0.07 -0.11 0.00 -1.18 0.00 0.00 59.36 58.17 2bui h GLU 315 Cb 0.06 -0.25 0.01 0.00 -0.16 0.00 0.00 28.75 28.41 2bui h GLU 315 CO -0.11 0.73 -0.42 0.28 -1.18 0.00 0.00 179.01 178.31 2bui h VAL 316 N 1.14 1.48 0.00 0.32 2.07 -0.68 -3.39 116.25 117.19 2bui h VAL 316 Ca 0.32 -1.99 -0.19 0.00 0.82 0.00 0.00 66.70 65.67 2bui h VAL 316 Cb -0.08 2.64 -0.04 0.00 -1.52 0.00 0.00 31.29 32.29 2bui h VAL 316 CO -0.08 0.56 -2.08 0.49 0.02 0.00 0.00 177.57 176.49 2bui n PHE 317 N -4.36 0.15 -1.98 1.57 3.01 -0.15 -5.05 117.46 110.65 2bui n PHE 317 Ca -0.10 0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2bui n PHE 317 Cb 0.58 -0.81 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 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 1.50 3.14 0.30 1.37 0.00 0.21 -1.28 105.19 110.42 2bui n GLY 318 Ca -0.18 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 3.58 0.46 -1.35 1.61 10.43 -1.26 -2.82 116.55 127.20 2bui n ASP 319 Ca 0.00 -1.53 -0.09 0.00 2.57 0.00 0.00 54.79 55.73 2bui n ASP 319 Cb 0.00 -0.23 0.15 0.00 1.84 0.00 0.00 41.12 42.88 2bui n ASP 319 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 2bui n LYS 320 N -0.13 2.23 -1.68 -1.24 0.00 -0.40 -5.05 118.16 111.89 2bui n LYS 320 Ca 0.00 -3.43 -0.47 0.00 0.00 0.00 0.00 58.31 54.41 2bui n LYS 320 Cb 0.12 -1.92 -0.04 0.00 0.00 0.00 0.00 35.03 33.18 2bui n LYS 320 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2bui n SER 321 N -1.03 3.36 -4.92 3.14 2.88 -1.13 -4.87 113.62 111.06 2bui n SER 321 Ca 0.36 1.02 -0.27 0.00 -1.33 0.00 0.00 58.87 58.65 2bui n SER 321 Cb 0.94 -1.41 0.07 0.00 -0.75 0.00 0.00 64.21 63.06 2bui n SER 321 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2bui s PRO 322 N 2.72 2.24 0.29 -1.46 0.04 -1.26 -4.80 135.00 132.78 2bui s PRO 322 Ca 0.86 -0.12 -0.29 0.00 0.04 0.00 0.00 61.00 61.49 2bui s PRO 322 Cb -0.67 -2.12 -0.10 0.00 0.04 0.00 0.00 34.50 31.65 2bui s PRO 322 CO 0.45 -1.26 1.43 0.00 0.04 0.00 0.00 177.00 177.66 2bui s ALA 323 N -3.30 3.60 -0.01 8.56 0.00 -1.24 -4.42 121.76 124.94 2bui s ALA 323 Ca 0.60 1.37 0.03 0.00 0.00 0.00 0.00 51.96 53.96 2bui s ALA 323 Cb -0.11 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 2bui s ALA 323 CO 0.46 -0.79 -0.11 0.42 0.00 0.00 0.00 175.76 175.74 2bui s ILE 324 N -0.46 0.87 -0.12 0.00 1.01 0.25 -0.99 121.20 121.76 2bui s ILE 324 Ca 0.56 -0.45 -0.13 0.00 0.00 0.00 0.00 60.65 60.63 2bui s ILE 324 Cb -0.43 -0.74 0.03 0.00 0.01 0.00 0.00 42.46 41.34 2bui s ILE 324 CO 0.49 0.25 0.35 -0.94 0.00 0.00 0.00 174.94 175.10 2bui s SER 325 N -0.13 -0.35 -0.47 3.58 1.04 -1.19 0.19 113.70 116.38 2bui s SER 325 Ca 0.02 0.64 -0.09 0.00 0.48 0.00 0.00 55.95 57.00 2bui s SER 325 Cb -0.06 0.68 0.12 0.00 0.10 0.00 0.00 66.02 66.86 2bui s SER 325 CO -0.00 -0.17 0.34 0.00 0.98 0.00 0.00 173.24 174.39 2bui s ALA 326 N -0.01 3.39 0.13 5.32 0.00 -1.26 -3.02 121.76 126.30 2bui s ALA 326 Ca -0.02 -2.54 0.33 0.00 0.00 0.00 0.00 51.96 49.73 2bui s ALA 326 Cb -0.03 -2.82 1.63 0.00 0.00 0.00 0.00 23.12 21.91 2bui s ALA 326 CO 0.01 -1.90 2.00 1.79 0.00 0.00 