#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 0.85 -0.18 2.12 1.75 -1.23 -2.12 119.30 120.48 2nti s MET 2 Ca 0.00 -1.29 -0.07 0.00 -1.25 0.00 0.00 55.69 53.08 2nti s MET 2 Cb 0.00 -0.31 0.08 0.00 2.84 0.00 0.00 34.83 37.44 2nti s MET 2 CO 0.00 0.01 0.39 0.21 -0.65 0.00 0.00 175.02 174.99 2nti s LYS 3 N -3.54 0.32 -0.03 4.11 2.20 -0.02 -1.60 119.74 121.18 2nti s LYS 3 Ca 0.10 0.91 0.00 0.00 -0.36 0.00 0.00 55.97 56.62 2nti s LYS 3 Cb 0.03 0.16 0.03 0.00 -1.51 0.00 0.00 37.83 36.54 2nti s LYS 3 CO -0.03 -0.22 0.00 0.00 -0.36 0.00 0.00 175.35 174.74 2nti s ALA 4 N 2.15 0.29 -0.18 3.13 0.00 0.02 -0.91 121.76 126.25 2nti s ALA 4 Ca -0.04 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 2nti s ALA 4 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 2nti s ALA 4 CO -0.12 -0.07 -0.06 0.21 0.00 0.00 0.00 175.76 175.72 2nti s LYS 5 N 1.01 3.47 -0.19 0.00 2.20 -0.43 -0.35 119.74 125.45 2nti s LYS 5 Ca -0.10 -0.60 -0.06 0.00 -0.36 0.00 0.00 55.97 54.85 2nti s LYS 5 Cb -0.13 -2.92 -0.03 0.00 -1.51 0.00 0.00 37.83 33.24 2nti s LYS 5 CO -0.02 0.01 0.02 0.08 -0.36 0.00 0.00 175.35 175.08 2nti s VAL 6 N 0.94 4.30 -0.03 4.02 1.01 0.19 0.54 120.40 131.37 2nti s VAL 6 Ca -0.01 -0.20 -0.24 0.00 0.00 0.00 0.00 61.98 61.53 2nti s VAL 6 Cb -0.15 -2.93 -0.18 0.00 0.00 0.00 0.00 36.38 33.12 2nti s VAL 6 CO 0.01 0.45 1.07 0.40 0.00 0.00 0.00 175.10 177.02 2nti h ILE 7 N 5.13 1.03 -1.84 2.22 1.08 -1.89 0.37 117.51 123.62 2nti h ILE 7 Ca -0.35 -1.08 -0.70 0.00 -0.39 0.00 0.00 64.86 62.34 2nti h ILE 7 Cb 1.18 1.67 -0.15 0.00 -3.07 0.00 0.00 36.82 36.45 2nti h ILE 7 CO 0.65 0.24 1.43 -0.62 -0.69 0.00 0.00 178.15 179.16 2nti s ASP 8 N -5.50 6.86 0.24 1.72 -1.08 -1.26 -4.13 116.67 113.52 2nti s ASP 8 Ca -0.14 -2.51 -0.02 0.00 -0.52 0.00 0.00 52.55 49.36 2nti s ASP 8 Cb 0.01 -2.46 0.29 0.00 -1.46 0.00 0.00 42.92 39.30 2nti s ASP 8 CO 0.56 -0.99 1.69 0.00 0.52 0.00 0.00 175.17 176.96 2nti h ALA 9 N 7.90 1.00 0.01 3.66 0.00 -1.72 -2.95 119.26 127.15 2nti h ALA 9 Ca 0.30 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2nti h ALA 9 Cb 0.92 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2nti h ALA 9 CO 1.28 0.59 -0.01 0.28 0.00 0.00 0.00 179.25 181.39 2nti h VAL 10 N 0.64 0.97 -0.59 0.00 2.07 -1.87 -0.73 116.25 116.74 2nti h VAL 10 Ca 0.10 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.64 2nti h VAL 10 Cb 0.62 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 2nti h VAL 10 CO 0.04 0.00 0.37 0.28 0.02 0.00 0.00 177.57 178.28 2nti h SER 11 N -0.03 0.61 -0.95 0.57 0.02 -1.74 -2.31 113.55 109.72 2nti h SER 11 Ca 0.00 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2nti h SER 11 Cb 0.03 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.39 2nti h SER 11 CO -0.01 0.43 0.63 0.15 -1.14 0.00 0.00 176.83 176.89 2nti h PHE 12 N 0.74 1.19 0.00 3.45 3.57 -1.32 -2.18 116.94 122.38 2nti h PHE 12 Ca 0.23 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 2nti h PHE 12 Cb -0.01 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.32 2nti h PHE 12 CO -0.05 0.75 -0.27 0.66 -2.23 0.00 0.00 178.31 177.17 2nti h SER 13 N 1.28 0.00 1.41 0.41 4.64 -0.59 -2.37 113.55 118.33 2nti h SER 13 Ca 0.35 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.60 2nti h SER 13 Cb -0.