#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nti s MET 2 N 0.00 1.12 -0.22 2.12 0.23 -1.25 -1.61 119.30 119.69 2nti s MET 2 Ca 0.00 -1.54 -0.11 0.00 -1.03 0.00 0.00 55.69 53.00 2nti s MET 2 Cb 0.00 -0.22 0.07 0.00 -1.53 0.00 0.00 34.83 33.16 2nti s MET 2 CO 0.00 -0.16 0.53 0.21 -2.03 0.00 0.00 175.02 173.57 2nti s LYS 3 N -3.94 0.51 -0.05 3.16 2.20 -0.22 -1.77 119.74 119.64 2nti s LYS 3 Ca 0.25 1.02 -0.02 0.00 -0.36 0.00 0.00 55.97 56.86 2nti s LYS 3 Cb 0.06 0.14 0.04 0.00 -1.51 0.00 0.00 37.83 36.56 2nti s LYS 3 CO 0.05 -0.17 0.10 0.00 -0.36 0.00 0.00 175.35 174.97 2nti s ALA 4 N 1.73 -0.14 -0.19 3.13 0.00 -0.11 -0.77 121.76 125.42 2nti s ALA 4 Ca -0.09 0.55 -0.03 0.00 0.00 0.00 0.00 51.96 52.39 2nti s ALA 4 Cb -0.08 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 2nti s ALA 4 CO -0.16 -0.14 -0.05 0.21 0.00 0.00 0.00 175.76 175.62 2nti s LYS 5 N 1.15 3.47 -0.20 0.00 2.20 -0.11 -0.58 119.74 125.67 2nti s LYS 5 Ca -0.09 -0.60 -0.06 0.00 -0.36 0.00 0.00 55.97 54.86 2nti s LYS 5 Cb -0.12 -2.93 -0.03 0.00 -1.51 0.00 0.00 37.83 33.24 2nti s LYS 5 CO -0.05 -0.00 0.03 0.08 -0.36 0.00 0.00 175.35 175.05 2nti s VAL 6 N 0.98 4.27 0.00 4.02 1.01 0.19 0.06 120.40 130.94 2nti s VAL 6 Ca -0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 2nti s VAL 6 Cb -0.15 -2.94 -0.18 0.00 0.00 0.00 0.00 36.38 33.12 2nti s VAL 6 CO 0.01 0.42 1.29 0.40 0.00 0.00 0.00 175.10 177.22 2nti h ILE 7 N 5.25 1.03 -2.88 2.22 1.08 -1.87 -0.99 117.51 121.35 2nti h ILE 7 Ca -0.36 -0.77 -0.75 0.00 -0.39 0.00 0.00 64.86 62.58 2nti h ILE 7 Cb 1.18 1.50 -0.22 0.00 -3.07 0.00 0.00 36.82 36.21 2nti h ILE 7 CO 0.63 0.18 0.79 -0.62 -0.69 0.00 0.00 178.15 178.43 2nti s ASP 8 N -5.37 7.00 0.29 1.72 -1.08 -1.26 -4.19 116.67 113.77 2nti s ASP 8 Ca -0.15 -2.91 0.04 0.00 -0.52 0.00 0.00 52.55 49.01 2nti s ASP 8 Cb 0.02 -2.32 0.43 0.00 -1.46 0.00 0.00 42.92 39.60 2nti s ASP 8 CO 0.61 -0.66 1.72 0.00 0.52 0.00 0.00 175.17 177.36 2nti h ALA 9 N 7.48 1.11 -0.03 3.66 0.00 -1.73 -3.00 119.26 126.75 2nti h ALA 9 Ca 0.21 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2nti h ALA 9 Cb 0.93 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2nti h ALA 9 CO 1.07 0.56 -0.02 0.28 0.00 0.00 0.00 179.25 181.14 2nti h VAL 10 N 0.35 0.94 -0.53 0.00 2.07 -1.87 -0.80 116.25 116.41 2nti h VAL 10 Ca 0.05 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.49 2nti h VAL 10 Cb 0.71 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2nti h VAL 10 CO 0.05 0.00 0.02 0.77 0.02 0.00 0.00 177.57 178.43 2nti h SER 11 N -0.02 0.86 -0.87 0.57 4.64 -1.76 -1.73 113.55 115.25 2nti h SER 11 Ca 0.02 -0.21 0.02 0.00 -0.47 0.00 0.00 61.79 61.15 2nti h SER 11 Cb 0.04 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 61.86 2nti h SER 11 CO -0.04 0.91 0.57 0.15 -0.87 0.00 0.00 176.83 177.55 2nti h PHE 12 N 0.83 1.07 0.00 4.77 3.57 -1.35 -1.90 116.94 123.93 2nti h PHE 12 Ca 0.16 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 2nti h PHE 12 Cb 0.47 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 2nti h PHE 12 CO 0.03 0.65 -0.21 0.66 -2.23 0.00 0.00 178.31 177.20 2nti h SER 13 N 1.13 0.00 1.37 0.41 4.64 -0.25 -2.29 113.55 118.56 2nti h SER 13 Ca 0.33 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.58 2nti h SER 13 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 2nti h SER 13 CO -0.09 0.21 -0.34 1.88 -0.87 0.00 0.00 176.83 177.62 2nti h TYR 14 N 0.00 0.00 -0.12 4.77 -1.99 -0.94 -0.69 116.97 118.00 2nti h TYR 14 Ca -0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2nti h TYR 14 Cb 0.73 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.46 2nti h TYR 14 CO 0.00 0.34 -0.01 0.82 -0.00 0.00 0.00 178.16 179.31 2nti h ILE 15 N 0.00 1.27 -0.29 -2.88 2.04 -1.17 -2.18 117.51 114.30 2nti h ILE 15 Ca -0.00 -0.88 -0.13 0.00 1.00 0.00 0.00 64.86 64.85 2nti h ILE 15 Cb 1.12 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 2nti h ILE 15 CO 0.04 0.25 -0.35 -0.07 0.00 0.00 0.00 178.15 178.02 2nti h LEU 16 N -0.07 0.67 -0.99 1.44 -0.00 -1.43 -1.46 115.31 113.47 2nti h LEU 16 Ca 0.03 -0.28 0.06 0.00 -0.00 0.00 0.00 57.88 57.69 2nti h LEU 16 Cb 0.39 -0.19 -0.07 0.00 -0.00 0.00 0.00 40.66 40.80 2nti h LEU 16 CO 0.01 0.96 0.64 0.03 -0.00 0.00 0.00 178.44 180.08 2nti h ARG 17 N 0.53 1.14 -0.27 1.13 -0.00 -1.14 0.04 114.38 115.82 2nti h ARG 17 Ca 0.05 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.98 59.42 2nti h ARG 17 Cb 0.86 -0.26 -0.01 0.00 0.00 0.00 0.00 29.97 30.56 2nti h ARG 17 CO 0.07 0.75 -0.00 1.15 0.00 0.00 0.00 179.97 181.94 2nti h THR 18 N 1.17 1.26 -0.86 2.04 2.02 -0.75 -2.81 112.91 114.98 2nti h THR 18 Ca 0.42 -0.93 0.03 0.00 0.77 0.00 0.00 66.41 66.71 2nti h THR 18 Cb 0.14 1.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 2nti h THR 18 CO -0.17 0.29 0.55 0.58 0.37 0.00 0.00 175.52 177.15 2nti h VAL 19 N 0.25 1.14 -0.20 3.16 2.07 -0.94 -2.16 116.25 119.57 2nti h VAL 19 Ca 0.08 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.28 2nti h VAL 19 Cb 0.43 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2nti h VAL 19 CO 0.01 0.20 0.19 1.23 0.02 0.00 0.00 177.57 179.22 2nti h GLY 20 N 1.08 0.00 2.00 2.17 0.00 -0.74 0.06 103.07 107.64 2nti h GLY 20 Ca 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 2nti h GLY 20 CO -0.12 0.00 -0.08 -0.55 0.00 0.00 0.00 176.54 175.79 2nti h ASP 21 N 0.00 0.00 0.00 0.19 3.45 -1.24 -3.31 116.42 115.51 2nti h ASP 21 Ca 0.09 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.43 2nti h ASP 21 Cb 0.47 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.22 2nti h ASP 21 CO -0.00 0.08 -1.50 0.49 -1.57 0.00 0.00 179.24 176.74 2nti n PHE 22 N -3.31 0.00 -4.38 4.55 3.01 -0.14 -5.05 117.46 112.15 2nti n PHE 22 Ca -0.01 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.19 2nti n PHE 22 Cb 0.28 -0.35 -0.13 0.00 -0.01 0.00 0.00 39.48 39.27 2nti n PHE 22 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2nti s LEU 23 N -4.45 2.29 -0.14 4.37 1.43 -0.35 -4.22 118.68 117.61 2nti s LEU 23 Ca -0.04 -0.70 0.07 0.00 -1.03 0.00 0.00 54.13 52.43 2nti s LEU 23 Cb 0.03 -1.05 -0.23 0.00 0.03 0.00 0.00 46.19 44.97 2nti s LEU 23 CO 0.31 0.12 0.28 -1.20 0.23 0.00 0.00 176.35 176.09 2nti n SER 24 N 1.09 1.22 -4.07 2.29 7.64 -1.26 -4.46 113.62 116.07 2nti n SER 24 Ca -0.19 0.16 -0.11 0.00 1.01 0.00 0.00 58.87 59.74 2nti n SER 24 Cb 0.53 -0.10 -0.11 0.00 -1.01 0.00 0.00 64.21 63.52 2nti n SER 24 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2nti s GLU 25 N -2.55 0.54 0.26 1.43 2.02 -1.26 -0.66 118.70 118.48 2nti s GLU 25 Ca -0.16 -0.87 -0.21 0.00 0.02 0.00 0.00 54.97 53.75 2nti s GLU 25 Cb 0.07 -0.14 0.03 0.00 0.10 0.00 0.00 34.13 34.19 2nti s GLU 25 CO 0.77 0.00 0.68 0.00 0.02 0.00 0.00 175.26 176.73 2nti s ALA 26 N -2.02 -1.21 -0.09 5.21 0.00 -0.83 -4.93 121.76 117.88 2nti s ALA 26 Ca -0.06 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.69 2nti s ALA 26 Cb -0.06 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 2nti s ALA 26 CO -0.02 -0.98 -0.14 -0.80 0.00 0.00 0.00 175.76 173.81 2nti s ASN 27 N -2.90 3.96 -0.33 0.00 0.02 -1.26 -0.98 114.94 113.44 2nti s ASN 27 Ca 0.10 -0.28 -0.29 0.00 -1.02 0.00 0.00 52.86 51.37 2nti s ASN 27 Cb -0.05 -1.24 0.02 0.00 0.02 0.00 0.00 41.25 40.00 2nti s ASN 27 CO 0.04 0.25 1.13 -0.36 0.02 0.00 0.00 177.10 178.17 2nti s PHE 28 N -0.15 3.03 -0.46 2.20 2.99 0.28 -4.45 117.98 121.42 2nti s PHE 28 Ca -0.01 1.09 -0.20 0.00 0.00 0.00 0.00 56.93 57.80 2nti s PHE 28 Cb -0.14 -3.80 0.03 0.00 0.00 0.00 0.00 43.02 39.12 2nti s PHE 28 CO 0.03 -1.00 0.66 0.42 -0.00 0.00 0.00 175.22 175.33 2nti s ILE 29 N 3.86 4.81 -0.24 0.64 -1.09 0.84 -1.58 121.20 128.44 2nti s ILE 29 Ca 0.48 -0.03 -0.08 0.00 -2.23 0.00 0.00 60.65 58.78 2nti s ILE 29 Cb -0.13 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.47 2nti s ILE 29 CO 0.18 -0.68 0.10 -0.69 -1.23 0.00 0.00 174.94 172.61 2nti s VAL 30 N 2.84 4.62 0.41 2.92 1.01 0.43 -1.14 120.40 131.51 2nti s VAL 30 Ca 0.21 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.17 2nti s VAL 30 Cb -0.15 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 2nti s VAL 30 CO 0.17 0.34 0.17 0.35 0.00 0.00 0.00 175.10 176.13 2nti n THR 31 N 4.69 0.00 0.30 3.92 -2.24 -0.62 -0.94 114.28 119.39 2nti n THR 31 Ca -0.16 -2.48 0.17 0.00 -2.27 0.00 0.00 64.05 59.32 2nti n THR 31 Cb 0.52 0.94 0.75 0.00 -2.10 0.00 0.00 70.33 70.43 2nti n THR 31 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2nti h LYS 32 N 0.00 0.00 0.00 -0.78 -0.00 -1.85 -2.53 116.57 111.41 2nti h LYS 32 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.33 2nti h LYS 32 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.49 2nti h LYS 32 CO 0.50 0.00 -0.42 -0.85 -0.00 0.00 0.00 179.45 178.68 2nti n GLU 33 N -2.95 0.14 -0.38 0.07 0.00 -1.26 -4.73 120.64 111.53 2nti n GLU 33 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 57.16 57.22 2nti n GLU 33 Cb 0.25 -1.60 0.00 0.00 0.00 0.00 0.00 31.44 30.08 2nti n GLU 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nti n GLY 34 N 1.42 0.48 3.20 -1.84 0.00 -0.96 -0.67 105.19 106.83 2nti n GLY 34 Ca 0.05 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 2nti n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nti s ILE 35 N -3.63 1.92 0.01 -0.61 1.01 0.27 -1.59 121.20 118.58 2nti s ILE 35 Ca 0.00 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 59.77 2nti s ILE 35 Cb 0.00 -1.65 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 2nti s ILE 35 CO 0.00 0.53 -0.22 -0.60 0.00 0.00 0.00 174.94 174.65 2nti s ARG 36 N 0.24 1.67 -0.08 2.79 3.52 -0.29 -0.45 118.95 126.34 2nti s ARG 36 Ca -0.14 -0.88 -0.01 0.00 -0.13 0.00 0.00 55.73 54.57 2nti s ARG 36 Cb -0.16 -1.70 0.03 0.00 -1.56 0.00 0.00 34.95 31.56 2nti s ARG 36 CO 0.07 0.45 -0.04 0.08 -0.81 0.00 0.00 175.30 175.05 2nti s VAL 37 N -0.64 0.64 0.08 7.11 1.01 -0.23 -0.11 120.40 128.25 2nti s VAL 37 Ca 0.09 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.05 2nti s VAL 37 Cb -0.09 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 2nti s VAL 37 CO 0.00 0.29 -0.14 -0.44 0.00 0.00 0.00 175.10 174.82 2nti s SER 38 N 1.69 1.73 -0.23 3.32 0.01 -1.26 -0.30 113.70 118.66 2nti s SER 38 Ca 0.02 -0.66 -0.36 0.00 1.31 0.00 0.00 55.95 56.26 2nti s SER 38 Cb -0.13 -0.05 0.15 0.00 0.21 0.00 0.00 66.02 66.20 2nti s SER 38 CO -0.05 -0.09 1.27 -0.83 0.41 0.00 0.00 173.24 173.95 2nti s GLY 39 N -1.89 -0.23 -0.10 3.44 0.00 -0.72 -4.56 107.32 103.26 2nti s GLY 39 Ca 0.00 1.80 0.02 0.00 0.00 0.00 0.00 44.72 46.55 2nti s GLY 39 CO 0.02 0.62 -0.18 -0.42 0.00 0.00 0.00 173.10 173.14 2nti s ILE 40 N -2.17 2.62 0.87 0.90 1.01 -1.26 -0.78 121.20 122.40 2nti s ILE 40 Ca 0.10 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.81 2nti s ILE 40 Cb -0.01 -2.05 0.12 0.00 0.01 0.00 0.00 42.46 40.53 2nti s ILE 40 CO -0.04 0.55 1.10 1.51 0.00 0.00 0.00 174.94 178.06 2nti s ASP 41 N 0.15 3.57 0.39 3.58 -4.77 -0.62 -4.91 116.67 114.06 2nti s ASP 41 Ca -0.10 1.72 0.14 0.00 -3.30 0.00 0.00 52.55 51.01 2nti s ASP 41 Cb -0.16 -2.36 0.80 0.00 -1.09 0.00 0.00 42.92 40.11 2nti s ASP 41 CO 0.06 -2.61 1.85 1.55 0.70 0.00 0.00 175.17 176.72 2nti h PRO 42 N -1.53 0.00 0.00 2.11 0.13 -1.93 -1.39 132.00 129.39 2nti h PRO 42 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2nti h PRO 42 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2nti h PRO 42 CO 0.51 0.34 0.00 -1.13 -0.23 0.00 0.00 178.00 177.49 2nti n SER 43 N -4.04 0.07 -1.62 1.44 3.41 -1.26 -4.90 113.62 106.72 2nti n SER 43 Ca -0.02 0.51 -0.17 0.00 -0.26 0.00 0.00 58.87 58.94 2nti n SER 43 Cb 0.39 -0.53 -0.04 0.00 -0.26 0.00 0.00 64.21 63.77 2nti n SER 43 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2nti n ARG 44 N -1.58 -1.25 -0.04 4.33 1.74 -0.53 -4.88 116.66 114.46 2nti n ARG 44 Ca 0.04 0.93 -0.06 0.00 -0.77 0.00 0.00 57.85 57.99 2nti n ARG 44 Cb 0.23 -5.26 -0.14 0.00 -1.02 0.00 0.00 32.46 26.27 2nti n ARG 44 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2nti n VAL 45 N -3.35 1.35 -4.90 1.55 0.31 -1.26 -4.92 118.33 107.11 2nti n VAL 45 Ca -0.18 -0.78 -0.31 0.00 -0.01 0.00 0.00 64.34 63.06 2nti n VAL 45 Cb 0.60 -0.71 -0.17 0.00 -0.91 0.00 0.00 33.84 32.65 2nti n VAL 45 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2nti s VAL 46 N -2.68 1.89 -0.14 2.52 1.01 -1.26 -0.17 120.40 121.57 2nti s VAL 46 Ca -0.06 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2nti s VAL 46 Cb 0.08 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2nti s VAL 46 CO 0.83 0.52 -0.01 0.12 0.00 0.00 0.00 175.10 176.56 2nti s PHE 47 N 0.60 3.09 0.10 5.22 5.36 -0.16 -1.58 117.98 130.61 2nti s PHE 47 Ca -0.13 -0.11 0.09 0.00 -0.96 0.00 0.00 56.93 55.82 2nti s PHE 47 Cb -0.17 -1.93 -0.03 0.00 -0.34 0.00 0.00 43.02 40.55 2nti s PHE 47 CO 0.04 0.13 -0.22 -0.48 -1.46 0.00 0.00 175.22 173.22 2nti s LEU 48 N 0.04 2.29 -0.25 6.12 0.05 0.04 0.38 118.68 127.34 2nti s LEU 48 Ca 0.02 -0.68 -0.02 0.00 0.05 0.00 0.00 54.13 53.50 2nti s LEU 48 Cb -0.13 -0.97 0.14 0.00 -2.05 0.00 0.00 46.19 43.18 2nti s LEU 48 CO 0.02 0.10 0.38 -0.62 -0.55 0.00 0.00 176.35 175.68 2nti s ASP 49 N -1.84 0.26 -0.17 1.48 2.15 0.41 -1.76 116.67 117.21 2nti s ASP 49 Ca 0.08 0.14 -0.05 0.00 0.43 0.00 0.00 52.55 53.15 2nti s ASP 49 Cb -0.10 1.12 -0.03 0.00 -0.30 0.00 0.00 42.92 43.61 2nti s ASP 49 CO 0.04 -0.31 -0.00 -0.63 -0.17 0.00 0.00 175.17 174.10 2nti s ILE 50 N 2.55 4.16 -0.12 4.11 -1.09 0.59 -0.40 121.20 130.99 2nti s ILE 50 Ca 0.12 -0.26 -0.00 0.00 -2.23 0.00 0.00 60.65 58.28 2nti s ILE 50 Cb -0.15 -2.84 0.02 0.00 -1.58 0.00 0.00 42.46 37.91 2nti s ILE 50 CO -0.18 0.48 -0.09 0.12 -1.23 0.00 0.00 174.94 174.03 2nti s PHE 51 N 0.43 1.68 -0.37 3.97 5.36 -0.07 -1.07 117.98 127.91 2nti s PHE 51 Ca -0.02 -0.88 -0.05 0.00 -0.96 0.00 0.00 56.93 55.02 2nti s PHE 51 Cb -0.14 -1.33 0.07 0.00 -0.34 0.00 0.00 43.02 41.28 2nti s PHE 51 CO 0.02 -0.56 0.15 -0.51 -1.46 0.00 0.00 175.22 172.86 2nti s LEU 52 N 1.65 4.69 0.72 6.12 1.43 0.40 -1.89 118.68 131.80 2nti s LEU 52 Ca 0.05 -1.50 -0.15 0.00 -1.03 0.00 0.00 54.13 51.49 2nti s LEU 52 Cb -0.13 -1.85 0.03 0.00 0.03 0.00 0.00 46.19 44.27 2nti s LEU 52 CO -0.09 -0.43 1.20 -2.84 0.23 0.00 0.00 176.35 174.42 2nti s PRO 53 N 1.30 2.23 0.41 1.29 0.02 -1.26 -0.56 135.00 138.44 2nti s PRO 53 Ca 0.01 1.72 0.20 0.00 0.02 0.00 0.00 61.00 62.95 2nti s PRO 53 Cb -0.21 -1.85 1.13 0.00 0.02 0.00 0.00 34.50 33.59 2nti s PRO 53 CO -0.00 -1.75 1.79 0.66 -0.33 0.00 0.00 177.00 177.36 2nti h SER 54 N -0.23 0.41 1.02 2.53 4.64 -1.18 0.72 113.55 121.46 2nti h SER 54 Ca -0.48 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2nti h SER 54 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2nti h SER 54 CO 0.50 0.09 0.00 -1.20 -0.87 0.00 0.00 176.83 175.35 2nti n SER 55 N -4.58 0.63 0.22 4.97 7.64 -1.26 -1.60 113.62 119.65 2nti n SER 55 Ca 0.24 0.61 0.07 0.00 1.01 0.00 0.00 58.87 60.80 2nti n SER 55 Cb 0.88 -0.76 0.53 0.00 -1.01 0.00 0.00 64.21 63.85 2nti n SER 55 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2nti h TYR 56 N 0.00 0.00 -3.11 1.43 5.03 -1.12 -3.43 116.97 115.77 2nti h TYR 56 Ca 0.00 0.00 -0.59 0.00 2.58 0.00 0.00 58.73 60.72 2nti h TYR 56 Cb 0.51 0.00 -0.05 0.00 1.55 0.00 0.00 36.73 38.74 2nti h TYR 56 CO 0.00 0.22 -0.20 -0.06 -1.32 0.00 0.00 178.16 176.80 2nti s PHE 57 N -4.37 3.65 0.20 -3.82 0.40 -0.63 -4.82 117.98 108.59 2nti s PHE 57 Ca -0.03 0.92 -0.08 0.00 -0.60 0.00 0.00 56.93 57.14 2nti s PHE 57 Cb 0.15 -2.25 0.12 0.00 0.51 0.00 0.00 43.02 41.55 2nti s PHE 57 CO 0.67 0.55 1.73 1.49 0.70 0.00 0.00 175.22 180.37 2nti h GLU 58 N 4.09 1.14 -4.25 0.44 4.57 -0.64 -3.43 114.58 116.49 2nti h GLU 58 Ca -0.50 -0.25 -0.28 0.00 -1.18 0.00 0.00 59.36 57.15 2nti h GLU 58 Cb 1.20 -0.16 -0.25 0.00 -0.16 0.00 0.00 28.75 29.38 2nti h GLU 58 CO 0.64 0.98 -0.74 0.20 -1.18 0.00 0.00 179.01 178.91 2nti s GLY 59 N -3.40 0.28 -0.19 1.92 0.00 -1.24 -4.96 107.32 99.72 2nti s GLY 59 Ca -0.12 -0.39 -0.06 0.00 0.00 0.00 0.00 44.72 44.15 2nti s GLY 59 CO 0.84 -0.39 0.38 -0.12 0.00 0.00 0.00 173.10 173.81 2nti s PHE 60 N -0.62 -0.71 -0.03 1.90 5.36 -1.25 -0.93 117.98 121.69 2nti s PHE 60 Ca -0.04 1.28 0.00 0.00 -0.96 0.00 0.00 56.93 57.22 2nti s PHE 60 Cb -0.05 0.18 0.03 0.00 -0.34 0.00 0.00 43.02 42.84 2nti s PHE 60 CO -0.00 -0.49 0.00 -1.21 -1.46 0.00 0.00 175.22 172.06 2nti s GLU 61 N 2.56 0.28 0.16 10.12 2.02 0.05 -5.00 118.70 128.89 2nti s GLU 61 Ca 0.01 0.09 0.08 0.00 0.02 0.00 0.00 54.97 55.17 2nti s GLU 61 Cb -0.13 -0.48 -0.04 0.00 0.10 0.00 0.00 34.13 33.59 2nti s GLU 61 CO -0.12 -0.14 -0.18 0.14 0.02 0.00 0.00 175.26 174.97 2nti s VAL 62 N 1.06 1.77 -0.62 2.63 -7.23 -1.26 -1.05 120.40 115.70 2nti s VAL 62 Ca -0.09 -1.89 0.08 0.00 -1.81 0.00 0.00 61.98 58.27 2nti s VAL 62 Cb -0.13 -1.81 -0.03 0.00 0.56 0.00 0.00 36.38 34.97 2nti s VAL 62 CO -0.02 -0.32 0.49 -1.54 -0.31 0.00 0.00 175.10 173.40 2nti n SER 63 N 0.33 0.86 -4.15 4.85 3.41 -0.63 -4.98 113.62 113.31 2nti n SER 63 Ca -0.14 -0.93 -0.10 0.00 -0.26 0.00 0.00 58.87 