0.00 175.76 177.65 2bui h THR 327 N 6.14 0.00 0.00 0.00 1.35 -1.85 -2.36 112.91 116.20 2bui h THR 327 Ca -0.21 -0.16 -0.01 0.00 -0.55 0.00 0.00 66.41 65.49 2bui h THR 327 Cb 1.07 0.99 -0.00 0.00 -1.73 0.00 0.00 68.15 68.48 2bui h THR 327 CO 0.86 0.00 -0.03 0.11 -0.25 0.00 0.00 175.52 176.21 2bui h LYS 328 N 0.00 0.00 0.00 4.72 1.57 -1.83 0.63 116.57 121.66 2bui h LYS 328 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2bui h LYS 328 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2bui h LYS 328 CO 0.00 0.03 -0.03 0.00 -0.57 0.00 0.00 179.45 178.88 2bui h ALA 329 N 1.97 1.61 0.02 3.86 0.00 -1.68 0.95 119.26 125.98 2bui h ALA 329 Ca -0.00 -0.03 -0.38 0.00 0.00 0.00 0.00 54.91 54.50 2bui h ALA 329 Cb 0.22 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2bui h ALA 329 CO 0.00 0.03 -2.18 -1.33 0.00 0.00 0.00 179.25 175.78 2bui n MET 330 N -4.00 0.62 0.04 0.00 2.81 0.10 -4.62 117.12 112.08 2bui n MET 330 Ca -0.03 0.31 0.02 0.00 -1.81 0.00 0.00 57.70 56.18 2bui n MET 330 Cb 0.11 -1.58 -0.07 0.00 -0.71 0.00 0.00 33.22 30.97 2bui n MET 330 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2bui h THR 331 N -0.62 0.43 0.00 2.03 1.35 -1.16 0.83 112.91 115.77 2bui h THR 331 Ca -0.56 -1.86 0.00 0.00 -0.55 0.00 0.00 66.41 63.44 2bui h THR 331 Cb 1.67 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 70.06 2bui h THR 331 CO -0.23 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 2bui n GLY 332 N 1.36 -0.43 3.37 5.82 0.00 0.32 -4.57 105.19 111.06 2bui n GLY 332 Ca -0.08 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 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 -1.02 3.26 -1.36 1.61 2.46 0.14 -4.66 115.29 115.72 2bui s HIS 333 Ca 0.00 -1.02 0.07 0.00 0.47 0.00 0.00 55.06 54.58 2bui s HIS 333 Cb 0.00 -2.96 0.26 0.00 -0.13 0.00 0.00 32.58 29.75 2bui s HIS 333 CO 0.00 -0.76 1.07 -1.13 -2.47 0.00 0.00 174.74 171.45 2bui n SER 334 N 5.11 2.05 0.00 9.88 3.41 -1.26 -0.20 113.62 132.62 2bui n SER 334 Ca -0.12 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 2bui n SER 334 Cb 0.44 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 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 0.25 0.00 0.31 1.04 4.77 -1.26 -1.66 117.00 120.45 2bui n LEU 335 Ca 0.09 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.26 2bui n LEU 335 Cb 0.41 0.00 1.05 0.00 -2.33 0.00 0.00 43.42 42.54 2bui n LEU 335 CO 0.09 0.00 1.15 1.23 -1.33 0.00 0.00 177.39 178.53 2bui h GLY 336 N 0.00 0.00 0.86 -0.72 0.00 -1.86 -2.04 103.07 99.31 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 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 2bui n ALA 337 N -2.22 3.42 -0.34 3.60 0.00 -0.66 -2.03 120.51 122.28 2bui n ALA 337 Ca -0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 53.44 53.05 2bui n ALA 337 Cb 0.08 -1.07 0.13 0.00 0.00 0.00 0.00 19.45 18.59 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 2.74 1.23 0.03 0.00 0.00 -1.47 -2.28 119.26 119.52 2bui h ALA 338 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2bui h ALA 338 Cb 0.63 