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2nti h SER 13 CO -0.08 0.27 -0.35 1.88 -0.87 0.00 0.00 176.83 177.68 2nti h TYR 14 N 0.00 0.00 -0.05 4.77 -1.99 -1.07 -0.98 116.97 117.65 2nti h TYR 14 Ca -0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2nti h TYR 14 Cb 0.54 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.27 2nti h TYR 14 CO 0.00 0.35 0.00 0.82 -0.00 0.00 0.00 178.16 179.33 2nti h ILE 15 N 0.00 1.23 0.00 -2.88 2.04 -1.22 -2.21 117.51 114.47 2nti h ILE 15 Ca -0.00 -0.70 -0.11 0.00 1.00 0.00 0.00 64.86 65.04 2nti h ILE 15 Cb 1.14 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 2nti h ILE 15 CO 0.05 0.19 -0.54 -0.07 0.00 0.00 0.00 178.15 177.77 2nti h LEU 16 N -0.19 0.00 -0.99 1.44 3.38 -1.47 -1.01 115.31 116.47 2nti h LEU 16 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2nti h LEU 16 Cb 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2nti h LEU 16 CO 0.00 0.54 0.20 -0.09 0.09 0.00 0.00 178.44 179.18 2nti h ARG 17 N 0.00 0.93 -0.24 1.13 9.65 -1.19 -0.15 114.38 124.51 2nti h ARG 17 Ca -0.01 -0.17 -0.10 0.00 -1.10 0.00 0.00 59.98 58.61 2nti h ARG 17 Cb 0.96 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 29.39 2nti h ARG 17 CO 0.07 0.79 -0.22 1.15 2.80 0.00 0.00 179.97 184.56 2nti h THR 18 N 0.90 1.32 -0.97 0.20 2.02 -0.70 -2.95 112.91 112.73 2nti h THR 18 Ca 0.20 -1.38 0.04 0.00 0.77 0.00 0.00 66.41 66.05 2nti h THR 18 Cb 0.25 1.67 -0.06 0.00 -1.74 0.00 0.00 68.15 68.27 2nti h THR 18 CO -0.01 0.43 0.64 0.58 0.37 0.00 0.00 175.52 177.53 2nti h VAL 19 N 0.28 1.15 0.00 3.16 2.07 -1.03 -2.18 116.25 119.69 2nti h VAL 19 Ca 0.04 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2nti h VAL 19 Cb 0.77 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2nti h VAL 19 CO 0.06 0.22 -0.01 1.23 0.02 0.00 0.00 177.57 179.09 2nti h GLY 20 N 1.20 0.00 2.00 2.17 0.00 -0.85 -0.69 103.07 106.91 2nti h GLY 20 Ca 0.40 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.72 2nti h GLY 20 CO -0.13 0.00 -0.01 -0.55 0.00 0.00 0.00 176.54 175.85 2nti h ASP 21 N 0.00 0.00 0.00 0.19 3.45 -1.32 -3.33 116.42 115.42 2nti h ASP 21 Ca -0.00 0.00 -0.17 0.00 0.43 0.00 0.00 57.03 57.29 2nti h ASP 21 Cb 0.05 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 38.79 2nti h ASP 21 CO 0.00 0.01 -1.63 0.49 -1.57 0.00 0.00 179.24 176.54 2nti n PHE 22 N -3.11 0.00 -4.61 4.55 3.01 -0.39 -5.05 117.46 111.86 2nti n PHE 22 Ca 0.01 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.20 2nti n PHE 22 Cb 0.34 -0.45 -0.14 0.00 -0.01 0.00 0.00 39.48 39.22 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 -4.67 2.21 -0.08 4.37 1.43 -0.44 -4.07 118.68 117.44 2nti s LEU 23 Ca -0.05 -0.60 -0.08 0.00 -1.03 0.00 0.00 54.13 52.37 2nti s LEU 23 Cb 0.03 -1.08 -0.28 0.00 0.03 0.00 0.00 46.19 44.89 2nti s LEU 23 CO 0.38 0.17 0.54 0.28 0.23 0.00 0.00 176.35 177.95 2nti h SER 24 N 4.56 0.51 -5.09 2.29 0.02 -1.88 -3.40 113.55 110.54 2nti h SER 24 Ca -0.46 -0.91 -0.14 0.00 -0.84 0.00 0.00 61.79 59.45 2nti h SER 24 Cb 1.16 -0.16 -0.18 0.00 0.14 0.00 0.00 62.40 63.36 2nti h SER 24 CO 0.42 1.79 -0.60 -1.61 -1.14 0.00 0.00 176.83 175.69 2nti s GLU 25 N -2.57 0.52 0.28 3.45 2.02 -1.26 -0.80 118.70 120.34 2nti s GLU 25 Ca -0.18 -0.82 -0.21 0.00 0.02 0.00 0.00 54.97 53.78 2nti s GLU 25 Cb 0.06 0.20 0.02 0.00 0.10 0.00 0.00 34.13 34.51 2nti s GLU 25 CO 0.82 -0.11 0.74 0.00 0.02 0.00 0.00 175.26 176.72 2nti s ALA 26 N -2.61 -1.22 -0.07 5.21 0.00 -0.88 -4.93 121.76 117.25 2nti s ALA 26 Ca -0.05 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 51.63 2nti s ALA 26 Cb -0.01 0.83 -0.02 0.00 0.00 0.00 0.00 23.12 23.92 2nti s ALA 26 CO -0.05 -1.04 -0.15 -0.80 0.00 0.00 0.00 175.76 173.72 2nti s ASN 27 N -2.93 3.94 -0.28 0.00 -0.87 -1.26 -1.05 114.94 112.49 2nti s ASN 27 Ca 0.11 -0.26 -0.27 0.00 -1.57 0.00 0.00 52.86 50.87 2nti s ASN 27 Cb -0.06 -1.04 0.01 0.00 -0.02 0.00 0.00 41.25 40.15 2nti s ASN 27 CO 0.07 0.29 0.98 -0.36 -2.57 0.00 0.00 177.10 175.51 2nti s PHE 28 N -0.40 3.23 -0.44 2.20 2.99 0.31 -4.46 117.98 121.41 2nti s PHE 28 Ca 0.04 1.20 -0.19 0.00 0.00 0.00 0.00 56.93 57.98 2nti s PHE 28 Cb -0.12 -3.41 0.03 0.00 0.00 0.00 0.00 43.02 39.52 2nti s PHE 28 CO 0.02 -0.61 0.55 0.42 -0.00 0.00 0.00 175.22 175.61 2nti s ILE 29 N 3.30 4.94 -0.23 0.64 -1.09 0.58 -1.66 121.20 127.68 2nti s ILE 29 Ca 0.41 -0.20 -0.07 