57.45 2nti n SER 63 Cb 0.57 0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 65.04 2nti n SER 63 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2nti s GLN 64 N -1.33 0.86 0.09 4.33 0.74 -1.26 -4.90 119.66 118.19 2nti s GLN 64 Ca 0.05 -1.38 -0.19 0.00 0.05 0.00 0.00 55.36 53.90 2nti s GLN 64 Cb 0.06 0.06 -0.08 0.00 1.10 0.00 0.00 33.01 34.15 2nti s GLN 64 CO 0.23 -0.16 1.54 0.93 -0.55 0.00 0.00 175.29 177.29 2nti h GLU 65 N 2.92 0.42 -3.29 1.67 5.08 -1.97 -3.44 114.58 115.98 2nti h GLU 65 Ca -0.35 -0.12 -0.26 0.00 -1.00 0.00 0.00 59.36 57.63 2nti h GLU 65 Cb 1.18 -0.04 -0.32 0.00 0.50 0.00 0.00 28.75 30.06 2nti h GLU 65 CO 0.63 0.57 -0.62 0.15 -1.00 0.00 0.00 179.01 178.73 2nti s LYS 66 N -5.09 0.07 -0.10 2.33 1.02 -1.26 -4.37 119.74 112.33 2nti s LYS 66 Ca -0.14 0.35 0.03 0.00 0.02 0.00 0.00 55.97 56.23 2nti s LYS 66 Cb 0.07 -0.20 0.01 0.00 -0.52 0.00 0.00 37.83 37.20 2nti s LYS 66 CO 0.74 -0.17 -0.18 -2.00 -0.92 0.00 0.00 175.35 172.81 2nti s GLU 67 N 1.21 2.49 -0.28 1.68 2.12 -0.11 -4.98 118.70 120.82 2nti s GLU 67 Ca -0.09 -0.67 -0.08 0.00 0.36 0.00 0.00 54.97 54.50 2nti s GLU 67 Cb -0.12 -2.01 -0.01 0.00 0.26 0.00 0.00 34.13 32.25 2nti s GLU 67 CO -0.05 0.03 0.10 0.42 -0.54 0.00 0.00 175.26 175.21 2nti s ILE 68 N 0.73 4.27 -0.34 -3.70 1.01 -1.26 -0.43 121.20 121.48 2nti s ILE 68 Ca -0.11 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.15 2nti s ILE 68 Cb -0.16 -3.12 0.10 0.00 0.01 0.00 0.00 42.46 39.29 2nti s ILE 68 CO 0.02 0.18 0.06 -0.63 0.00 0.00 0.00 174.94 174.57 2nti s ILE 69 N 1.58 2.41 0.21 2.92 1.01 -0.61 -4.96 121.20 123.75 2nti s ILE 69 Ca 0.05 -2.27 -0.27 0.00 0.00 0.00 0.00 60.65 58.15 2nti s ILE 69 Cb -0.16 -2.74 -0.09 0.00 0.01 0.00 0.00 42.46 39.48 2nti s ILE 69 CO 0.04 -0.58 0.86 -0.83 0.00 0.00 0.00 174.94 174.42 2nti s GLY 70 N 1.03 2.99 0.02 6.18 0.00 -1.25 -0.56 107.32 115.74 2nti s GLY 70 Ca 0.10 0.48 -0.17 0.00 0.00 0.00 0.00 44.72 45.12 2nti s GLY 70 CO -0.07 1.01 0.38 -0.11 0.00 0.00 0.00 173.10 174.30 2nti s PHE 71 N -1.21 -0.24 -0.17 1.90 -0.12 -0.16 -2.64 117.98 115.36 2nti s PHE 71 Ca 0.39 0.24 -0.20 0.00 -0.05 0.00 0.00 56.93 57.31 2nti s PHE 71 Cb -0.24 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.30 2nti s PHE 71 CO 0.28 -0.52 0.59 0.21 -0.05 0.00 0.00 175.22 175.73 2nti s LYS 72 N -2.13 4.26 0.23 1.99 2.20 -1.26 -1.97 119.74 123.05 2nti s LYS 72 Ca -0.08 0.57 -0.08 0.00 -0.36 0.00 0.00 55.97 56.03 2nti s LYS 72 Cb -0.02 -3.53 0.22 0.00 -1.51 0.00 0.00 37.83 32.99 2nti s LYS 72 CO -0.00 -0.11 1.89 -0.07 -0.36 0.00 0.00 175.35 176.70 2nti h LEU 73 N 7.71 0.96 -0.74 5.43 3.38 -1.19 -0.82 115.31 130.04 2nti h LEU 73 Ca -0.35 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2nti h LEU 73 Cb 1.16 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 2nti h LEU 73 CO 0.76 0.68 0.48 -0.08 0.09 0.00 0.00 178.44 180.37 2nti h GLU 74 N 1.13 0.98 -0.18 1.13 4.81 -1.89 0.19 114.58 120.75 2nti h GLU 74 Ca 0.33 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.42 2nti h GLU 74 Cb -0.08 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.08 2nti h GLU 74 CO -0.09 0.66 -0.14 -0.44 -0.73 0.00 0.00 179.01 178.28 2nti h ASP 75 N 1.01 0.43 -0.70 1.04 3.32 -1.82 0.08 116.42 119.78 2nti h ASP 75 Ca 0.27 -0.46 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 2nti h ASP 75 Cb -0.10 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2nti h ASP 75 CO -0.06 0.80 0.26 0.58 -1.72 0.00 0.00 179.24 179.10 2nti h VAL 76 N 0.07 1.25 -0.16 -1.35 2.07 -1.00 -2.88 116.25 114.25 2nti h VAL 76 Ca 0.03 -0.81 -0.12 0.00 0.82 0.00 0.00 66.70 66.62 2nti h VAL 76 Cb 0.66 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2nti h VAL 76 CO 0.04 0.32 -0.44 0.78 0.02 0.00 0.00 177.57 178.29 2nti h ASN 77 N 1.01 0.41 -0.91 0.57 2.35 -0.58 -1.13 115.58 117.30 2nti h ASN 77 Ca 0.23 -0.18 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2nti h ASN 77 Cb 0.24 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.44 2nti h ASN 77 CO -0.02 0.80 0.59 0.44 -1.65 0.00 0.00 177.43 177.59 2nti h ASP 78 N 0.31 0.89 -0.04 5.81 3.32 -0.77 0.19 116.42 126.13 2nti h ASP 78 Ca 0.02 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 2nti h ASP 78 Cb 0.90 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 40.28 2nti h ASP 78 CO 0.08 0.56 -0.37 0.40 -1.72 0.00 0.00 179.24 178.18 2nti h ILE 79 N 1.00 1.44 0.00 0.35 2.04 -1.32 -3.20 117.51 117.82 2nti h ILE 79 Ca 0.40 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2nti h ILE 79 Cb 0.25 2.45 -0.00 0.00 -0.74 0.00 0.00 36.82 38.78 2nti h ILE 79 CO -0.16 0.53 -0.07 -0.07 0.00 0.00 0.00 178.15 178.38 2nti h LEU 80 N -0.19 0.00 -0.05 1.44 3.38 -0.65 0.35 115.31 119.59 2nti h LEU 80 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2nti h LEU 80 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2nti h LEU 80 CO 0.08 0.07 0.00 0.29 0.09 0.00 0.00 178.44 178.96 2nti n LYS 81 N -3.32 0.02 -0.10 1.13 5.02 0.61 -2.43 118.16 119.09 2nti n LYS 81 Ca -0.01 0.23 0.11 0.00 -2.02 0.00 0.00 58.31 56.62 2nti n LYS 81 Cb 0.24 -1.53 0.33 0.00 -0.02 0.00 0.00 35.03 34.06 2nti n LYS 81 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2nti n ARG 82 N -1.56 1.90 -2.13 1.97 5.12 0.11 -4.96 116.66 117.12 2nti n ARG 82 Ca 0.04 -1.36 -0.39 0.00 -1.93 0.00 0.00 57.85 54.22 2nti n ARG 82 Cb 0.20 -1.42 -0.01 0.00 -1.16 0.00 0.00 32.46 30.07 2nti n ARG 82 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2nti s VAL 83 N -1.74 2.80 0.14 1.55 0.11 -1.02 -5.04 120.40 117.21 2nti s VAL 83 Ca 0.33 0.67 0.03 0.00 -2.93 0.00 0.00 61.98 60.09 2nti s VAL 83 Cb 0.19 -3.38 -0.04 0.00 -1.53 0.00 0.00 36.38 31.62 2nti s VAL 83 CO 0.27 0.06 0.21 -0.76 -3.33 0.00 0.00 175.10 171.56 2nti s LEU 84 N -2.66 4.11 0.13 2.54 1.43 -1.26 -5.01 118.68 117.96 2nti s LEU 84 Ca 0.59 0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.68 2nti s LEU 84 Cb -0.34 -2.71 0.17 0.00 0.03 0.00 0.00 46.19 43.34 2nti s LEU 84 CO 0.43 0.07 0.81 1.17 0.23 0.00 0.00 176.35 179.07 2nti n LYS 85 N -0.35 -0.09 -0.16 1.70 0.00 -1.26 -0.40 118.16 117.59 2nti n LYS 85 Ca -0.07 0.81 0.08 0.00 0.00 0.00 0.00 58.31 59.12 2nti n LYS 85 Cb 0.54 -1.20 0.16 0.00 0.00 0.00 0.00 35.03 34.53 2nti n LYS 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2nti n ASP 86 N -4.80 2.95 -4.70 3.14 8.00 -1.26 -4.82 116.55 115.06 2nti n ASP 86 Ca 0.06 -1.88 -0.43 0.00 0.71 0.00 0.00 54.79 53.26 2nti n ASP 86 Cb 0.23 -0.21 -0.01 0.00 -0.02 0.00 0.00 41.12 41.11 2nti n ASP 86 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2nti n ASP 87 N 0.90 2.79 -4.89 -2.24 10.43 0.46 -4.80 116.55 119.21 2nti n ASP 87 Ca 0.14 1.21 -0.32 0.00 2.57 0.00 0.00 54.79 58.38 2nti n ASP 87 Cb 0.46 -1.49 -0.05 0.00 1.84 0.00 0.00 41.12 41.88 2nti n ASP 87 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 2nti s THR 88 N -1.05 5.19 -0.05 -3.53 2.01 0.16 -3.35 115.64 115.02 2nti s THR 88 Ca 0.56 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.71 2nti s THR 88 Cb -0.57 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.31 2nti s THR 88 CO 0.62 0.13 -0.21 -0.22 -0.69 0.00 0.00 174.62 174.24 2nti s LEU 89 N -2.40 2.00 -0.23 4.42 2.96 -0.38 -0.72 118.68 124.34 2nti s LEU 89 Ca 0.37 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2nti s LEU 89 Cb -0.13 -1.19 0.05 0.00 0.50 0.00 0.00 46.19 45.42 2nti s LEU 89 CO 0.22 0.21 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.70 2nti s ILE 90 N -0.09 2.03 -0.09 6.68 1.01 -0.29 0.57 121.20 131.02 2nti s ILE 90 Ca -0.03 -1.32 -0.25 0.00 0.00 0.00 0.00 60.65 59.05 2nti s ILE 90 Cb -0.12 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 2nti s ILE 90 CO 0.03 0.17 0.80 -0.76 0.00 0.00 0.00 174.94 175.18 2nti s LEU 91 N 1.21 4.27 0.10 2.97 1.02 0.25 -1.74 118.68 126.77 2nti s LEU 91 Ca -0.03 1.27 0.01 0.00 0.02 0.00 0.00 54.13 55.39 2nti s LEU 91 Cb -0.17 -3.23 -0.04 0.00 0.02 0.00 0.00 46.19 42.77 2nti s LEU 91 CO -0.08 -0.25 -0.03 -0.94 0.02 0.00 0.00 176.35 175.07 2nti s SER 92 N 0.97 0.90 0.04 2.29 1.04 -0.25 -0.93 113.70 117.76 2nti s SER 92 Ca 0.40 -1.05 -0.04 0.00 0.48 0.00 0.00 55.95 55.74 2nti s SER 92 Cb -0.18 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 2nti s SER 92 CO 0.18 -0.54 0.06 -0.55 0.98 0.00 0.00 173.24 173.37 2nti s SER 93 N -3.04 0.22 0.14 7.02 0.15 -0.73 -0.43 113.70 117.04 2nti s SER 93 Ca 0.14 -0.58 0.02 0.00 0.70 0.00 0.00 55.95 56.24 2nti s SER 93 Cb 0.06 0.20 -0.01 0.00 -1.71 0.00 0.00 66.02 64.57 2nti s SER 93 