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2bui h ALA 338 CO 0.00 0.46 -0.34 0.78 0.00 0.00 0.00 179.25 180.16 2bui h GLY 339 N 1.16 -0.59 1.42 0.00 0.00 -1.75 0.10 103.07 103.42 2bui h GLY 339 Ca 0.37 0.40 -0.18 0.00 0.00 0.00 0.00 47.33 47.92 2bui h GLY 339 CO -0.12 -0.24 -0.66 -0.24 0.00 0.00 0.00 176.54 175.27 2bui h VAL 340 N -0.51 1.33 -0.73 4.60 3.04 -1.73 -2.48 116.25 119.76 2bui h VAL 340 Ca 0.05 -1.95 -0.04 0.00 -1.01 0.00 0.00 66.70 63.75 2bui h VAL 340 Cb 0.58 1.92 -0.03 0.00 -2.01 0.00 0.00 31.29 31.75 2bui h VAL 340 CO -0.25 0.60 0.29 1.56 -1.01 0.00 0.00 177.57 178.76 2bui h GLN 341 N 0.42 1.09 0.00 4.17 4.20 -1.24 -1.41 115.11 122.34 2bui h GLN 341 Ca -0.02 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.46 2bui h GLN 341 Cb 1.24 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 2bui h GLN 341 CO 0.13 0.89 -0.19 0.93 -0.67 0.00 0.00 178.83 179.91 2bui h GLU 342 N 1.07 0.00 -0.05 1.46 5.08 -0.77 -1.49 114.58 119.88 2bui h GLU 342 Ca 0.25 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.40 2bui h GLU 342 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2bui h GLU 342 CO -0.02 0.19 -0.83 0.00 -1.00 0.00 0.00 179.01 177.35 2bui h ALA 343 N 1.81 0.47 -0.35 3.43 0.00 -1.08 -1.91 119.26 121.63 2bui h ALA 343 Ca -0.00 -0.65 -0.07 0.00 0.00 0.00 0.00 54.91 54.18 2bui h ALA 343 Cb 0.99 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2bui h ALA 343 CO 0.02 0.78 -0.07 0.82 0.00 0.00 0.00 179.25 180.80 2bui h ILE 344 N 0.28 1.28 -0.88 0.00 2.04 -1.01 0.18 117.51 119.40 2bui h ILE 344 Ca -0.05 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.68 2bui h ILE 344 Cb 1.44 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.77 2bui h ILE 344 CO 0.15 0.37 0.56 1.88 0.00 0.00 0.00 178.15 181.10 2bui h TYR 345 N 0.45 1.13 -0.61 1.37 0.05 -1.24 0.50 116.97 118.62 2bui h TYR 345 Ca 0.09 0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.82 2bui h TYR 345 Cb 0.57 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.91 2bui h TYR 345 CO 0.05 0.73 0.14 0.77 -1.05 0.00 0.00 178.16 178.80 2bui h SER 346 N 1.20 0.94 -0.10 3.88 0.02 -1.09 -1.43 113.55 116.96 2bui h SER 346 Ca 0.32 -0.24 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 2bui h SER 346 Cb -0.10 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.18 2bui h SER 346 CO -0.06 0.93 -0.20 -0.07 -1.14 0.00 0.00 176.83 176.28 2bui h LEU 347 N 0.90 0.51 -0.38 5.07 3.38 0.06 -1.28 115.31 123.56 2bui h LEU 347 Ca 0.19 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2bui h LEU 347 Cb 0.37 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2bui h LEU 347 CO 0.00 0.72 -0.20 -0.07 0.09 0.00 0.00 178.44 178.99 2bui h LEU 348 N 0.46 0.84 -0.79 1.67 3.38 -0.68 0.12 115.31 120.30 2bui h LEU 348 Ca 0.07 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 2bui h LEU 348 Cb 0.61 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2bui h LEU 348 CO 0.04 1.06 0.33 0.24 0.09 0.00 0.00 178.44 180.20 2bui h MET 349 N 0.61 1.18 -0.28 1.13 2.86 -1.05 0.02 114.93 119.41 2bui h MET 349 Ca 0.08 -0.21 -0.06 0.00 -2.06 0.00 0.00 59.70 57.46 2bui h MET 349 Cb 0.75 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2bui h MET 349 CO 0.06 0.95 -0.05 1.25 1.06 0.00 0.00 176.91 180.18 2bui h LEU 350 N 1.15 0.53 -0.65 1.22 5.85 -1.08 -0.53 115.31 121.80 2bui h LEU 350 Ca 0.27 -0.35 -0.10 0.00 0.84 0.00 0.00 57.88 58.53 2bui h LEU 350 Cb 0.20 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2bui h LEU 350 CO -0.02 0.76 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.72 2bui h GLU 351 N 0.29 1.02 -0.36 1.25 4.57 -0.52 -3.27 114.58 117.55 2bui h GLU 351 Ca 0.07 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 2bui h GLU 351 Cb 0.52 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2bui h GLU 351 CO 0.02 1.02 0.00 0.72 -1.18 0.00 0.00 179.01 179.59 2bui n HIS 352 N -4.17 0.46 -3.13 0.92 8.25 -0.03 -5.02 115.22 112.50 2bui n HIS 352 Ca 0.02 -0.26 -0.14 0.00 -0.26 0.00 0.00 57.72 57.09 2bui n HIS 352 Cb 0.36 -0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.53 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 1.34 -1.03 3.45 -1.41 0.00 -0.25 -4.94 105.19 102.35 2bui n GLY 353 Ca 0.18 0.53 -0.13 0.00 0.00 0.00 0.00 46.02 46.59 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 -3.36 -0.56 -0.21 1.61 -0.12 -0.92 -1.49 117.98 112.93 2bui s PHE 354 Ca 0.43 0.54 -0.02 0.00 -0.05 0.00 0.00 56.93 57.83 2bui s PHE 354 Cb -0.06 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 42.85 2bui s PHE 354 CO 0.69 -0.77 -0.09 0.42 -0.05 0.00 0.00 175.22 175.42 2bui s ILE 355 N -3.03 2.97 0.32 -4.49 1.01 0.14 -4.55 121.20 113.57 2bui s ILE 355 Ca -0.02 -0.65 -0.29 0.00 0.00 0.00 0.00 60.65 59.69 2bui s ILE 355 Cb -0.01 -2.34 -0.10 0.00 0.01 0.00 0.00 42.46 40.02 2bui s ILE 355 CO -0.07 0.45 1.30 0.00 0.00 0.00 0.00 174.94 176.62 2bui s ALA 356 N 1.42 3.50 0.52 9.38 0.00 -1.26 -1.99 121.76 133.33 2bui s ALA 356 Ca 0.05 1.23 -0.20 0.00 0.00 0.00 0.00 51.96 53.04 2bui s ALA 356 Cb -0.14 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.44 2bui s ALA 356 CO -0.06 -0.60 1.09 -1.25 0.00 0.00 0.00 175.76 174.94 2bui s PRO 357 N -1.60 3.53 -0.55 0.00 0.04 -1.26 -4.75 135.00 130.40 2bui s PRO 357 Ca 0.49 1.49 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 2bui s PRO 357 Cb -0.39 -2.04 0.11 0.00 0.04 0.00 0.00 34.50 32.22 2bui s PRO 357 CO 0.51 -0.68 0.57 0.45 0.04 0.00 0.00 177.00 177.89 2bui s SER 358 N -1.90 6.19 0.75 6.66 0.15 0.88 -4.72 113.70 121.70 2bui s SER 358 Ca 0.70 -1.61 -0.07 0.00 0.70 0.00 0.00 55.95 55.67 2bui s SER 358 Cb -0.20 -2.24 0.10 0.00 -1.71 0.00 0.00 66.02 61.96 2bui s SER 358 CO 0.25 -0.94 1.06 0.27 1.20 0.00 0.00 173.24 175.07 2bui s ILE 359 N 2.03 2.21 -1.70 6.45 -4.36 -1.26 -4.48 121.20 120.08 2bui s ILE 359 Ca 0.07 -0.29 0.00 0.00 -0.26 0.00 0.00 60.65 60.16 2bui s ILE 359 Cb -0.27 -2.92 0.00 0.00 1.25 0.00 0.00 42.46 40.52 2bui s ILE 359 CO 0.05 0.00 0.00 0.59 0.24 0.00 0.00 174.94 175.82 2bui n ASN 360 N -3.04 -5.10 -4.40 4.36 3.02 -1.26 -4.49 115.26 104.35 2bui n ASN 360 Ca 0.11 0.25 -0.45 0.00 -0.03 0.00 0.00 