0.00 -2.23 0.00 0.00 60.65 58.56 2nti s ILE 29 Cb -0.14 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.55 2nti s ILE 29 CO 0.11 -0.57 0.07 -0.69 -1.23 0.00 0.00 174.94 172.64 2nti s VAL 30 N 2.50 4.49 0.38 2.92 1.01 0.59 -1.05 120.40 131.24 2nti s VAL 30 Ca 0.17 -0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.08 2nti s VAL 30 Cb -0.16 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 2nti s VAL 30 CO 0.15 0.37 0.18 0.35 0.00 0.00 0.00 175.10 176.15 2nti n THR 31 N 4.55 0.00 -0.08 3.92 -2.24 -0.48 -0.92 114.28 119.03 2nti n THR 31 Ca -0.16 -2.35 0.12 0.00 -2.27 0.00 0.00 64.05 59.39 2nti n THR 31 Cb 0.52 0.94 0.50 0.00 -2.10 0.00 0.00 70.33 70.19 2nti n THR 31 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2nti h LYS 32 N 0.00 0.39 0.00 -0.78 3.64 -1.85 -2.52 116.57 115.44 2nti h LYS 32 Ca -0.29 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2nti h LYS 32 Cb 1.19 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2nti h LYS 32 CO 0.45 0.26 -0.40 -0.85 -2.27 0.00 0.00 179.45 176.64 2nti n GLU 33 N -4.47 0.06 -0.73 1.90 0.00 -1.26 -4.75 120.64 111.39 2nti n GLU 33 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.28 2nti n GLU 33 Cb 0.37 -1.54 0.00 0.00 0.00 0.00 0.00 31.44 30.27 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 1.47 0.50 3.23 -1.84 0.00 -0.95 -0.70 105.19 106.89 2nti n GLY 34 Ca 0.05 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.21 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 -3.36 1.97 -0.00 -0.61 1.01 0.04 -1.39 121.20 118.86 2nti s ILE 35 Ca 0.00 -1.00 0.06 0.00 0.00 0.00 0.00 60.65 59.71 2nti s ILE 35 Cb 0.00 -1.69 -0.02 0.00 0.01 0.00 0.00 42.46 40.77 2nti s ILE 35 CO 0.00 0.55 -0.19 -0.60 0.00 0.00 0.00 174.94 174.69 2nti s ARG 36 N 0.06 1.51 -0.07 2.79 3.52 -0.22 -0.12 118.95 126.41 2nti s ARG 36 Ca -0.09 -0.72 0.01 0.00 -0.13 0.00 0.00 55.73 54.79 2nti s ARG 36 Cb -0.15 -1.48 0.02 0.00 -1.56 0.00 0.00 34.95 31.78 2nti s ARG 36 CO 0.05 0.40 -0.07 0.08 -0.81 0.00 0.00 175.30 174.96 2nti s VAL 37 N -0.51 0.82 0.06 7.11 1.01 -0.20 -0.30 120.40 128.38 2nti s VAL 37 Ca 0.07 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 61.87 2nti s VAL 37 Cb -0.08 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2nti s VAL 37 CO -0.00 0.31 -0.14 -0.44 0.00 0.00 0.00 175.10 174.82 2nti s SER 38 N 1.23 1.67 -0.20 3.32 0.01 -1.26 0.31 113.70 118.77 2nti s SER 38 Ca -0.05 -0.57 -0.35 0.00 1.31 0.00 0.00 55.95 56.29 2nti s SER 38 Cb -0.14 -0.07 0.14 0.00 0.21 0.00 0.00 66.02 66.17 2nti s SER 38 CO -0.02 -0.04 1.23 -0.83 0.41 0.00 0.00 173.24 173.99 2nti s GLY 39 N -1.56 -0.27 -0.12 3.44 0.00 -0.70 -4.72 107.32 103.39 2nti s GLY 39 Ca -0.01 1.68 0.02 0.00 0.00 0.00 0.00 44.72 46.41 2nti s GLY 39 CO 0.02 0.57 -0.20 -0.42 0.00 0.00 0.00 173.10 173.06 2nti s ILE 40 N -2.32 2.33 0.86 0.90 1.01 -1.26 -0.75 121.20 121.97 2nti s ILE 40 Ca 0.10 -0.91 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 2nti s ILE 40 Cb -0.01 -1.93 0.11 0.00 0.01 0.00 0.00 42.46 40.64 2nti s ILE 40 CO -0.04 0.55 1.10 1.51 0.00 0.00 0.00 174.94 178.05 2nti s ASP 41 N 0.49 3.67 0.57 3.58 -4.77 -0.86 -4.89 116.67 114.46 2nti s ASP 41 Ca -0.14 1.81 0.25 0.00 -3.30 0.00 0.00 52.55 51.18 2nti s ASP 41 Cb -0.17 -2.44 1.62 0.00 -1.09 0.00 0.00 42.92 40.85 2nti s ASP 41 CO 0.05 -2.56 2.19 1.55 0.70 0.00 0.00 175.17 177.10 2nti h PRO 42 N -1.49 0.00 -0.07 2.11 0.13 -1.94 0.11 132.00 130.85 2nti h PRO 42 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2nti h PRO 42 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2nti h PRO 42 CO 0.50 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.14 2nti n SER 43 N -4.06 0.67 -2.61 1.44 3.41 -1.26 -4.92 113.62 106.29 2nti n SER 43 Ca -0.02 -1.54 -0.15 0.00 -0.26 0.00 0.00 58.87 56.91 2nti n SER 43 Cb 0.15 -0.04 -0.00 0.00 -0.26 0.00 0.00 64.21 64.05 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 -0.34 -2.52 -0.09 4.33 3.00 0.03 -4.86 116.66 116.21 2nti n ARG 44 Ca 0.15 0.61 -0.09 0.00 -0.01 0.00 0.00 57.85 58.51 2nti n ARG 44 Cb 0.17 -5.24 -0.14 0.00 0.00 0.00 0.00 32.46 27.25 2nti n ARG 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2nti n VAL 45 N -3.55 1.21 -5.20 1.55 0.31 -1.26 -4.95 118.33 106.43 2nti n VAL 45 Ca -0.13 -0.75 -0.31 0.00 -0.01 0.00 0.00 64.34 63.14 2nti n VAL 45 Cb 0.60 -0.52 -0.17 0.00 -0.91 0.00 0.00 33.84 32.85 2nti n VAL 45 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2nti s VAL 46 N -2.44 2.00 -0.17 2.52 0.11 -1.26 -0.70 120.40 120.46 2nti s VAL 46 Ca -0.09 -1.01 -0.07 0.00 -2.93 0.00 0.00 61.98 57.88 2nti s VAL 46 Cb 0.05 -1.72 -0.04 0.00 -1.53 0.00 0.00 36.38 33.15 2nti s VAL 46 CO 0.73 0.55 0.07 0.12 -3.33 0.00 0.00 175.10 173.24 2nti s PHE 47 N 0.14 3.30 0.09 1.54 5.36 -0.34 -2.04 117.98 126.04 2nti s PHE 47 Ca -0.12 0.16 0.10 0.00 -0.96 0.00 0.00 56.93 56.11 2nti s PHE 47 Cb -0.16 -2.05 -0.03 0.00 -0.34 0.00 0.00 43.02 40.44 2nti s PHE 47 CO 0.06 0.26 -0.26 -0.48 -1.46 0.00 0.00 175.22 173.35 2nti s LEU 48 N 0.10 2.25 -0.21 6.12 0.05 0.07 0.28 118.68 127.34 2nti s LEU 48 Ca 0.06 -0.67 -0.04 0.00 0.05 0.00 0.00 54.13 53.53 2nti s LEU 48 Cb -0.12 -1.23 0.10 0.00 -2.05 0.00 0.00 46.19 42.89 2nti s LEU 48 CO 0.00 0.21 0.22 -0.62 -0.55 0.00 0.00 176.35 175.62 2nti s ASP 49 N -1.66 1.48 -0.18 1.48 2.15 0.46 -1.72 116.67 118.69 2nti s ASP 49 Ca 0.12 -0.31 -0.05 0.00 0.43 0.00 0.00 52.55 52.74 2nti s ASP 49 Cb -0.10 0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.86 2nti s ASP 49 CO 0.04 -0.34 -0.00 -0.63 -0.17 0.00 0.00 175.17 174.07 2nti s ILE 50 N 2.32 4.12 -0.16 4.11 -1.09 0.15 -0.71 121.20 129.93 2nti s ILE 50 Ca 0.07 -0.27 0.01 0.00 -2.23 0.00 0.00 60.65 58.23 2nti s ILE 50 Cb -0.16 -2.84 0.03 0.00 -1.58 0.00 0.00 42.46 37.91 2nti s ILE 50 CO -0.15 0.46 -0.15 0.12 -1.23 0.00 0.00 174.94 174.00 2nti s PHE 51 N 0.59 2.36 -0.42 3.97 5.36 -0.53 -1.04 117.98 128.27 2nti s PHE 51 Ca -0.01 -1.39 -0.07 0.00 -0.96 0.00 0.00 56.93 54.51 2nti s PHE 51 Cb -0.14 -1.68 0.10 0.00 -0.34 0.00 0.00 43.02 40.96 2nti s PHE 51 CO 0.02 -0.71 0.25 -0.51 -1.46 0.00 0.00 175.22 172.80 2nti s LEU 52 N 1.42 5.23 0.71 6.12 1.43 0.82 -2.40 118.68 132.03 2nti s LEU 52 Ca 0.04 -1.74 -0.15 0.00 -1.03 0.00 0.00 54.13 51.26 2nti s LEU 52 Cb -0.13 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.18 2nti s LEU 52 CO -0.11 -0.56 1.16 -2.84 0.23 0.00 0.00 176.35 174.23 2nti s PRO 53 N 1.32 2.34 0.39 1.29 0.02 -1.26 -0.78 135.00 138.32 2nti s PRO 53 Ca 0.05 1.58 0.18 0.00 0.02 0.00 0.00 61.00 62.83 2nti s PRO 53 Cb -0.24 -1.88 1.09 0.00 0.02 0.00 0.00 34.50 33.50 2nti s PRO 53 CO -0.01 -1.64 1.75 0.66 -0.33 0.00 0.00 177.00 177.44 2nti h SER 54 N -0.27 0.47 0.78 2.53 4.64 -1.21 0.33 113.55 120.81 2nti h SER 54 Ca -0.47 0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2nti h SER 54 Cb 1.27 0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2nti h SER 54 CO 0.51 0.07 -0.01 0.28 -0.87 0.00 0.00 176.83 176.81 2nti h SER 55 N 0.40 0.00 -0.17 4.97 0.02 -1.89 -2.81 113.55 114.07 2nti h SER 55 Ca 0.62 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.50 2nti h SER 55 Cb 1.54 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.06 2nti h SER 55 CO -0.33 0.01 -0.08 0.22 -1.14 0.00 0.00 176.83 175.51 2nti h TYR 56 N 0.00 0.53 -3.49 3.45 5.03 -1.18 -3.44 116.97 117.88 2nti h TYR 56 Ca -0.00 -0.07 -0.50 0.00 2.58 0.00 0.00 58.73 60.74 2nti h TYR 56 Cb 0.40 -0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.54 2nti h TYR 56 CO 0.00 0.57 0.02 -0.06 -1.32 0.00 0.00 178.16 177.38 2nti s PHE 57 N -4.83 3.49 0.11 -3.82 0.40 -1.06 -4.85 117.98 107.41 2nti s PHE 57 