CO -0.04 -0.48 0.14 -0.46 1.20 0.00 0.00 173.24 173.60 2nti n ASN 94 N 0.84 -0.35 0.33 5.45 0.23 -0.79 -3.78 115.26 117.19 2nti n ASN 94 Ca -0.19 -1.89 0.21 0.00 -0.53 0.00 0.00 54.58 52.17 2nti n ASN 94 Cb 0.58 0.78 1.10 0.00 -2.08 0.00 0.00 39.78 40.16 2nti n ASN 94 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2nti h GLU 95 N 0.00 0.00 0.00 -3.83 4.11 -2.01 -3.14 114.58 109.70 2nti h GLU 95 Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2nti h GLU 95 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2nti h GLU 95 CO 0.15 0.00 -0.20 -1.13 0.07 0.00 0.00 179.01 177.89 2nti n SER 96 N -2.99 1.01 -3.94 3.06 3.41 -1.26 -4.97 113.62 107.95 2nti n SER 96 Ca -0.03 -0.23 -0.11 0.00 -0.26 0.00 0.00 58.87 58.24 2nti n SER 96 Cb 0.13 0.67 -0.12 0.00 -0.26 0.00 0.00 64.21 64.63 2nti n SER 96 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2nti s LYS 97 N -0.87 0.20 -0.16 4.33 2.20 -1.19 -1.66 119.74 122.58 2nti s LYS 97 Ca 0.00 -0.36 -0.04 0.00 -0.36 0.00 0.00 55.97 55.21 2nti s LYS 97 Cb 0.00 0.02 -0.03 0.00 -1.51 0.00 0.00 37.83 36.32 2nti s LYS 97 CO 0.00 -0.02 -0.03 -1.17 -0.36 0.00 0.00 175.35 173.77 2nti s LEU 98 N -0.83 3.26 -0.08 5.43 0.20 0.67 -1.88 118.68 125.44 2nti s LEU 98 Ca -0.09 -0.14 0.04 0.00 0.69 0.00 0.00 54.13 54.63 2nti s LEU 98 Cb -0.06 -1.79 -0.01 0.00 -0.43 0.00 0.00 46.19 43.90 2nti s LEU 98 CO -0.00 0.15 -0.20 -0.89 -0.29 0.00 0.00 176.35 175.12 2nti s THR 99 N 0.46 2.47 -0.23 3.68 2.01 0.43 -0.36 115.64 124.10 2nti s THR 99 Ca -0.03 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.08 2nti s THR 99 Cb -0.14 -1.96 0.04 0.00 0.01 0.00 0.00 72.50 70.45 2nti s THR 99 CO 0.03 0.56 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.62 2nti s LEU 100 N -0.02 2.94 -0.21 4.42 1.43 0.27 -1.09 118.68 126.42 2nti s LEU 100 Ca -0.06 -1.06 -0.02 0.00 -1.03 0.00 0.00 54.13 51.97 2nti s LEU 100 Cb -0.15 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.54 2nti s LEU 100 CO 0.05 -0.11 -0.10 -0.89 0.23 0.00 0.00 176.35 175.52 2nti s THR 101 N 1.20 2.82 -0.11 5.49 2.01 -0.71 -0.60 115.64 125.74 2nti s THR 101 Ca -0.03 -0.71 -0.16 0.00 0.31 0.00 0.00 61.69 61.10 2nti s THR 101 Cb -0.17 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 2nti s THR 101 CO -0.08 0.45 0.41 -0.36 -0.69 0.00 0.00 174.62 174.35 2nti s PHE 102 N 1.39 3.53 -0.05 4.92 0.40 0.16 -1.14 117.98 127.19 2nti s PHE 102 Ca 0.05 0.82 0.02 0.00 -0.60 0.00 0.00 56.93 57.22 2nti s PHE 102 Cb -0.14 -2.45 0.01 0.00 0.51 0.00 0.00 43.02 40.95 2nti s PHE 102 CO -0.07 0.26 -0.11 0.34 0.70 0.00 0.00 175.22 176.34 2nti s ASP 103 N 0.33 1.56 0.00 1.36 3.68 0.10 -0.91 116.67 122.79 2nti s ASP 103 Ca 0.23 -0.25 0.00 0.00 2.13 0.00 0.00 52.55 54.66 2nti s ASP 103 Cb -0.15 -0.62 0.00 0.00 -1.45 0.00 0.00 42.92 40.71 2nti s ASP 103 CO 0.09 0.04 0.00 0.61 0.13 0.00 0.00 175.17 176.04 2nti n GLY 104 N 3.63 -0.15 0.24 2.66 0.00 -1.26 0.39 105.19 110.70 2nti n GLY 104 Ca -0.22 0.55 0.10 0.00 0.00 0.00 0.00 46.02 46.46 2nti n GLY 104 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2nti h GLU 105 N 0.00 0.00 -2.57 1.61 4.57 -1.96 -3.45 114.58 112.79 2nti h GLU 105 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.27 2nti h GLU 105 Cb 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 28.48 2nti h GLU 105 CO 0.00 0.18 0.39 -0.59 -1.18 0.00 0.00 179.01 177.80 2nti s PHE 106 N -4.14 -0.32 -0.12 0.92 -0.71 -1.26 -5.16 117.98 107.19 2nti s PHE 106 Ca -0.02 0.08 -0.20 0.00 -1.04 0.00 0.00 56.93 55.74 2nti s PHE 106 Cb 0.13 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.50 2nti s PHE 106 CO 0.62 -0.79 0.57 0.99 -1.34 0.00 0.00 175.22 175.27 2nti s THR 107 N -3.43 5.12 -0.02 -4.49 2.01 -1.26 -4.47 115.64 109.10 2nti s THR 107 Ca 0.07 1.13 0.02 0.00 0.31 0.00 0.00 61.69 63.21 2nti s THR 107 Cb -0.02 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.60 2nti s THR 107 CO -0.05 0.26 -0.06 -0.13 -0.69 0.00 0.00 174.62 173.95 2nti s ARG 108 N 0.96 0.67 -0.04 4.92 0.52 -0.08 -5.00 118.95 120.89 2nti s ARG 108 Ca 0.30 -0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.33 2nti s ARG 108 Cb -0.16 -0.66 0.02 0.00 0.52 0.00 0.00 34.95 34.67 2nti s ARG 108 CO 0.12 0.06 -0.05 0.45 0.02 0.00 0.00 175.30 175.90 2nti s SER 109 N 0.27 0.94 -0.04 0.23 0.15 -1.26 0.36 113.70 114.35 2nti s SER 109 Ca -0.03 -0.13 0.06 0.00 0.70 0.00 0.00 55.95 56.54 2nti s SER 109 Cb -0.08 -0.40 -0.02 0.00 -1.71 0.00 0.00 66.02 63.81 2nti s SER 109 CO -0.00 -0.02 -0.21 -0.36 1.20 0.00 0.00 173.24 173.85 2nti s PHE 110 N 0.69 2.51 -0.08 3.44 0.40 0.23 -4.98 117.98 120.19 2nti s PHE 110 Ca -0.09 -0.36 0.04 0.00 -0.60 0.00 0.00 56.93 55.91 2nti s PHE 110 Cb -0.12 -1.57 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 2nti s PHE 110 CO 0.00 0.03 -0.20 -1.21 0.70 0.00 0.00 175.22 174.54 2nti s GLU 111 N -0.58 2.85 -0.11 0.44 2.02 -1.26 -0.57 118.70 121.49 2nti s GLU 111 Ca 0.09 -0.82 0.03 0.00 0.02 0.00 0.00 54.97 54.29 2nti s GLU 111 Cb -0.11 -2.33 0.01 0.00 0.10 0.00 0.00 34.13 31.80 2nti s GLU 111 CO 0.00 0.33 -0.20 -0.51 0.02 0.00 0.00 175.26 174.91 2nti s LEU 112 N -0.01 1.95 0.48 1.80 1.43 0.52 -4.97 118.68 119.86 2nti s LEU 112 Ca -0.07 -0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 52.29 2nti s LEU 112 Cb -0.15 -1.27 -0.07 0.00 0.03 0.00 0.00 46.19 44.73 2nti s LEU 112 CO 0.05 0.09 1.37 -2.84 0.23 0.00 0.00 176.35 175.25 2nti s PRO 113 N 0.68 3.55 0.46 1.29 0.02 -1.26 -0.24 135.00 139.50 2nti s PRO 113 Ca -0.12 2.29 -0.24 0.00 0.02 0.00 0.00 61.00 62.95 2nti s PRO 113 Cb -0.16 -2.53 -0.07 0.00 0.02 0.00 0.00 34.50 31.76 2nti s PRO 113 CO 0.03 -0.88 1.25 -0.51 -0.33 0.00 0.00 177.00 176.55 2nti s LEU 114 N -2.96 4.04 0.26 -5.54 1.43 -0.67 -4.79 118.68 110.45 2nti s LEU 114 Ca 0.64 2.50 0.11 0.00 -1.03 0.00 0.00 54.13 56.35 2nti s LEU 114 Cb -0.41 -4.15 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 2nti s LEU 114 CO 0.51 -1.04 -0.10 0.27 0.23 0.00 0.00 176.35 176.22 2nti s ILE 115 N -1.41 2.99 -0.44 -0.59 -4.36 -1.08 -5.01 121.20 111.30 2nti s ILE 115 Ca 0.63 -2.08 -0.23 0.00 -0.26 0.00 0.00 60.65 58.71 2nti s ILE 115 Cb -0.34 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 40.83 2nti s ILE 115 CO 0.42 -0.34 0.79 -1.10 0.24 0.00 0.00 174.94 174.95 2nti s GLN 116 N -3.46 3.44 -0.10 0.37 -1.52 -1.26 -3.80 119.66 113.33 2nti s GLN 116 Ca 0.30 -0.05 0.04 0.00 -1.95 0.00 0.00 55.36 53.69 2nti s GLN 116 Cb -0.06 -3.93 -0.00 0.00 -0.22 0.00 0.00 33.01 28.80 2nti s GLN 116 CO 0.17 -1.10 -0.22 0.08 -0.25 0.00 0.00 175.29 173.96 2nti s VAL 117 N 3.31 2.21 0.25 1.09 1.01 -1.26 -5.05 120.40 121.95 2nti s VAL 117 Ca 0.30 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2nti s VAL 117 Cb -0.12 -1.85 -0.09 0.00 0.00 0.00 0.00 36.38 34.32 2nti s VAL 117 CO 0.22 0.56 1.20 -0.70 0.00 0.00 0.00 175.10 176.38 2nti s GLU 118 N 0.25 4.50 0.33 2.72 2.12 -1.26 -4.88 118.70 122.48 2nti s GLU 118 Ca -0.15 1.94 -0.27 0.00 0.36 0.00 0.00 54.97 56.85 2nti s GLU 118 Cb -0.17 -3.18 -0.09 0.00 0.26 0.00 0.00 34.13 30.94 2nti s GLU 118 CO 0.08 -0.02 1.02 -1.54 -0.54 0.00 0.00 175.26 174.25 2nti s SER 119 N -0.32 7.15 -0.13 -1.70 1.04 -1.26 -4.88 113.70 113.61 2nti s SER 119 Ca 0.50 2.03 -0.12 0.00 0.48 0.00 0.00 55.95 58.84 2nti s SER 119 Cb -0.34 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.13 2nti s SER 119 CO 0.42 -0.21 0.26 -0.89 0.98 0.00 0.00 173.24 173.80 2nti s THR 120 N -1.46 5.32 0.11 2.02 2.01 -1.26 -5.06 115.64 117.31 2nti s THR 120 Ca 0.50 0.48 -0.31 0.00 0.31 0.00 0.00 61.69 62.67 2nti s THR 120 Cb -0.24 -3.57 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 2nti s THR 120 CO 0.31 0.48 1.60 -1.10 -0.69 0.00 0.00 174.62 175.22 2nti s GLN 121 N -0.14 4.21 0.62 4.92 -1.52 -1.26 -4.87 119.66 121.62 2nti s GLN 121 Ca 0.16 2.33 -0.18 0.00 -1.95 0.00 0.00 55.36 55.72 2nti s GLN 121 Cb -0.13 -3.40 -0.02 0.00 -0.22 0.00 0.00 33.01 29.23 2nti s GLN 121 CO 0.05 -0.67 1.23 -2.14 -0.25 0.00 0.00 175.29 173.51 2nti s PRO 122 N 1.95 2.81 -1.35 2.91 0.02 -1.26 -4.90 135.00 135.18 2nti s PRO 122 Ca 0.72 1.87 -0.14 0.00 0.02 0.00 0.00 61.00 63.47 2nti s PRO 122 Cb -0.41 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.18 2nti s PRO 122 CO 0.32 -1.35 2.35 -0.35 -0.33 0.00 0.00 177.00 177.64 2nti n PRO 123 N -1.76 2.79 -0.47 5.54 -0.04 -1.26 -4.74 135.00 135.06 2nti n PRO 123 Ca 0.14 -2.31 0.00 0.00 -0.04 0.00 0.00 63.50 61.29 2nti n PRO 123 Cb 0.49 -3.06 0.00 0.00 -0.04 0.00 0.00 33.50 30.90 2nti n PRO 123 