54.58 54.46 2bui n ASN 360 Cb 0.60 -4.15 -0.02 0.00 -0.61 0.00 0.00 39.78 35.60 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 -2.73 5.08 -0.09 2.41 1.01 -1.26 -4.71 121.20 120.91 2bui s ILE 361 Ca 0.00 -1.92 0.14 0.00 0.00 0.00 0.00 60.65 58.87 2bui s ILE 361 Cb 0.00 -4.65 -0.06 0.00 0.01 0.00 0.00 42.46 37.76 2bui s ILE 361 CO 0.00 -1.31 1.18 -0.33 0.00 0.00 0.00 174.94 174.48 2bui h GLU 362 N 8.42 0.00 -2.40 2.79 5.08 -1.95 -3.43 114.58 123.08 2bui h GLU 362 Ca 0.13 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.22 2bui h GLU 362 Cb 1.03 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 29.94 2bui h GLU 362 CO 0.97 0.52 -0.58 -2.00 -1.00 0.00 0.00 179.01 176.91 2bui s GLU 363 N -2.88 0.22 0.11 2.33 2.12 -1.26 -5.06 118.70 114.28 2bui s GLU 363 Ca 0.01 0.33 -0.31 0.00 0.36 0.00 0.00 54.97 55.35 2bui s GLU 363 Cb 0.08 -0.94 -0.08 0.00 0.26 0.00 0.00 34.13 33.45 2bui s GLU 363 CO 0.78 -0.62 1.41 -1.17 -0.54 0.00 0.00 175.26 175.12 2bui s LEU 364 N 2.38 4.37 0.29 2.70 2.96 -1.26 0.11 118.68 130.23 2bui s LEU 364 Ca 0.08 2.33 -0.30 0.00 -0.22 0.00 0.00 54.13 56.02 2bui s LEU 364 Cb -0.15 -3.58 -0.13 0.00 0.50 0.00 0.00 46.19 42.83 2bui s LEU 364 CO -0.13 -0.67 1.41 -0.67 -1.32 0.00 0.00 176.35 174.97 2bui n ASP 365 N 4.11 3.04 0.30 3.68 -0.08 -0.35 -4.71 116.55 122.54 2bui n ASP 365 Ca 0.12 1.17 0.16 0.00 -1.51 0.00 0.00 54.79 54.73 2bui n ASP 365 Cb 0.42 -1.49 0.94 0.00 2.34 0.00 0.00 41.12 43.33 2bui n ASP 365 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2bui h GLU 366 N 3.72 0.00 0.00 -0.67 4.11 -1.92 -0.83 114.58 119.00 2bui h GLU 366 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2bui h GLU 366 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2bui h GLU 366 CO 0.71 0.02 0.00 1.04 0.07 0.00 0.00 179.01 180.86 2bui n GLN 367 N -3.62 0.19 -0.47 1.06 6.02 -1.26 -2.55 117.38 116.76 2bui n GLN 367 Ca -0.03 0.08 0.10 0.00 -0.01 0.00 0.00 57.00 57.14 2bui n GLN 367 Cb 0.12 -1.50 0.32 0.00 1.02 0.00 0.00 30.24 30.19 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 -1.38 2.72 -2.00 -1.58 0.00 -0.32 -4.95 120.51 113.01 2bui n ALA 368 Ca 0.09 -1.48 -0.42 0.00 0.00 0.00 0.00 53.44 51.63 2bui n ALA 368 Cb 0.22 -0.89 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.50 3.62 0.00 0.00 0.00 -1.06 -3.11 121.76 119.71 2bui s ALA 369 Ca 0.46 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.65 2bui s ALA 369 Cb 0.28 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2bui s ALA 369 CO 0.26 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.76 2bui n GLY 370 N 2.92 0.65 3.62 0.00 0.00 -1.26 -5.07 105.19 106.05 2bui n GLY 370 Ca 0.09 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.49 2bui n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bui s LEU 371 N 0.00 3.19 -1.29 0.99 1.43 -1.18 -5.04 118.68 116.78 2bui s LEU 371 Ca 0.00 -0.41 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 2bui s LEU 371 Cb 0.00 -1.89 0.16 0.00 0.03 0.00 0.00 46.19 44.48 2bui s LEU 371 CO 0.00 0.12 2.04 -3.20 0.23 0.00 0.00 176.35 175.55 2bui