Ca -0.07 0.86 -0.11 0.00 -0.60 0.00 0.00 56.93 57.01 2nti s PHE 57 Cb 0.15 -2.30 -0.15 0.00 0.51 0.00 0.00 43.02 41.24 2nti s PHE 57 CO 0.77 -0.03 1.30 1.49 0.70 0.00 0.00 175.22 179.45 2nti h GLU 58 N 1.24 0.73 -4.71 0.44 4.57 -0.19 -3.45 114.58 113.20 2nti h GLU 58 Ca -0.47 -0.63 -0.33 0.00 -1.18 0.00 0.00 59.36 56.74 2nti h GLU 58 Cb 1.19 0.14 -0.24 0.00 -0.16 0.00 0.00 28.75 29.69 2nti h GLU 58 CO 0.64 1.24 -0.75 0.20 -1.18 0.00 0.00 179.01 179.15 2nti s GLY 59 N -4.18 0.53 -0.22 1.92 0.00 -1.24 -4.97 107.32 99.16 2nti s GLY 59 Ca -0.10 -0.66 -0.07 0.00 0.00 0.00 0.00 44.72 43.90 2nti s GLY 59 CO 0.90 -0.67 0.45 -0.12 0.00 0.00 0.00 173.10 173.66 2nti s PHE 60 N -0.95 -0.89 -0.02 1.90 5.36 -1.25 -1.32 117.98 120.81 2nti s PHE 60 Ca -0.04 1.56 -0.01 0.00 -0.96 0.00 0.00 56.93 57.48 2nti s PHE 60 Cb -0.08 0.34 0.01 0.00 -0.34 0.00 0.00 43.02 42.96 2nti s PHE 60 CO 0.01 -0.54 0.04 -1.83 -1.46 0.00 0.00 175.22 171.44 2nti s GLU 61 N 2.65 0.03 0.26 10.12 -1.05 -0.09 -5.01 118.70 125.62 2nti s GLU 61 Ca -0.00 0.10 0.12 0.00 -0.15 0.00 0.00 54.97 55.04 2nti s GLU 61 Cb -0.12 -0.05 -0.05 0.00 -0.44 0.00 0.00 34.13 33.47 2nti s GLU 61 CO -0.14 -0.05 -0.20 0.14 0.95 0.00 0.00 175.26 175.96 2nti s VAL 62 N 0.32 2.47 -0.10 1.83 -7.23 -1.26 -0.84 120.40 115.60 2nti s VAL 62 Ca -0.02 -2.33 0.09 0.00 -1.81 0.00 0.00 61.98 57.91 2nti s VAL 62 Cb -0.04 -2.28 -0.13 0.00 0.56 0.00 0.00 36.38 34.50 2nti s VAL 62 CO -0.01 -0.34 0.04 -1.54 -0.31 0.00 0.00 175.10 172.94 2nti n SER 63 N -0.45 2.50 -4.55 4.85 3.41 -0.90 -4.98 113.62 113.49 2nti n SER 63 Ca -0.06 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.29 2nti n SER 63 Cb 0.59 0.77 -0.10 0.00 -0.26 0.00 0.00 64.21 65.21 2nti n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nti s GLN 64 N -2.26 1.86 0.14 4.33 -2.07 -1.26 -4.98 119.66 115.42 2nti s GLN 64 Ca -0.05 -2.06 -0.17 0.00 -1.82 0.00 0.00 55.36 51.26 2nti s GLN 64 Cb 0.03 -1.31 -0.01 0.00 -1.09 0.00 0.00 33.01 30.64 2nti s GLN 64 CO 0.42 -0.14 1.75 0.93 -1.32 0.00 0.00 175.29 176.92 2nti h GLU 65 N 1.87 0.51 -3.53 9.60 3.07 -1.97 -3.44 114.58 120.70 2nti h GLU 65 Ca -0.42 -0.06 -0.30 0.00 -0.50 0.00 0.00 59.36 58.07 2nti h GLU 65 Cb 1.25 -0.10 -0.34 0.00 -0.84 0.00 0.00 28.75 28.72 2nti h GLU 65 CO 0.75 0.42 -0.73 0.21 -1.40 0.00 0.00 179.01 178.26 2nti s LYS 66 N -5.88 -0.02 -0.02 2.33 2.20 -1.26 -4.24 119.74 112.85 2nti s LYS 66 Ca -0.13 0.19 0.04 0.00 -0.36 0.00 0.00 55.97 55.71 2nti s LYS 66 Cb 0.10 -0.27 -0.01 0.00 -1.51 0.00 0.00 37.83 36.14 2nti s LYS 66 CO 0.73 -0.17 -0.15 -2.00 -0.36 0.00 0.00 175.35 173.39 2nti s GLU 67 N 1.10 1.37 -0.16 4.03 2.12 -0.09 -4.99 118.70 122.08 2nti s GLU 67 Ca -0.09 -0.55 0.01 0.00 0.36 0.00 0.00 54.97 54.71 2nti s GLU 67 Cb -0.13 -1.28 0.01 0.00 0.26 0.00 0.00 34.13 32.99 2nti s GLU 67 CO -0.03 0.29 -0.19 0.42 -0.54 0.00 0.00 175.26 175.21 2nti s ILE 68 N -0.21 2.23 -0.31 -3.70 1.01 -1.26 -0.30 121.20 118.66 2nti s ILE 68 Ca 0.03 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.80 2nti s ILE 68 Cb -0.08 -1.92 0.09 0.00 0.01 0.00 0.00 42.46 40.56 2nti s ILE 68 CO 0.00 0.53 0.03 -0.63 0.00 0.00 0.00 174.94 174.87 2nti s ILE 69 N 1.02 1.92 0.18 2.92 1.01 -0.67 -4.95 121.20 122.63 2nti s ILE 69 Ca -0.02 -1.95 -0.27 0.00 0.00 0.00 0.00 60.65 58.42 2nti s ILE 69 Cb -0.15 -2.34 -0.08 0.00 0.01 0.00 0.00 42.46 39.90 2nti s ILE 69 CO -0.06 -0.48 0.82 -0.83 0.00 0.00 0.00 174.94 174.39 2nti s GLY 70 N 1.12 2.97 0.06 6.18 0.00 -1.24 -0.53 107.32 115.89 2nti s GLY 70 Ca 0.06 0.43 -0.16 0.00 0.00 0.00 0.00 44.72 45.05 2nti s GLY 70 CO -0.11 0.97 0.36 -0.11 0.00 0.00 0.00 173.10 174.22 2nti s PHE 71 N -1.09 -0.18 -0.22 1.90 -0.12 -0.21 -2.38 117.98 115.68 2nti s PHE 71 Ca 0.37 0.03 -0.16 0.00 -0.05 0.00 0.00 56.93 57.12 2nti s PHE 71 Cb -0.24 