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2nti n SER 124 N 5.58 5.14 -4.10 3.54 7.64 -1.26 -4.72 113.62 125.44 2nti n SER 124 Ca 0.57 -2.36 -0.34 0.00 1.01 0.00 0.00 58.87 57.76 2nti n SER 124 Cb 0.34 -1.08 -0.14 0.00 -1.01 0.00 0.00 64.21 62.32 2nti n SER 124 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2nti s VAL 125 N 0.04 2.70 -1.09 0.44 -7.23 -1.26 -5.04 120.40 108.95 2nti s VAL 125 Ca 0.00 -1.85 -0.13 0.00 -1.81 0.00 0.00 61.98 58.19 2nti s VAL 125 Cb 0.00 -2.74 0.20 0.00 0.56 0.00 0.00 36.38 34.40 2nti s VAL 125 CO 0.00 -0.35 1.22 0.21 -0.31 0.00 0.00 175.10 175.86 2nti s ASN 126 N 1.26 7.04 0.51 4.85 3.04 -1.26 -5.01 114.94 125.37 2nti s ASN 126 Ca 0.01 -2.99 -0.19 0.00 0.04 0.00 0.00 52.86 49.74 2nti s ASN 126 Cb -0.20 -2.32 -0.08 0.00 -1.54 0.00 0.00 41.25 37.11 2nti s ASN 126 CO -0.04 -0.64 1.01 -0.76 -3.04 0.00 0.00 177.10 173.63 2nti s LEU 127 N 0.75 3.74 0.16 3.21 1.43 -1.26 -5.07 118.68 121.64 2nti s LEU 127 Ca 0.35 1.78 0.05 0.00 -1.03 0.00 0.00 54.13 55.28 2nti s LEU 127 Cb -0.06 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 2nti s LEU 127 CO -0.05 -0.75 0.15 -0.70 0.23 0.00 0.00 176.35 175.24 2nti s GLU 128 N -3.59 2.96 -0.14 1.70 2.12 -1.26 -5.11 118.70 115.38 2nti s GLU 128 Ca 0.64 -0.84 -0.01 0.00 0.36 0.00 0.00 54.97 55.12 2nti s GLU 128 Cb -0.13 -2.68 -0.01 0.00 0.26 0.00 0.00 34.13 31.56 2nti s GLU 128 CO 0.25 0.49 -0.12 -0.06 -0.54 0.00 0.00 175.26 175.28 2nti s PHE 129 N -1.76 2.84 -0.96 5.30 0.40 -1.26 -5.01 117.98 117.52 2nti s PHE 129 Ca 0.31 -0.68 0.13 0.00 -0.60 0.00 0.00 56.93 56.09 2nti s PHE 129 Cb -0.10 -1.88 0.57 0.00 0.51 0.00 0.00 43.02 42.12 2nti s PHE 129 CO 0.24 -0.25 1.43 -0.35 0.70 0.00 0.00 175.22 176.98 2nti n PRO 130 N 3.69 0.01 -3.79 0.24 -0.04 -1.25 -4.74 135.00 129.12 2nti n PRO 130 Ca -0.18 0.29 -0.13 0.00 -0.04 0.00 0.00 63.50 63.45 2nti n PRO 130 Cb 0.52 -1.53 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 2nti n PRO 130 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2nti s PHE 131 N -3.02 -0.23 -0.03 0.54 5.36 -1.18 -0.39 117.98 119.02 2nti s PHE 131 Ca 0.06 0.56 0.00 0.00 -0.96 0.00 0.00 56.93 56.60 2nti s PHE 131 Cb 0.08 0.06 0.03 0.00 -0.34 0.00 0.00 43.02 42.85 2nti s PHE 131 CO 0.24 -0.12 -0.00 0.21 -1.46 0.00 0.00 175.22 174.09 2nti s LYS 132 N 0.29 0.36 0.14 10.12 2.20 -0.65 -2.97 119.74 129.23 2nti s LYS 132 Ca -0.01 0.07 0.08 0.00 -0.36 0.00 0.00 55.97 55.74 2nti s LYS 132 Cb -0.03 -0.56 -0.04 0.00 -1.51 0.00 0.00 37.83 35.69 2nti s LYS 132 CO -0.01 -0.15 -0.17 0.00 -0.36 0.00 0.00 175.35 174.65 2nti s ALA 133 N 1.14 1.78 -0.04 3.13 0.00 0.27 -1.87 121.76 126.17 2nti s ALA 133 Ca -0.08 -1.36 0.04 0.00 0.00 0.00 0.00 51.96 50.55 2nti s ALA 133 Cb -0.13 -0.16 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 2nti s ALA 133 CO -0.02 0.22 -0.15 -1.14 0.00 0.00 0.00 175.76 174.68 2nti s GLN 134 N -2.53 1.56 0.21 0.00 0.74 0.85 -0.05 119.66 120.45 2nti s GLN 134 Ca 0.11 -0.51 -0.20 0.00 0.05 0.00 0.00 55.36 54.81 2nti s GLN 134 Cb -0.07 -1.37 0.04 0.00 1.10 0.00 0.00 33.01 32.71 2nti s GLN 134 CO 0.05 0.19 0.60 -0.48 -0.55 0.00 0.00 175.29 175.10 2nti s LEU 135 N 0.13 -0.18 0.18 3.68 2.34 -0.92 0.99 118.68 124.90 2nti s LEU 135 Ca -0.05 -0.39 -0.30 0.00 0.06 0.00 0.00 54.13 53.45 2nti s LEU 135 Cb -0.11 2.42 -0.08 0.00 -0.56 0.00 0.00 46.19 47.86 2nti s LEU 135 CO 0.02 -1.11 1.21 -0.76 -1.06 0.00 0.00 176.35 174.65 2nti s LEU 136 N -2.86 4.44 0.38 1.48 1.43 -1.26 -0.87 118.68 121.42 2nti s LEU 136 Ca 0.08 2.25 0.09 0.00 -1.03 0.00 0.00 54.13 55.53 2nti s LEU 136 Cb -0.02 -3.61 0.85 0.00 0.03 0.00 0.00 46.19 43.44 2nti s LEU 136 CO -0.03 -0.40 1.93 0.74 0.23 0.00 0.00 176.35 178.83 2nti h THR 137 N 3.76 0.92 -0.37 5.49 2.02 -1.16 -1.36 112.91 122.20 2nti h THR 137 Ca -0.44 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 66.44 2nti h THR 137 Cb 1.21 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 2nti h THR 137 CO 0.75 0.12 -0.10 -0.29 0.37 0.00 0.00 175.52 176.37 2nti h ILE 138 N 0.64 1.24 -0.10 3.11 2.10 -1.84 0.12 117.51 122.78 2nti h ILE 138 Ca 0.35 -1.07 -0.00 0.00 1.08 0.00 0.00 64.86 65.22 2nti h ILE 138 Cb 0.52 1.06 -0.00 0.00 -1.09 0.00 0.00 36.82 37.31 2nti h ILE 138 CO -0.13 0.36 0.04 0.74 -1.08 0.00 0.00 178.15 178.08 2nti h THR 139 N 0.59 1.13 0.10 2.19 2.02 -1.63 -1.74 112.91 115.57 2nti h THR 139 Ca 0.11 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 66.90 2nti h THR 139 Cb 0.52 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2nti h THR 139 CO 0.03 0.12 -0.13 0.15 0.37 0.00 0.00 175.52 176.06 2nti h PHE 140 N 0.02 -0.33 -0.34 3.16 3.57 -1.16 -2.69 116.94 119.16 2nti h PHE 140 Ca 0.03 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.58 2nti h PHE 140 Cb 0.15 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 2nti h PHE 140 CO -0.02 -0.20 0.10 0.00 -2.23 0.00 0.00 178.31 175.96 2nti h ALA 141 N 0.60 0.38 -0.09 2.41 0.00 -0.73 -0.98 119.26 120.85 2nti h ALA 141 Ca 0.01 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2nti h ALA 141 Cb 0.27 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2nti h ALA 141 CO -0.06 -0.29 0.02 -0.44 0.00 0.00 0.00 179.25 178.48 2nti h ASP 142 N 0.24 0.01 -0.33 0.00 3.45 -1.28 -0.73 116.42 117.79 2nti h ASP 142 Ca 0.16 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 2nti h ASP 142 Cb 0.14 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 38.91 2nti h ASP 142 CO -0.17 0.02 0.17 0.40 -1.57 0.00 0.00 179.24 178.09 2nti h ILE 143 N 0.07 1.15 -0.33 0.35 2.04 -1.29 -2.31 117.51 117.19 2nti h ILE 143 Ca 0.04 -0.41 -0.12 0.00 1.00 0.00 0.00 64.86 65.38 2nti h ILE 143 Cb 0.03 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2nti h ILE 143 CO -0.05 0.15 -0.27 0.40 0.00 0.00 0.00 178.15 178.38 2nti h ILE 144 N 0.40 1.28 -0.27 -0.67 1.08 -1.06 -1.44 117.51 116.83 2nti h ILE 144 Ca 0.11 -1.37 0.00 0.00 -0.39 0.00 0.00 64.86 63.22 2nti h ILE 144 Cb 0.09 1.31 -0.01 0.00 -3.07 0.00 0.00 36.82 35.14 2nti h ILE 144 CO -0.02 0.45 0.18 0.44 -0.69 0.00 0.00 178.15 178.51 2nti h ASP 145 N 0.59 0.31 -0.38 1.72 3.32 -1.06 -0.38 116.42 120.53 2nti h ASP 145 Ca 0.08 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2nti h ASP 145 Cb 0.76 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 2nti h ASP 145 CO 0.06 0.23 0.15 -0.33 -1.72 0.00 0.00 179.24 177.63 2nti h GLU 146 N 0.36 0.57 0.00 3.56 5.08 -1.21 -2.94 114.58 120.01 2nti h GLU 146 Ca 0.10 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2nti h GLU 146 Cb -0.04 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2nti h GLU 146 CO -0.02 0.55 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.28 2nti h LEU 147 N 0.48 0.00 -2.32 1.33 3.38 -1.21 -3.32 115.31 113.64 2nti h LEU 147 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2nti h LEU 147 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2nti h LEU 147 CO -0.01 0.18 -0.01 0.77 0.09 0.00 0.00 178.44 179.46 2nti h SER 148 N 0.00 0.00 0.48 -0.43 4.64 -0.87 -0.73 113.55 116.64 2nti h SER 148 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nti h SER 148 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2nti h SER 148 CO 0.02 0.01 -0.27 0.47 -0.87 0.00 0.00 176.83 176.19 2nti n ASP 149 N -3.13 0.54 -0.18 4.97 8.00 -1.25 -4.13 116.55 121.38 2nti n ASP 149 Ca -0.02 -0.36 0.11 0.00 0.71 0.00 0.00 54.79 55.23 2nti n ASP 149 Cb 0.17 0.03 0.01 0.00 -0.02 0.00 0.00 41.12 41.31 2nti n ASP 149 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2nti n LEU 150 N -1.17 1.26 0.00 0.64 4.77 -0.28 -5.03 117.00 117.19 2nti n LEU 150 Ca 0.09 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 2nti n LEU 150 Cb 0.32 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2nti n LEU 150 CO 0.29 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 2nti n GLY 151 N 1.46 0.32 0.01 -0.72 0.00 -1.25 -4.93 105.19 100.09 2nti n GLY 151 Ca 0.07 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 45.15 2nti n GLY 151 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2nti n GLU 152 N -0.47 0.02 -4.81 1.61 0.28 -1.26 -4.81 120.64 111.20 2nti n GLU 152 Ca 0.00 -0.02 -0.29 0.00 -0.16 0.00 0.00 57.16 56.70 2nti n GLU 152 Cb 0.00 -1.50 -0.17 0.00 1.43 0.00 0.00 31.44 31.20 2nti n GLU 152 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2nti s VAL 153 N -2.99 1.61 -0.27 3.84 1.01 -1.26 -1.01 120.40 121.33 2nti s VAL 153 Ca 0.08 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.19 2nti s VAL 153 Cb 0.16 