n ASN 372 N 0.20 6.15 -4.58 2.29 4.05 -1.26 -4.94 115.26 117.18 2bui n ASN 372 Ca -0.11 -3.13 -0.43 0.00 0.45 0.00 0.00 54.58 51.36 2bui n ASN 372 Cb 0.54 -1.43 -0.03 0.00 1.23 0.00 0.00 39.78 40.09 2bui n ASN 372 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2bui s ILE 373 N -0.25 4.35 -0.12 -1.44 1.01 -1.26 -0.58 121.20 122.90 2bui s ILE 373 Ca 0.44 0.95 -0.29 0.00 0.00 0.00 0.00 60.65 61.75 2bui s ILE 373 Cb 0.13 -4.52 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 2bui s ILE 373 CO -0.03 -0.93 1.29 -0.69 0.00 0.00 0.00 174.94 174.58 2bui s VAL 374 N 4.09 4.19 -1.25 2.92 1.01 0.13 -4.90 120.40 126.58 2bui s VAL 374 Ca 0.42 1.46 0.11 0.00 0.00 0.00 0.00 61.98 63.97 2bui s VAL 374 Cb -0.09 -3.94 0.13 0.00 0.00 0.00 0.00 36.38 32.48 2bui s VAL 374 CO 0.29 -0.09 0.93 0.35 0.00 0.00 0.00 175.10 176.58 2bui n THR 375 N 5.16 0.22 -4.03 3.92 -2.24 -1.26 -0.08 114.28 115.96 2bui n THR 375 Ca 0.13 -0.61 -0.16 0.00 -2.27 0.00 0.00 64.05 61.15 2bui n THR 375 Cb 0.45 1.07 -0.15 0.00 -2.10 0.00 0.00 70.33 69.59 2bui n THR 375 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2bui s GLU 376 N -0.92 0.34 0.03 -0.78 0.41 -1.26 -4.54 118.70 111.98 2bui s GLU 376 Ca 0.15 -0.06 -0.37 0.00 -0.41 0.00 0.00 54.97 54.28 2bui s GLU 376 Cb 0.10 -0.39 -0.16 0.00 -1.78 0.00 0.00 34.13 31.89 2bui s GLU 376 CO 0.14 -0.00 1.47 2.41 -0.49 0.00 0.00 175.26 178.79 2bui n THR 377 N 3.45 0.08 -4.26 3.63 -1.04 -1.26 -4.59 114.28 110.28 2bui n THR 377 Ca -0.18 -0.01 -0.24 0.00 -2.04 0.00 0.00 64.05 61.57 2bui n THR 377 Cb 0.55 -1.05 -0.17 0.00 -1.82 0.00 0.00 70.33 67.84 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 1.21 0.93 0.15 12.58 2.01 -0.84 -4.97 115.64 126.71 2bui s THR 378 Ca 0.86 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 62.25 2bui s THR 378 Cb -0.91 -0.90 -0.07 0.00 0.01 0.00 0.00 72.50 70.63 2bui s THR 378 CO 0.49 0.32 0.96 -1.81 -0.69 0.00 0.00 174.62 173.89 2bui s ASP 379 N 1.07 7.53 -0.23 3.53 1.01 -1.26 0.28 116.67 128.60 2bui s ASP 379 Ca -0.08 1.84 -0.27 0.00 0.71 0.00 0.00 52.55 54.76 2bui s ASP 379 Cb -0.14 -2.59 0.13 0.00 1.01 0.00 0.00 42.92 41.32 2bui s ASP 379 CO -0.01 -0.01 1.04 -0.60 0.21 0.00 0.00 175.17 175.80 2bui s ARG 380 N -0.33 0.52 -0.28 8.23 3.52 -0.55 -4.92 118.95 125.13 2bui s ARG 380 Ca 0.45 0.39 -0.29 0.00 -0.13 0.00 0.00 55.73 56.16 2bui s ARG 380 Cb -0.24 0.25 0.01 0.00 -1.56 0.00 0.00 34.95 33.41 2bui s ARG 380 CO 0.31 -0.11 1.09 -2.00 -0.81 0.00 0.00 175.30 173.78 2bui s GLU 381 N -0.32 4.12 0.15 5.12 2.12 -1.26 -3.16 118.70 125.47 2bui s GLU 381 Ca 0.01 1.20 0.05 0.00 0.36 0.00 0.00 54.97 56.60 2bui s GLU 381 Cb -0.03 -3.72 -0.04 0.00 0.26 0.00 0.00 34.13 30.60 2bui s GLU 381 CO -0.03 -0.83 0.08 -0.51 -0.54 0.00 0.00 175.26 173.43 2bui s LEU 382 N 3.56 3.63 0.00 2.70 1.43 -1.26 -5.02 118.68 123.72 2bui s LEU 382 Ca 0.46 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 2bui s LEU 382 Cb -0.14 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.81 2bui s LEU 382 CO 0.13 0.09 0.00 0.41 0.23 0.00 0.00 176.35 