0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.29 2nti s PHE 71 CO 0.28 -0.57 0.41 0.21 -0.05 0.00 0.00 175.22 175.49 2nti s LYS 72 N -2.85 4.13 0.26 1.99 2.36 -1.26 -2.08 119.74 122.30 2nti s LYS 72 Ca -0.03 0.19 -0.05 0.00 -2.55 0.00 0.00 55.97 53.53 2nti s LYS 72 Cb 0.00 -3.57 0.30 0.00 -1.05 0.00 0.00 37.83 33.51 2nti s LYS 72 CO -0.05 -0.12 1.88 -0.07 1.55 0.00 0.00 175.35 178.54 2nti h LEU 73 N 7.96 1.03 -0.88 5.43 3.38 -1.26 -1.29 115.31 129.67 2nti h LEU 73 Ca -0.34 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.55 2nti h LEU 73 Cb 1.16 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.60 2nti h LEU 73 CO 0.70 0.83 0.58 -0.08 0.09 0.00 0.00 178.44 180.56 2nti h GLU 74 N 1.16 1.14 -0.13 1.13 4.81 -1.89 0.20 114.58 121.01 2nti h GLU 74 Ca 0.29 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.38 2nti h GLU 74 Cb 0.03 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.15 2nti h GLU 74 CO -0.05 0.75 -0.19 -0.44 -0.73 0.00 0.00 179.01 178.36 2nti h ASP 75 N 1.18 0.38 -0.77 1.04 3.32 -1.78 0.02 116.42 119.81 2nti h ASP 75 Ca 0.33 -0.53 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 2nti h ASP 75 Cb -0.11 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 2nti h ASP 75 CO -0.08 0.84 0.42 0.58 -1.72 0.00 0.00 179.24 179.27 2nti h VAL 76 N -0.06 1.23 -0.06 -1.35 2.07 -1.14 -2.84 116.25 114.10 2nti h VAL 76 Ca 0.01 -0.60 -0.17 0.00 0.82 0.00 0.00 66.70 66.76 2nti h VAL 76 Cb 0.76 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2nti h VAL 76 CO 0.04 0.27 -0.72 0.78 0.02 0.00 0.00 177.57 177.97 2nti h ASN 77 N 1.10 0.36 -0.98 0.57 2.35 -0.51 -1.25 115.58 117.22 2nti h ASN 77 Ca 0.28 -0.24 0.07 0.00 -0.55 0.00 0.00 56.30 55.86 2nti h ASN 77 Cb 0.05 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 38.24 2nti h ASN 77 CO -0.04 0.96 0.64 0.44 -1.65 0.00 0.00 177.43 177.77 2nti h ASP 78 N 0.21 1.00 -0.12 5.81 3.32 -0.78 0.15 116.42 126.00 2nti h ASP 78 Ca -0.02 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 2nti h ASP 78 Cb 1.28 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2nti h ASP 78 CO 0.12 0.62 -0.22 0.40 -1.72 0.00 0.00 179.24 178.44 2nti h ILE 79 N 1.12 1.38 0.00 0.35 2.04 -1.30 -3.17 117.51 117.93 2nti h ILE 79 Ca 0.43 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 2nti h ILE 79 Cb 0.22 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 2nti h ILE 79 CO -0.18 0.43 -0.10 -0.07 0.00 0.00 0.00 178.15 178.23 2nti h LEU 80 N -0.07 0.00 0.00 1.44 3.38 -0.71 -0.24 115.31 119.11 2nti h LEU 80 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2nti h LEU 80 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2nti h LEU 80 CO 0.05 0.10 0.00 0.29 0.09 0.00 0.00 178.44 178.97 2nti n LYS 81 N -3.38 0.06 -0.05 1.13 5.02 0.46 -2.26 118.16 119.13 2nti n LYS 81 Ca -0.01 0.20 0.12 0.00 -2.02 0.00 0.00 58.31 56.60 2nti n LYS 81 Cb 0.28 -1.50 0.36 0.00 -0.02 0.00 0.00 35.03 34.15 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 -1.45 1.91 -1.75 1.97 5.12 -0.10 -4.95 116.66 117.40 2nti n ARG 82 Ca 0.05 -1.35 -0.40 0.00 -1.93 0.00 0.00 57.85 54.22 2nti n ARG 82 Cb 0.18 -1.45 0.02 0.00 -1.16 0.00 0.00 32.46 30.04 2nti n ARG 82 CO 0.00 0.00 0.00 1.55 -1.93 0.00 0.00 177.63 177.25 2nti n VAL 83 N 0.60 2.86 -3.98 1.55 3.14 -0.96 -5.02 118.33 116.51 2nti n VAL 83 Ca 0.17 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.72 2nti n VAL 83 Cb 0.42 -1.80 -0.06 0.00 -1.06 0.00 0.00 33.84 31.35 2nti n VAL 83 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2nti s LEU 84 N -2.61 4.18 0.09 6.55 1.43 -1.26 -5.02 118.68 122.04 2nti s LEU 84 Ca 0.62 0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 2nti s LEU 84 Cb -0.45 -2.46 0.12 0.00 0.03 0.00 0.00 46.19 43.43 2nti s LEU 84 CO 0.57 0.27 0.54 1.17 0.23 0.00 0.00 176.35 179.13 2nti n LYS 