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 2nti s VAL 153 CO 0.85 0.46 0.25 -0.22 0.00 0.00 0.00 175.10 176.45 2nti s LEU 154 N 0.61 4.05 -0.12 3.92 2.96 -0.03 -4.64 118.68 125.42 2nti s LEU 154 Ca -0.14 0.13 -0.15 0.00 -0.22 0.00 0.00 54.13 53.75 2nti s LEU 154 Cb -0.16 -2.23 -0.05 0.00 0.50 0.00 0.00 46.19 44.24 2nti s LEU 154 CO 0.04 -0.07 0.36 0.20 -1.32 0.00 0.00 176.35 175.56 2nti s ASN 155 N 1.57 6.56 -0.05 3.68 0.01 0.77 -1.02 114.94 126.47 2nti s ASN 155 Ca 0.10 0.66 0.03 0.00 -0.71 0.00 0.00 52.86 52.95 2nti s ASN 155 Cb -0.15 -2.22 0.00 0.00 0.41 0.00 0.00 41.25 39.29 2nti s ASN 155 CO 0.09 0.12 -0.15 -0.63 -1.51 0.00 0.00 177.10 175.03 2nti s ILE 156 N 0.21 1.26 0.08 0.60 1.01 0.07 -0.32 121.20 124.10 2nti s ILE 156 Ca 0.20 -0.60 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 2nti s ILE 156 Cb -0.14 -1.10 0.01 0.00 0.01 0.00 0.00 42.46 41.25 2nti s ILE 156 CO 0.07 0.37 0.28 -1.38 0.00 0.00 0.00 174.94 174.28 2nti s HIS 157 N 0.22 -0.02 0.03 3.97 -3.43 -0.98 -0.65 115.29 114.42 2nti s HIS 157 Ca -0.07 -0.27 0.08 0.00 -0.80 0.00 0.00 55.06 54.01 2nti s HIS 157 Cb -0.12 0.07 -0.03 0.00 -1.43 0.00 0.00 32.58 31.07 2nti s HIS 157 CO 0.02 -0.56 -0.24 -1.54 -2.00 0.00 0.00 174.74 170.43 2nti s SER 158 N -2.53 3.35 -0.21 7.38 1.04 0.08 -0.93 113.70 121.87 2nti s SER 158 Ca 0.01 -0.52 -0.04 0.00 0.48 0.00 0.00 55.95 55.88 2nti s SER 158 Cb 0.02 -0.40 0.10 0.00 0.10 0.00 0.00 66.02 65.84 2nti s SER 158 CO -0.08 0.27 0.23 -0.75 0.98 0.00 0.00 173.24 173.89 2nti s LYS 159 N -1.19 0.21 -1.26 4.02 2.20 -0.57 -3.59 119.74 119.56 2nti s LYS 159 Ca 0.12 0.19 -0.02 0.00 -0.36 0.00 0.00 55.97 55.90 2nti s LYS 159 Cb -0.10 -1.15 0.01 0.00 -1.51 0.00 0.00 37.83 35.08 2nti s LYS 159 CO 0.02 -0.68 0.99 0.39 -0.36 0.00 0.00 175.35 175.71 2nti n GLU 160 N 5.32 -6.60 -1.03 4.03 1.02 -1.26 -1.81 120.64 120.31 2nti n GLU 160 Ca -0.05 0.80 -0.01 0.00 -0.02 0.00 0.00 57.16 57.88 2nti n GLU 160 Cb 0.49 -5.75 -0.00 0.00 -0.02 0.00 0.00 31.44 26.16 2nti n GLU 160 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2nti n ASN 161 N -3.08 -4.14 -4.83 1.62 4.13 -1.26 -5.02 115.26 102.68 2nti n ASN 161 Ca -0.21 0.02 -0.34 0.00 1.68 0.00 0.00 54.58 55.73 2nti n ASN 161 Cb 0.64 -1.72 -0.06 0.00 -1.54 0.00 0.00 39.78 37.10 2nti n ASN 161 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2nti s LYS 162 N -1.00 3.25 -0.12 3.52 1.02 -0.75 -4.70 119.74 120.96 2nti s LYS 162 Ca 0.00 -0.36 -0.01 0.00 0.02 0.00 0.00 55.97 55.62 2nti s LYS 162 Cb 0.00 -2.99 -0.02 0.00 -0.52 0.00 0.00 37.83 34.30 2nti s LYS 162 CO 0.00 0.68 -0.08 -1.17 -0.92 0.00 0.00 175.35 173.86 2nti s LEU 163 N -1.61 3.03 -0.11 3.17 2.96 0.14 -1.51 118.68 124.75 2nti s LEU 163 Ca 0.22 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 54.00 2nti s LEU 163 Cb -0.12 -1.69 0.00 0.00 0.50 0.00 0.00 46.19 44.88 2nti s LEU 163 CO 0.13 0.23 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.86 2nti s TYR 164 N -0.03 2.48 -0.18 5.38 2.02 -0.11 0.70 117.35 127.61 2nti s TYR 164 Ca -0.01 -1.10 -0.06 0.00 -0.37 0.00 0.00 57.07 55.53 2nti s TYR 164 Cb -0.14 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 2nti s TYR 164 CO 0.03 -0.47 0.04 -0.06 -1.57 0.00 0.00 175.55 173.52 2nti s PHE 165 N 0.54 3.17 -0.01 2.71 2.99 -0.67 -2.33 117.98 124.39 2nti s PHE 165 Ca -0.14 -0.08 0.02 0.00 0.00 0.00 0.00 56.93 56.72 2nti s PHE 165 Cb -0.17 -2.07 -0.00 0.00 0.00 0.00 0.00 43.02 40.78 2nti s PHE 165 CO 0.05 0.04 -0.07 -1.21 -0.00 0.00 0.00 175.22 174.03 2nti s GLU 166 N 0.52 0.64 -0.30 0.44 2.02 0.56 -1.01 118.70 121.57 2nti s GLU 166 Ca 0.01 -0.25 0.03 0.00 0.02 0.00 0.00 54.97 54.78 2nti s GLU 166 Cb -0.13 -0.62 0.08 0.00 0.10 0.00 0.00 34.13 33.56 2nti s GLU 166 CO 0.01 0.14 -0.01 0.08 0.02 0.00 0.00 175.26 175.50 2nti s VAL 167 N -0.06 2.13 -0.30 2.63 1.01 -0.21 -0.16 120.40 125.44 2nti s VAL 167 Ca 0.01 -1.99 -0.18 0.00 0.00 0.00 0.00 61.98 59.82 2nti s VAL 167 Cb -0.04 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2nti s VAL 167 CO -0.00 -0.38 0.53 -0.63 0.00 0.00 0.00 175.10 174.62 2nti s ILE 168 N 1.03 5.03 0.00 2.22 1.01 -1.26 -1.41 121.20 127.82 2nti s ILE 168 Ca 0.03 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.39 2nti s ILE 168 Cb -0.19 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.39 2nti s ILE 168 CO -0.08 -0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.43 2nti n GLY 169 N 4.53 5.02 3.55 6.18 0.00 -0.59 -5.01 105.19 118.87 2nti n GLY 169 Ca -0.04 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.27 2nti n GLY 169 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2nti s ASP 170 N 1.08 4.68 -1.52 1.61 1.47 -1.26 -3.58 116.67 119.15 2nti s ASP 170 Ca 0.00 0.70 -0.14 0.00 1.18 0.00 0.00 52.55 54.29 2nti s ASP 170 Cb 0.00 -2.52 0.10 0.00 -0.34 0.00 0.00 42.92 40.16 2nti s ASP 170 CO 0.00 -2.80 0.82 0.18 0.68 0.00 0.00 175.17 174.05 2nti n LEU 171 N 15.06 -2.13 -3.63 2.11 4.77 -1.26 -4.89 117.00 127.03 2nti n LEU 171 Ca 0.32 -0.73 -0.03 0.00 -0.03 0.00 0.00 56.01 55.54 2nti n LEU 171 Cb 0.53 -2.37 -0.03 0.00 -2.33 0.00 0.00 43.42 39.22 2nti n LEU 171 CO 0.69 0.35 1.11 -0.55 -1.33 0.00 0.00 177.39 177.66 2nti s SER 172 N -3.14 -0.07 -0.21 -1.43 0.15 -1.23 -5.17 113.70 102.59 2nti s SER 172 Ca 0.62 0.05 -0.10 0.00 0.70 0.00 0.00 55.95 57.21 2nti s SER 172 Cb -0.32 0.07 0.08 0.00 -1.71 0.00 0.00 66.02 64.14 2nti s SER 172 CO 0.76 -0.09 0.49 0.28 1.20 0.00 0.00 173.24 175.87 2nti s THR 173 N -1.59 -0.30 -0.11 6.45 -1.32 -1.26 -1.54 115.64 115.97 2nti s THR 173 Ca 0.09 0.09 -0.04 0.00 -1.21 0.00 0.00 61.69 60.62 2nti s THR 173 Cb -0.01 -0.74 -0.04 0.00 -1.51 0.00 0.00 72.50 70.21 2nti s THR 173 CO -0.05 0.04 0.05 0.00 -2.21 0.00 0.00 174.62 172.44 2nti s ALA 174 N 1.94 3.46 -0.05 11.08 0.00 -0.50 -4.97 121.76 132.73 2nti s ALA 174 Ca -0.07 -0.75 -0.06 0.00 0.00 0.00 0.00 51.96 51.08 2nti s ALA 174 Cb -0.09 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.36 2nti s ALA 174 CO -0.15 0.53 0.15 0.21 0.00 0.00 0.00 175.76 176.51 2nti s LYS 175 N -0.72 0.22 -0.04 0.00 2.20 -1.26 -1.04 119.74 119.11 2nti s LYS 175 Ca 0.12 0.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 2nti s LYS 175 Cb -0.12 0.10 0.02 0.00 -1.51 0.00 0.00 37.83 36.33 2nti s LYS 175 CO 0.02 -0.03 -0.05 0.08 -0.36 0.00 0.00 175.35 175.02 2nti s VAL 176 N -0.11 0.51 -0.25 4.02 1.01 -0.18 -4.98 120.40 120.41 2nti s VAL 176 Ca -0.02 -0.13 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 2nti s VAL 176 Cb -0.02 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.79 2nti s VAL 176 CO 0.00 0.21 0.16 -0.70 0.00 0.00 0.00 175.10 174.77 2nti s GLU 177 N 0.76 3.99 -0.20 2.72 2.12 -1.26 -1.67 118.70 125.16 2nti s GLU 177 Ca -0.10 -0.31 -0.03 0.00 0.36 0.00 0.00 54.97 54.90 2nti s GLU 177 Cb -0.13 -3.56 -0.01 0.00 0.26 0.00 0.00 34.13 30.70 2nti s GLU 177 CO 0.00 -0.04 -0.08 -0.51 -0.54 0.00 0.00 175.26 174.09 2nti s LEU 178 N 1.35 2.77 0.15 2.70 1.02 0.22 -4.97 118.68 121.92 2nti s LEU 178 Ca 0.07 -0.41 -0.07 0.00 0.02 0.00 0.00 54.13 53.74 2nti s LEU 178 Cb -0.15 -1.69 -0.02 0.00 0.02 0.00 0.00 46.19 44.36 2nti s LEU 178 CO 0.07 0.01 0.22 -0.94 0.02 0.00 0.00 176.35 175.73 2nti s SER 179 N 1.27 0.12 0.46 2.29 1.04 -1.26 0.27 113.70 117.89 2nti s SER 179 Ca 0.03 -0.95 0.25 0.00 0.48 0.00 0.00 55.95 55.77 2nti s SER 179 Cb -0.14 0.39 1.02 0.00 0.10 0.00 0.00 66.02 67.39 2nti s SER 179 CO -0.03 -0.84 1.87 0.71 0.98 0.00 0.00 173.24 175.93 2nti h THR 180 N 2.65 0.50 -0.27 2.02 1.35 -1.84 -0.72 112.91 116.59 2nti h THR 180 Ca -0.33 -1.00 -0.16 0.00 -0.55 0.00 0.00 66.41 64.37 2nti h THR 180 Cb 1.22 1.70 -0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2nti h THR 180 CO 0.52 0.19 -0.47 0.44 -0.25 0.00 0.00 175.52 175.95 2nti h ASP 181 N 0.00 0.88 -0.04 5.36 3.32 -1.95 -2.58 116.42 121.41 2nti h ASP 181 Ca -0.00 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2nti h ASP 181 Cb 0.68 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2nti h ASP 181 CO 0.02 1.24 0.00 -0.46 -1.72 0.00 0.00 179.24 178.32 2nti n ASN 182 N -4.11 0.66 -0.11 6.45 0.23 -1.23 -4.91 115.26 112.25 2nti n ASN 182 Ca -0.05 -1.39 -0.01 0.00 -0.53 0.00 0.00 54.58 52.60 2nti n ASN 182 Cb 0.58 -0.02 -0.01 0.00 -2.08 0.00 0.00 39.78 38.25 2nti n ASN 182 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2nti n GLY 183 N 0.99 0.51 0.08 4.83 0.00 -0.97 -4.88 105.19 105.75 2nti n GLY 183 Ca 0.18 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2nti n GLY 183 