177.21 2bui n THR 383 N -0.13 0.00 -4.61 5.49 -1.04 -1.26 -4.90 114.28 107.83 2bui n THR 383 Ca -0.09 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.68 2bui n THR 383 Cb 0.54 -0.42 -0.16 0.00 -1.82 0.00 0.00 70.33 68.47 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 -1.63 1.15 0.05 12.58 2.01 -1.26 -0.67 115.64 127.88 2bui s THR 384 Ca 0.00 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.53 2bui s THR 384 Cb 0.00 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 2bui s THR 384 CO 0.00 0.35 -0.12 0.68 -0.69 0.00 0.00 174.62 174.85 2bui s VAL 385 N 0.49 0.89 -0.01 3.82 -7.23 0.37 -0.45 120.40 118.28 2bui s VAL 385 Ca -0.11 -1.14 0.08 0.00 -1.81 0.00 0.00 61.98 58.99 2bui s VAL 385 Cb -0.14 -0.87 -0.02 0.00 0.56 0.00 0.00 36.38 35.90 2bui s VAL 385 CO 0.03 -0.23 -0.24 -0.32 -0.31 0.00 0.00 175.10 174.03 2bui s MET 386 N -1.53 1.90 -0.08 4.82 -2.45 0.26 -0.61 119.30 121.62 2bui s MET 386 Ca -0.04 -0.90 -0.01 0.00 -1.25 0.00 0.00 55.69 53.49 2bui s MET 386 Cb -0.09 -1.88 0.03 0.00 1.25 0.00 0.00 34.83 34.13 2bui s MET 386 CO 0.01 0.51 -0.03 0.45 1.05 0.00 0.00 175.02 177.02 2bui s SER 387 N -0.70 1.60 0.07 1.11 0.15 -0.08 0.20 113.70 116.05 2bui s SER 387 Ca 0.10 -0.15 -0.03 0.00 0.70 0.00 0.00 55.95 56.56 2bui s SER 387 Cb -0.09 -0.54 -0.05 0.00 -1.71 0.00 0.00 66.02 63.63 2bui s SER 387 CO -0.00 -0.14 0.28 0.20 1.20 0.00 0.00 173.24 174.77 2bui s ASN 388 N 1.68 6.44 -0.12 5.45 0.01 -0.84 -1.89 114.94 125.66 2bui s ASN 388 Ca 0.01 0.46 -0.04 0.00 -0.71 0.00 0.00 52.86 52.58 2bui s ASN 388 Cb -0.13 -2.04 0.06 0.00 0.41 0.00 0.00 41.25 39.55 2bui s ASN 388 CO -0.05 0.16 0.20 -0.44 -1.51 0.00 0.00 177.10 175.46 2bui s SER 389 N -2.24 0.76 0.02 -1.22 0.01 -0.27 -3.68 113.70 107.08 2bui s SER 389 Ca 0.35 0.30 0.05 0.00 1.31 0.00 0.00 55.95 57.96 2bui s SER 389 Cb -0.13 0.42 -0.02 0.00 0.21 0.00 0.00 66.02 66.51 2bui s SER 389 CO 0.23 -0.26 -0.16 -0.36 0.41 0.00 0.00 173.24 173.10 2bui s PHE 390 N 2.34 1.41 0.21 2.43 0.08 -1.26 -0.84 117.98 122.34 2bui s PHE 390 Ca 0.03 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.77 2bui s PHE 390 Cb -0.13 -0.87 -0.05 0.00 -0.57 0.00 0.00 43.02 41.41 2bui s PHE 390 CO -0.08 0.02 0.08 0.20 -0.10 0.00 0.00 175.22 175.34 2bui s GLY 391 N -0.80 1.44 0.67 4.36 0.00 -0.43 -4.37 107.32 108.20 2bui s GLY 391 Ca 0.05 -1.71 -0.17 0.00 0.00 0.00 0.00 44.72 42.89 2bui s GLY 391 CO 0.01 -1.50 0.67 0.69 0.00 0.00 0.00 173.10 172.97 2bui n PHE 392 N -0.31 -0.27 -0.53 1.90 0.99 -1.26 -2.50 117.46 115.46 2bui n PHE 392 Ca -0.02 0.39 0.00 0.00 -0.00 0.00 0.00 57.45 57.83 2bui n PHE 392 Cb 0.65 -1.99 0.00 0.00 -1.00 0.00 0.00 39.48 37.14 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 1.54 0.75 3.42 1.37 0.00 0.11 -4.13 105.19 108.25 2bui n GLY 393 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.33 -0.42 3.68 -0.02 0.00 -1.04 -4.74 105.19 100.32 2bui n GLY 394 Ca 0.00 0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.30 5.31 0.02 2.61 -1.32 -1.06 -0.95 115.64 116.96 2bui s THR 395 Ca 0.52 0.16 0.08 0.00 -1.21 