85 N 1.07 -0.06 -0.32 1.70 3.00 -1.26 -0.36 118.16 121.94 2nti n LYS 85 Ca -0.12 0.54 0.07 0.00 -0.00 0.00 0.00 58.31 58.80 2nti n LYS 85 Cb 0.53 -0.80 0.23 0.00 0.00 0.00 0.00 35.03 34.98 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 -4.54 3.52 -4.76 3.14 8.00 -1.26 -4.82 116.55 115.84 2nti n ASP 86 Ca 0.05 -2.26 -0.39 0.00 0.71 0.00 0.00 54.79 52.90 2nti n ASP 86 Cb 0.16 -0.38 0.02 0.00 -0.02 0.00 0.00 41.12 40.90 2nti n ASP 86 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2nti s ASP 87 N -1.16 5.72 0.29 -2.24 -0.00 0.52 -4.76 116.67 115.04 2nti s ASP 87 Ca 0.34 2.74 0.05 0.00 -0.00 0.00 0.00 52.55 55.68 2nti s ASP 87 Cb 0.21 -2.64 -0.02 0.00 -0.00 0.00 0.00 42.92 40.47 2nti s ASP 87 CO 0.18 -1.26 0.42 0.42 -0.00 0.00 0.00 175.17 174.93 2nti s THR 88 N -1.30 4.83 -0.03 -1.27 -4.23 -0.20 -3.54 115.64 109.91 2nti s THR 88 Ca 0.65 -0.92 0.02 0.00 -1.18 0.00 0.00 61.69 60.25 2nti s THR 88 Cb -0.40 -3.71 0.01 0.00 1.34 0.00 0.00 72.50 69.75 2nti s THR 88 CO 0.49 -0.30 -0.06 -0.22 -0.54 0.00 0.00 174.62 173.99 2nti s LEU 89 N -4.09 1.57 -0.24 4.79 0.20 0.12 -1.37 118.68 119.66 2nti s LEU 89 Ca 0.38 -0.14 -0.01 0.00 0.69 0.00 0.00 54.13 55.06 2nti s LEU 89 Cb -0.09 -0.44 0.03 0.00 -0.43 0.00 0.00 46.19 45.25 2nti s LEU 89 CO 0.31 -0.00 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.64 2nti s ILE 90 N 0.53 2.63 -0.19 6.68 1.01 -0.25 0.56 121.20 132.18 2nti s ILE 90 Ca -0.07 -1.08 -0.20 0.00 0.00 0.00 0.00 60.65 59.31 2nti s ILE 90 Cb -0.11 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 2nti s ILE 90 CO 0.00 0.24 0.57 -0.76 0.00 0.00 0.00 174.94 174.99 2nti s LEU 91 N 1.29 4.16 0.10 2.97 1.02 0.53 -1.54 118.68 127.20 2nti s LEU 91 Ca 0.00 0.76 0.02 0.00 0.02 0.00 0.00 54.13 54.94 2nti s LEU 91 Cb -0.16 -2.79 -0.04 0.00 0.02 0.00 0.00 46.19 43.21 2nti s LEU 91 CO -0.06 -0.21 -0.07 -0.94 0.02 0.00 0.00 176.35 175.09 2nti s SER 92 N 1.13 1.23 0.03 2.29 1.04 -0.36 -0.80 113.70 118.26 2nti s SER 92 Ca 0.26 -0.94 -0.01 0.00 0.48 0.00 0.00 55.95 55.74 2nti s SER 92 Cb -0.16 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2nti s SER 92 CO 0.10 -0.40 -0.02 -0.94 0.98 0.00 0.00 173.24 172.96 2nti s SER 93 N -2.86 0.34 0.00 7.02 1.04 -0.63 -0.29 113.70 118.32 2nti s SER 93 Ca 0.10 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2nti s SER 93 Cb 0.03 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.30 2nti s SER 93 CO -0.03 -0.44 0.00 0.59 0.98 0.00 0.00 173.24 174.34 2nti n ASN 94 N 0.92 0.00 -0.56 7.02 3.02 -0.61 -3.57 115.26 121.49 2nti n ASN 94 Ca -0.19 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.42 2nti n ASN 94 Cb 0.58 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.84 2nti n ASN 94 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2nti n GLU 95 N 0.00 1.38 0.00 3.52 0.28 -1.26 -4.46 120.64 120.10 2nti n GLU 95 Ca 0.00 -1.51 0.00 0.00 -0.16 0.00 0.00 57.16 55.49 2nti n GLU 95 Cb 0.00 -1.26 0.00 0.00 1.43 0.00 0.00 31.44 31.61 2nti n GLU 95 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2nti n SER 96 N 0.68 3.79 -3.99 -1.84 3.41 -1.26 -4.94 113.62 109.46 2nti n SER 96 Ca 0.09 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.55 2nti n SER 96 Cb 0.35 0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 64.78 2nti n SER 96 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2nti s LYS 97 N -1.60 0.48 -0.19 4.33 -0.14 -1.26 -1.64 119.74 119.71 2nti s LYS 97 Ca 0.00 -0.34 -0.12 0.00 -1.36 0.00 0.00 55.97 54.15 2nti s LYS 97 Cb 0.00 -0.41 -0.05 0.00 -1.68 0.00 0.00 37.83 35.69 2nti s LYS 97 CO 0.00 0.10 0.23 -1.17 -0.76 0.00 0.00 175.35 173.75 2nti s LEU 98 N -0.50 4.20 -0.12 3.17 2.96 0.78 -1.57 118.68 127.62 2nti s LEU 98 Ca -0.01 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.26 2nti s LEU 98 Cb -0.04 -2.25 -0.02 