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2nti n THR 184 N -2.89 0.98 -4.33 2.61 5.66 -0.82 -4.85 114.28 110.63 2nti n THR 184 Ca -0.01 -0.69 -0.30 0.00 -3.05 0.00 0.00 64.05 60.00 2nti n THR 184 Cb 0.08 -0.52 -0.10 0.00 -1.55 0.00 0.00 70.33 68.23 2nti n THR 184 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2nti s LEU 185 N -5.45 2.95 -0.07 1.09 1.43 -0.34 -4.61 118.68 113.69 2nti s LEU 185 Ca -0.05 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 52.63 2nti s LEU 185 Cb 0.09 -1.75 -0.27 0.00 0.03 0.00 0.00 46.19 44.29 2nti s LEU 185 CO 0.83 0.20 0.58 -0.07 0.23 0.00 0.00 176.35 178.13 2nti h LEU 186 N 3.88 0.38 -7.46 1.79 3.38 0.31 -3.32 115.31 114.26 2nti h LEU 186 Ca -0.49 -0.70 -0.12 0.00 0.09 0.00 0.00 57.88 56.66 2nti h LEU 186 Cb 1.17 -0.12 -0.22 0.00 0.09 0.00 0.00 40.66 41.58 2nti h LEU 186 CO 0.51 1.61 -0.28 -1.61 0.09 0.00 0.00 178.44 178.76 2nti s GLU 187 N -2.58 0.59 -0.27 1.13 0.41 -1.03 -4.95 118.70 112.00 2nti s GLU 187 Ca -0.15 0.04 -0.13 0.00 -0.41 0.00 0.00 54.97 54.31 2nti s GLU 187 Cb 0.07 0.27 0.09 0.00 -1.78 0.00 0.00 34.13 32.77 2nti s GLU 187 CO 0.81 -0.14 0.64 0.00 -0.49 0.00 0.00 175.26 176.08 2nti s ALA 188 N -0.82 -1.78 -0.24 5.21 0.00 -1.26 -0.10 121.76 122.76 2nti s ALA 188 Ca -0.09 2.26 -0.22 0.00 0.00 0.00 0.00 51.96 53.91 2nti s ALA 188 Cb -0.04 -1.44 0.06 0.00 0.00 0.00 0.00 23.12 21.70 2nti s ALA 188 CO 0.03 -0.50 0.65 -1.12 0.00 0.00 0.00 175.76 174.82 2nti s SER 189 N 1.93 -0.68 0.00 0.00 0.01 -0.78 -4.87 113.70 109.30 2nti s SER 189 Ca -0.09 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.49 2nti s SER 189 Cb -0.07 1.33 0.00 0.00 0.21 0.00 0.00 66.02 67.49 2nti s SER 189 CO -0.19 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 173.85 2nti n GLY 190 N 2.76 -0.74 3.77 3.44 0.00 -1.26 -1.63 105.19 111.53 2nti n GLY 190 Ca -0.14 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 2nti n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nti s ALA 191 N -1.31 1.80 -0.91 4.61 0.00 0.48 -4.59 121.76 121.83 2nti s ALA 191 Ca 0.00 -0.38 -0.22 0.00 0.00 0.00 0.00 51.96 51.36 2nti s ALA 191 Cb 0.00 -3.08 0.07 0.00 0.00 0.00 0.00 23.12 20.12 2nti s ALA 191 CO 0.00 -2.20 1.27 -0.51 0.00 0.00 0.00 175.76 174.33 2nti s ASP 192 N -3.88 6.44 0.35 0.00 1.01 -1.26 -4.74 116.67 114.58 2nti s ASP 192 Ca 0.63 -1.40 0.09 0.00 0.71 0.00 0.00 52.55 52.58 2nti s ASP 192 Cb -0.15 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 2nti s ASP 192 CO 0.54 -1.43 0.03 0.68 0.21 0.00 0.00 175.17 175.20 2nti s VAL 193 N 4.36 2.60 -0.04 -1.27 -7.23 -1.24 -4.88 120.40 112.71 2nti s VAL 193 Ca 0.38 -1.94 -0.04 0.00 -1.81 0.00 0.00 61.98 58.57 2nti s VAL 193 Cb -0.05 -2.83 0.01 0.00 0.56 0.00 0.00 36.38 34.08 2nti s VAL 193 CO -0.03 -0.18 0.10 -0.55 -0.31 0.00 0.00 175.10 174.13 2nti s SER 194 N -3.73 -0.10 0.23 4.85 0.15 -1.26 -0.74 113.70 113.09 2nti s SER 194 Ca 0.35 0.19 -0.22 0.00 0.70 0.00 0.00 55.95 56.97 2nti s SER 194 Cb 0.00 0.20 0.04 0.00 -1.71 0.00 0.00 66.02 64.56 2nti s SER 194 CO 0.20 -0.04 0.76 -0.55 1.20 0.00 0.00 173.24 174.80 2nti s SER 195 N 0.01 -0.28 0.01 5.45 0.15 0.17 -3.93 113.70 115.28 2nti s SER 195 Ca -0.00 -0.47 -0.00 0.00 0.70 0.00 0.00 55.95 56.17 2nti s SER 195 Cb -0.01 0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 64.94 2nti s SER 195 CO 0.00 -1.18 -0.02 -0.94 1.20 0.00 0.00 173.24 172.30 2nti s SER 196 N -2.89 0.18 0.05 5.45 1.04 -1.26 -0.75 113.70 115.52 2nti s SER 196 Ca 0.10 -0.38 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 2nti s SER 196 Cb -0.04 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.12 2nti s SER 196 CO 0.03 -0.24 -0.04 -0.31 0.98 0.00 0.00 173.24 173.67 2nti s TYR 197 N -1.13 0.55 -0.09 5.02 1.51 -0.19 -0.19 117.35 122.83 2nti s TYR 197 Ca -0.12 -0.97 -0.29 0.00 -1.01 0.00 0.00 57.07 54.67 2nti s TYR 197 Cb -0.08 -0.39 -0.06 0.00 -0.11 0.00 0.00 41.96 41.33 2nti s TYR 197 CO -0.01 -0.32 1.86 0.20 -1.11 0.00 0.00 175.55 176.17 2nti s GLY 198 N -2.74 1.26 0.27 0.71 0.00 -1.26 -0.85 107.32 104.70 2nti s GLY 198 Ca 0.05 0.94 -0.01 0.00 0.00 0.00 0.00 44.72 45.70 2nti s GLY 198 CO -0.08 3.32 1.85 1.98 0.00 0.00 0.00 173.10 180.17 2nti h MET 199 N 11.15 1.01 -0.32 2.90 4.05 -1.39 -2.56 114.93 129.77 2nti h MET 199 Ca -0.42 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 58.99 2nti h MET 199 Cb 1.20 -0.23 -0.05 0.00 -0.80 0.00 0.00 31.60 31.73 2nti h MET 199 CO 0.96 0.67 0.02 1.49 0.23 0.00 0.00 176.91 180.28 2nti h GLU 200 N 1.05 0.12 -0.34 0.39 4.81 -1.89 0.80 114.58 119.50 2nti h GLU 200 Ca 0.45 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.63 2nti h GLU 200 Cb 0.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2nti h GLU 200 CO -0.22 0.08 0.03 1.88 -0.73 0.00 0.00 179.01 180.04 2nti h TYR 201 N 0.12 0.63 -0.55 0.92 -1.99 -1.86 -2.15 116.97 112.09 2nti h TYR 201 Ca 0.16 -0.10 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 2nti h TYR 201 Cb 0.20 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 38.74 2nti h TYR 201 CO -0.22 0.67 0.12 0.28 -0.00 0.00 0.00 178.16 179.02 2nti h VAL 202 N 0.40 1.25 0.00 -2.88 2.07 -1.33 -2.94 116.25 112.82 2nti h VAL 202 Ca 0.10 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 2nti h VAL 202 Cb 0.41 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2nti h VAL 202 CO 0.01 0.33 -0.21 0.00 0.02 0.00 0.00 177.57 177.73 2nti h ALA 203 N 1.01 1.27 0.00 1.67 0.00 -0.71 -2.43 119.26 120.07 2nti h ALA 203 Ca 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2nti h ALA 203 Cb 0.37 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2nti h ALA 203 CO 0.01 0.26 -0.07 -0.91 0.00 0.00 0.00 179.25 178.54 2nti h ASN 204 N 0.00 0.00 0.86 0.00 2.35 -1.20 -2.92 115.58 114.67 2nti h ASN 204 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2nti h ASN 204 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 2nti h ASN 204 CO 0.03 0.07 -0.02 0.35 -1.65 0.00 0.00 177.43 176.20 2nti n THR 205 N -4.39 0.00 0.30 2.81 -2.24 -0.91 -4.01 114.28 105.84 2nti n THR 205 Ca -0.03 -0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.92 2nti n THR 205 Cb 0.15 -0.46 0.78 0.00 -2.10 0.00 0.00 70.33 68.70 2nti n THR 205 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2nti h THR 206 N 0.01 0.00 0.00 4.28 1.35 -1.64 -0.80 112.91 116.12 2nti h THR 206 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2nti h THR 206 Cb 0.45 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2nti h THR 206 CO 0.00 0.00 0.00 0.11 -0.25 0.00 0.00 175.52 175.38 2nti h LYS 207 N 0.00 0.00 0.00 4.72 1.57 -1.82 -2.79 116.57 118.24 2nti h LYS 207 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2nti h LYS 207 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2nti h LYS 207 CO 0.00 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.55 2nti n MET 208 N -2.96 0.02 0.23 3.15 2.81 -0.30 -2.16 117.12 117.90 2nti n MET 208 Ca -0.01 0.36 0.18 0.00 -1.81 0.00 0.00 57.70 56.42 2nti n MET 208 Cb 0.16 -1.54 0.85 0.00 -0.71 0.00 0.00 33.22 31.98 2nti n MET 208 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2nti h ARG 209 N 0.00 0.00 0.00 0.03 2.43 -1.71 -0.35 114.38 114.78 2nti h ARG 209 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2nti h ARG 209 Cb 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2nti h ARG 209 CO 0.00 0.00 -0.45 0.54 -1.51 0.00 0.00 179.97 178.55 2nti n ARG 210 N -3.44 0.05 0.00 0.20 3.00 -0.92 -4.00 116.66 111.56 2nti n ARG 210 Ca 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 57.85 57.87 2nti n ARG 210 Cb 0.38 -1.53 0.00 0.00 0.00 0.00 0.00 32.46 31.30 2nti n ARG 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2nti n ALA 211 N -1.56 1.66 -3.28 7.54 0.00 -0.62 -4.45 120.51 119.80 2nti n ALA 211 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 2nti n ALA 211 Cb 0.35 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.64 2nti n ALA 211 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2nti s SER 212 N -1.05 2.36 -0.15 0.00 0.15 -0.24 -4.57 113.70 110.20 2nti s SER 212 Ca 0.00 -0.41 -0.11 0.00 0.70 0.00 0.00 55.95 56.13 2nti s SER 212 Cb 0.00 -1.03 -0.24 0.00 -1.71 0.00 0.00 66.02 63.04 2nti s SER 212 CO 0.00 0.10 0.30 0.47 1.20 0.00 0.00 173.24 175.31 2nti n ASP 213 N 3.60 2.05 -4.39 5.45 8.00 -1.25 -4.58 116.55 125.43 2nti n ASP 213 Ca -0.21 0.26 -0.25 0.00 0.71 0.00 0.00 54.79 55.30 2nti n ASP 213 Cb 0.52 -0.88 -0.12 0.00 -0.02 0.00 0.00 41.12 40.62 2nti n ASP 213 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2nti