0.00 0.00 61.69 61.23 2bui s THR 395 Cb -0.23 -3.45 -0.02 0.00 -1.51 0.00 0.00 72.50 67.29 2bui s THR 395 CO 0.67 0.40 -0.22 0.20 -2.21 0.00 0.00 174.62 173.45 2bui s ASN 396 N 0.70 2.67 -0.07 8.08 0.01 -0.59 -1.31 114.94 124.43 2bui s ASN 396 Ca 0.07 -0.49 -0.06 0.00 -0.71 0.00 0.00 52.86 51.67 2bui s ASN 396 Cb -0.12 -0.26 0.02 0.00 0.41 0.00 0.00 41.25 41.30 2bui s ASN 396 CO 0.01 0.23 0.19 0.00 -1.51 0.00 0.00 177.10 176.01 2bui s ALA 397 N -0.69 -0.46 -0.02 0.60 0.00 -0.02 -1.83 121.76 119.34 2bui s ALA 397 Ca 0.09 0.52 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 2bui s ALA 397 Cb -0.09 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.75 2bui s ALA 397 CO 0.01 -0.09 0.05 0.99 0.00 0.00 0.00 175.76 176.72 2bui s THR 398 N 0.09 -0.04 -0.08 0.00 2.01 -0.43 -1.11 115.64 116.07 2bui s THR 398 Ca -0.00 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.19 2bui s THR 398 Cb -0.01 -0.10 -0.01 0.00 0.01 0.00 0.00 72.50 72.39 2bui s THR 398 CO 0.00 0.06 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.00 2bui s LEU 399 N 0.78 2.12 -0.15 4.42 1.43 -0.79 -0.91 118.68 125.58 2bui s LEU 399 Ca -0.06 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 2bui s LEU 399 Cb -0.09 -1.41 0.00 0.00 0.03 0.00 0.00 46.19 44.73 2bui s LEU 399 CO -0.03 0.20 -0.18 -0.69 0.23 0.00 0.00 176.35 175.88 2bui s VAL 400 N 0.12 2.43 0.01 -1.59 1.01 -0.17 -0.90 120.40 121.31 2bui s VAL 400 Ca -0.12 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.09 2bui s VAL 400 Cb -0.16 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2bui s VAL 400 CO 0.07 0.53 -0.25 -0.04 0.00 0.00 0.00 175.10 175.40 2bui s MET 401 N 0.81 1.90 0.00 2.72 -1.94 0.22 -1.82 119.30 121.19 2bui s MET 401 Ca -0.06 -0.98 0.00 0.00 -1.71 0.00 0.00 55.69 52.94 2bui s MET 401 Cb -0.15 -1.93 -0.00 0.00 2.01 0.00 0.00 34.83 34.75 2bui s MET 401 CO -0.01 0.52 -0.01 0.50 -0.01 0.00 0.00 175.02 176.01 2bui s ARG 402 N -0.88 0.11 0.52 2.03 3.52 -0.33 -0.48 118.95 123.44 2bui s ARG 402 Ca 0.10 -0.14 -0.22 0.00 -0.13 0.00 0.00 55.73 55.35 2bui s ARG 402 Cb -0.10 -0.03 -0.06 0.00 -1.56 0.00 0.00 34.95 33.21 2bui s ARG 402 CO 0.00 0.00 1.26 0.15 -0.81 0.00 0.00 175.30 175.91 2bui s LYS 403 N -0.29 3.37 0.06 5.12 1.02 0.15 -0.29 119.74 128.88 2bui s LYS 403 Ca -0.03 2.00 0.00 0.00 0.02 0.00 0.00 55.97 57.96 2bui s LYS 403 Cb -0.02 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.97 2bui s LYS 403 CO -0.00 -0.93 0.20 -0.51 -0.92 0.00 0.00 175.35 173.19 2bui s LEU 404 N -3.38 4.33 0.37 3.17 1.43 -1.26 -4.86 118.68 118.47 2bui s LEU 404 Ca 0.69 0.25 -0.28 0.00 -1.03 0.00 0.00 54.13 53.76 2bui s LEU 404 Cb -0.34 -2.93 -0.10 0.00 0.03 0.00 0.00 46.19 42.84 2bui s LEU 404 CO 0.41 0.17 1.43 -0.54 0.23 0.00 0.00 176.35 178.04 2bui s LYS 405 N -2.53 4.14 0.00 1.70 -0.14 -1.26 -5.11 119.74 116.54 2bui s LYS 405 Ca 0.35 2.45 0.00 0.00 -1.36 0.00 0.00 55.97 57.40 2bui s LYS 405 Cb -0.13 -2.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.06 2bui s LYS 405 CO 0.28 -0.46 0.00 -0.25 -0.76 0.00 0.00 175.35 174.16