s SER 214 N -6.99 3.16 0.18 -2.24 0.01 -1.26 -0.70 113.70 105.85 2nti s SER 214 Ca -0.25 -0.85 -0.05 0.00 1.31 0.00 0.00 55.95 56.11 2nti s SER 214 Cb 0.07 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 2nti s SER 214 CO 0.71 0.07 0.19 0.00 0.41 0.00 0.00 173.24 174.63 2nti s MET 215 N -2.66 1.15 0.02 12.44 0.23 -0.05 -1.27 119.30 129.15 2nti s MET 215 Ca 0.18 -1.40 0.06 0.00 -1.03 0.00 0.00 55.69 53.50 2nti s MET 215 Cb -0.07 0.32 -0.02 0.00 -1.53 0.00 0.00 34.83 33.52 2nti s MET 215 CO 0.09 -0.39 -0.18 -1.21 -2.03 0.00 0.00 175.02 171.30 2nti s GLU 216 N -4.06 1.28 -0.13 3.16 2.02 0.11 -2.16 118.70 118.93 2nti s GLU 216 Ca 0.27 -0.76 0.02 0.00 0.02 0.00 0.00 54.97 54.51 2nti s GLU 216 Cb 0.05 -1.31 0.01 0.00 0.10 0.00 0.00 34.13 32.99 2nti s GLU 216 CO 0.05 0.34 -0.18 -1.17 0.02 0.00 0.00 175.26 174.33 2nti s LEU 217 N -0.84 1.88 -0.03 1.80 0.20 0.93 -0.91 118.68 121.71 2nti s LEU 217 Ca 0.06 -0.51 0.06 0.00 0.69 0.00 0.00 54.13 54.43 2nti s LEU 217 Cb -0.08 -1.25 -0.01 0.00 -0.43 0.00 0.00 46.19 44.42 2nti s LEU 217 CO 0.01 0.03 -0.22 -0.31 -0.29 0.00 0.00 176.35 175.56 2nti s TYR 218 N 1.00 2.07 0.32 5.38 1.51 0.49 -0.57 117.35 127.55 2nti s TYR 218 Ca -0.05 -0.48 -0.18 0.00 -1.01 0.00 0.00 57.07 55.36 2nti s TYR 218 Cb -0.15 -1.35 0.03 0.00 -0.11 0.00 0.00 41.96 40.38 2nti s TYR 218 CO -0.03 -0.10 0.72 -0.59 -1.11 0.00 0.00 175.55 174.44 2nti s PHE 219 N -0.36 0.02 0.27 2.71 -0.71 -1.16 0.99 117.98 119.74 2nti s PHE 219 Ca 0.04 -0.56 -0.19 0.00 -1.04 0.00 0.00 56.93 55.18 2nti s PHE 219 Cb -0.10 0.70 0.07 0.00 -1.21 0.00 0.00 43.02 42.48 2nti s PHE 219 CO 0.01 -1.36 0.94 0.20 -1.34 0.00 0.00 175.22 173.66 2nti s GLY 220 N -3.00 0.23 0.07 1.99 0.00 -1.26 -3.10 107.32 102.24 2nti s GLY 220 Ca 0.14 -0.52 -0.31 0.00 0.00 0.00 0.00 44.72 44.04 2nti s GLY 220 CO 0.09 1.36 1.27 -0.45 0.00 0.00 0.00 173.10 175.38 2nti s SER 221 N -3.28 6.98 -0.70 1.64 0.15 -1.25 -2.86 113.70 114.38 2nti s SER 221 Ca 0.19 2.12 0.00 0.00 0.70 0.00 0.00 55.95 58.96 2nti s SER 221 Cb -0.04 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2nti s SER 221 CO 0.08 -0.55 0.00 0.00 1.20 0.00 0.00 173.24 173.97 2nti n GLN 222 N 4.08 -1.80 -4.53 5.44 6.02 -1.26 -4.96 117.38 120.37 2nti n GLN 222 Ca 0.10 0.68 -0.34 0.00 -0.01 0.00 0.00 57.00 57.44 2nti n GLN 222 Cb 0.45 -5.01 -0.11 0.00 1.02 0.00 0.00 30.24 26.59 2nti n GLN 222 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2nti s ILE 223 N -1.50 3.82 0.57 5.09 -1.09 -1.14 -4.88 121.20 122.08 2nti s ILE 223 Ca 0.00 -0.50 -0.21 0.00 -2.23 0.00 0.00 60.65 57.71 2nti s ILE 223 Cb 0.00 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.24 2nti s ILE 223 CO 0.00 0.55 1.32 -2.16 -1.23 0.00 0.00 174.94 173.42 2nti s PRO 224 N -0.99 3.03 -0.20 2.79 0.04 -1.26 -4.10 135.00 134.31 2nti s PRO 224 Ca 0.14 2.13 -0.29 0.00 0.04 0.00 0.00 61.00 63.02 2nti s PRO 224 Cb -0.11 -2.14 -0.00 0.00 0.04 0.00 0.00 34.50 32.29 2nti s PRO 224 CO 0.03 -1.25 1.14 -1.17 0.04 0.00 0.00 177.00 175.79 2nti s LEU 225 N -3.73 4.14 -0.25 -3.56 2.96 0.27 -4.45 118.68 114.05 2nti s LEU 225 Ca 0.74 1.52 -0.08 0.00 -0.22 0.00 0.00 54.13 56.09 2nti s LEU 225 Cb -0.38 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.74 2nti s LEU 225 CO 0.44 -0.71 0.09 -0.75 -1.32 0.00 0.00 176.35 174.10 2nti s LYS 226 N 3.31 3.74 -0.31 1.98 2.36 0.28 -0.66 119.74 130.44 2nti s LYS 226 Ca 0.49 -0.44 -0.05 0.00 -2.55 0.00 0.00 55.97 53.41 2nti s LYS 226 Cb -0.18 -3.37 0.03 0.00 -1.05 0.00 0.00 37.83 33.26 2nti s LYS 226 CO 0.10 -0.14 0.06 -0.51 1.55 0.00 0.00 175.35 176.41 2nti s LEU 227 N 1.52 3.97 -0.33 5.43 1.43 -0.56 -0.38 118.68 129.76 2nti s LEU 227 Ca 0.06 -0.98 -0.09 0.00 -1.03 0.00 0.00 54.13 52.08 2nti s LEU 227 Cb -0.15 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2nti s LEU 227 CO 0.05 -0.25 0.15 -0.60 0.23 0.00 0.00 176.35 175.93 2nti s ARG 228 N 1.40 3.09 -0.40 1.70 6.06 -0.09 -1.57 118.95 129.15 2nti s ARG 228 Ca -0.01 -0.88 -0.16 0.00 -2.50 0.00 0.00 55.73 52.18 2nti s ARG 228 Cb -0.18 -3.57 0.01 0.00 0.06 0.00 0.00 34.95 31.27 2nti s ARG 228 CO 0.01 -0.52 0.37 -0.06 -2.50 0.00 0.00 175.30 172.61 2nti s PHE 229 N 1.56 3.20 -0.05 5.12 0.08 -0.32 0.05 117.98 127.61 2nti s PHE 229 Ca 0.03 -0.38 -0.30 0.00 0.12 0.00 0.00 56.93 56.41 2nti s PHE 229 Cb -0.18 -2.75 -0.04 0.00 -0.57 0.00 0.00 43.02 39.48 2nti s PHE 229 CO 0.05 -0.61 1.37 0.15 -0.10 0.00 0.00 175.22 176.08 2nti s LYS 230 N 1.96 4.27 0.26 0.44 1.02 -0.40 -1.07 119.74 126.23 2nti s LYS 230 Ca 0.10 1.87 0.07 0.00 0.02 0.00 0.00 55.97 58.03 2nti s LYS 230 Cb -0.18 -3.67 -0.04 0.00 -0.52 0.00 0.00 37.83 33.43 2nti s LYS 230 CO 0.12 -0.62 0.20 -0.51 -0.92 0.00 0.00 175.35 173.62 2nti s LEU 231 N 2.82 3.75 0.28 3.17 1.43 0.43 -3.92 118.68 126.64 2nti s LEU 231 Ca 0.62 -0.30 -0.27 0.00 -1.03 0.00 0.00 54.13 53.14 2nti s LEU 231 Cb -0.28 -2.29 -0.15 0.00 0.03 0.00 0.00 46.19 43.50 2nti s LEU 231 CO 0.23 -0.07 0.81 -2.65 0.23 0.00 0.00 176.35 174.90 2nti n PRO 232 N -1.18 0.85 -3.52 1.29 -0.02 -1.26 -2.85 135.00 128.31 2nti n PRO 232 Ca -0.07 0.30 -0.22 0.00 -2.02 0.00 0.00 63.50 61.49 2nti n PRO 232 Cb 0.58 -1.55 0.08 0.00 -0.02 0.00 0.00 33.50 32.59 2nti n PRO 232 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2nti n GLN 233 N 0.79 -7.40 -1.15 -0.52 3.00 -1.26 -2.90 117.38 107.94 2nti n GLN 233 Ca 0.12 0.80 -0.05 0.00 -0.01 0.00 0.00 57.00 57.86 2nti n GLN 233 Cb 0.31 -5.74 -0.02 0.00 0.00 0.00 0.00 30.24 24.79 2nti n GLN 233 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2nti n GLU 234 N -4.66 -0.85 -1.51 -1.09 1.02 -1.20 -4.72 120.64 107.64 2nti n GLU 234 Ca -0.05 0.56 -0.31 0.00 -0.02 0.00 0.00 57.16 57.35 2nti n GLU 234 Cb 0.58 -4.40 0.06 0.00 -0.02 0.00 0.00 31.44 27.66 2nti n GLU 234 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2nti s GLY 235 N -2.46 1.67 0.09 0.62 0.00 -1.13 -4.88 107.32 101.22 2nti s GLY 235 Ca 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 44.72 44.71 2nti s GLY 235 CO 0.00 0.42 0.26 -2.52 0.00 0.00 0.00 173.10 171.26 2nti s TYR 236 N -3.03 0.03 -0.27 1.90 1.13 -0.79 -0.43 117.35 115.89 2nti s TYR 236 Ca 0.59 -0.38 0.01 0.00 -1.41 0.00 0.00 57.07 55.87 2nti s TYR 236 Cb -0.15 0.04 0.08 0.00 -1.10 0.00 0.00 41.96 40.83 2nti s TYR 236 CO 0.55 -0.57 0.01 0.20 -2.51 0.00 0.00 175.55 173.23 2nti s GLY 237 N -2.72 1.28 -0.15 5.49 0.00 -0.23 -0.89 107.32 110.11 2nti s GLY 237 Ca 0.03 -1.57 -0.07 0.00 0.00 0.00 0.00 44.72 43.11 2nti s GLY 237 CO -0.10 1.16 0.08 0.99 0.00 0.00 0.00 173.10 175.23 2nti s ASP 238 N 1.42 5.85 -0.15 1.64 -0.00 0.47 -1.18 116.67 124.71 2nti s ASP 238 Ca 0.02 0.22 -0.02 0.00 -0.00 0.00 0.00 52.55 52.77 2nti s ASP 238 Cb -0.18 -1.92 0.04 0.00 -0.00 0.00 0.00 42.92 40.86 2nti s ASP 238 CO -0.12 0.28 -0.01 -0.36 -0.00 0.00 0.00 175.17 174.96 2nti s PHE 239 N -0.26 1.22 -0.24 4.23 0.40 -0.61 -0.44 117.98 122.28 2nti s PHE 239 Ca 0.09 -0.79 -0.09 0.00 -0.60 0.00 0.00 56.93 55.54 2nti s PHE 239 Cb -0.12 -1.09 -0.04 0.00 0.51 0.00 0.00 43.02 42.28 2nti s PHE 239 CO 0.01 -0.55 0.11 0.71 0.70 0.00 0.00 175.22 176.21 2nti s TYR 240 N 1.79 3.18 -0.18 0.36 1.51 0.16 -1.49 117.35 122.68 2nti s TYR 240 Ca 0.01 -0.09 -0.00 0.00 -1.01 0.00 0.00 57.07 55.98 2nti s TYR 240 Cb -0.15 -2.24 0.01 0.00 -0.11 0.00 0.00 41.96 39.46 2nti s TYR 240 CO -0.07 -0.14 -0.15 0.42 -1.11 0.00 0.00 175.55 174.50 2nti s ILE 241 N 1.31 2.55 0.49 2.71 1.01 0.16 -0.98 121.20 128.46 2nti s ILE 241 Ca 0.06 -0.78 -0.23 0.00 0.00 0.00 0.00 60.65 59.69 2nti s ILE 241 Cb -0.15 -2.10 -0.07 0.00 0.01 0.00 0.00 42.46 40.16 2nti s ILE 241 CO 0.05 0.50 1.34 0.00 0.00 0.00 0.00 174.94 176.84 2nti s ALA 242 N 1.21 3.02 0.29 9.38 0.00 0.76 -0.57 121.76 135.85 2nti s ALA 242 Ca 0.02 1.31 -0.29 0.00 0.00 0.00 0.00 51.96 53.00 2nti s ALA 242 Cb -0.14 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 2nti s ALA 242 CO -0.07 -1.15 1.23 -2.14 0.00 0.00 0.00 175.76 173.63 2nti s PRO 243 N -2.66 4.47 -1.21 0.00 0.02 -1.26 -4.62 135.00 129.74 2nti s PRO 243 Ca 0.65 2.03 -0.19 0.00 0.02 0.00 0.00 61.00 63.51 2nti s PRO 243 Cb -0.39 -3.14 0.07 0.00 0.02 0.00 0.00 34.50 31.05 2nti s PRO 243 CO 0.49 -0.05 1.64 0.50 -0.33 0.00 0.00 177.00 179.25 2nti s ARG 244 N -1.34 3.88 0.00 5.54 6.06 0.73 -5.00 118.95 128.82 2nti s ARG 244 Ca 0.49 -1.77 0.00 0.00 -2.50 0.00 0.00 55.73 51.95 2nti s ARG 244 Cb -0.36 -5.47 0.00 0.00 0.06 0.00 0.00 34.95 29.18 2nti s ARG 244 CO 0.46 -2.22 0.00 0.00 -2.50 0.00 0.00 175.30 171.03