0.00 0.50 0.00 0.00 46.19 44.38 2nti s LEU 98 CO -0.00 0.10 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.12 2nti s THR 99 N 0.60 3.11 -0.25 3.68 2.01 0.61 -0.17 115.64 125.22 2nti s THR 99 Ca 0.12 -0.65 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 2nti s THR 99 Cb -0.12 -2.29 0.04 0.00 0.01 0.00 0.00 72.50 70.13 2nti s THR 99 CO 0.02 0.53 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.66 2nti s LEU 100 N 0.16 3.28 -0.29 4.42 1.43 0.17 -1.22 118.68 126.63 2nti s LEU 100 Ca -0.07 -1.02 -0.03 0.00 -1.03 0.00 0.00 54.13 51.98 2nti s LEU 100 Cb -0.15 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.47 2nti s LEU 100 CO 0.05 -0.15 0.00 -0.89 0.23 0.00 0.00 176.35 175.59 2nti s THR 101 N 1.27 3.15 -0.00 5.49 2.01 -0.59 -0.83 115.64 126.13 2nti s THR 101 Ca -0.02 -1.18 -0.24 0.00 0.31 0.00 0.00 61.69 60.56 2nti s THR 101 Cb -0.18 -2.73 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 2nti s THR 101 CO -0.05 -0.01 0.72 -0.36 -0.69 0.00 0.00 174.62 174.23 2nti s PHE 102 N 1.32 3.67 -0.13 4.92 0.40 0.55 -1.09 117.98 127.62 2nti s PHE 102 Ca -0.03 1.35 -0.01 0.00 -0.60 0.00 0.00 56.93 57.65 2nti s PHE 102 Cb -0.19 -2.78 0.03 0.00 0.51 0.00 0.00 43.02 40.60 2nti s PHE 102 CO -0.01 0.22 -0.05 0.34 0.70 0.00 0.00 175.22 176.42 2nti s ASP 103 N 0.22 2.34 0.00 1.36 3.68 -0.47 -1.16 116.67 122.63 2nti s ASP 103 Ca 0.37 -0.41 0.00 0.00 2.13 0.00 0.00 52.55 54.64 2nti s ASP 103 Cb -0.19 -0.80 0.00 0.00 -1.45 0.00 0.00 42.92 40.48 2nti s ASP 103 CO 0.20 -0.16 0.00 0.61 0.13 0.00 0.00 175.17 175.95 2nti n GLY 104 N 4.96 1.16 0.23 2.66 0.00 -1.26 -1.04 105.19 111.90 2nti n GLY 104 Ca -0.11 0.22 0.10 0.00 0.00 0.00 0.00 46.02 46.23 2nti n GLY 104 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2nti h GLU 105 N 0.00 0.00 -3.06 1.61 4.11 -1.96 -3.45 114.58 111.83 2nti h GLU 105 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.48 2nti h GLU 105 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 2nti h GLU 105 CO 0.00 0.21 0.19 -0.59 0.07 0.00 0.00 179.01 178.90 2nti s PHE 106 N -3.75 -0.20 -0.15 2.06 -0.71 -1.26 -5.16 117.98 108.81 2nti s PHE 106 Ca -0.00 -0.22 -0.17 0.00 -1.04 0.00 0.00 56.93 55.50 2nti s PHE 106 Cb 0.11 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.52 2nti s PHE 106 CO 0.63 -1.16 0.44 0.99 -1.34 0.00 0.00 175.22 174.79 2nti s THR 107 N -3.90 5.20 -0.02 -4.49 2.01 -1.26 -4.44 115.64 108.73 2nti s THR 107 Ca 0.10 0.86 0.02 0.00 0.31 0.00 0.00 61.69 62.99 2nti s THR 107 Cb -0.05 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.68 2nti s THR 107 CO 0.04 0.30 -0.09 -0.13 -0.69 0.00 0.00 174.62 174.05 2nti s ARG 108 N 0.84 0.92 -0.04 4.92 0.52 -0.31 -5.02 118.95 120.78 2nti s ARG 108 Ca 0.23 -0.30 0.02 0.00 -0.52 0.00 0.00 55.73 55.16 2nti s ARG 108 Cb -0.15 -0.87 0.02 0.00 0.52 0.00 0.00 34.95 34.47 2nti s ARG 108 CO 0.09 0.12 -0.07 0.45 0.02 0.00 0.00 175.30 175.91 2nti s SER 109 N 0.15 1.14 -0.05 0.23 0.15 -1.26 -0.33 113.70 113.73 2nti s SER 109 Ca -0.02 -0.17 0.06 0.00 0.70 0.00 0.00 55.95 56.51 2nti s SER 109 Cb -0.08 -0.50 -0.02 0.00 -1.71 0.00 0.00 66.02 63.71 2nti s SER 109 CO 0.00 -0.01 -0.23 -0.36 1.20 0.00 0.00 173.24 173.85 2nti s PHE 110 N 0.70 2.48 -0.09 3.44 0.40 -0.01 -4.98 117.98 119.91 2nti s PHE 110 Ca -0.11 -0.52 0.03 0.00 -0.60 0.00 0.00 56.93 55.73 2nti s PHE 110 Cb -0.14 -1.59 -0.01 0.00 0.51 0.00 0.00 43.02 41.79 2nti s PHE 110 CO 0.01 -0.09 -0.18 -1.21 0.70 0.00 0.00 175.22 174.46 2nti s GLU 111 N -0.38 2.94 -0.11 0.44 2.02 -1.26 -0.65 118.70 121.70 2nti s GLU 111 Ca 0.03 -0.76 0.03 0.00 0.02 0.00 0.00 54.97 54.28 2nti s GLU 111 Cb -0.12 -2.42 0.01 0.00 0.10 0.00 0.00 34.13 31.70 2nti s GLU 111 CO 0.02 0.35 -0.19 -0.51 0.02 0.00 0.00 175.26 174.94 2nti s LEU 112 N -0.03 1.93 0.33 1.80 1.43 0.76 -4.98 118.68 119.91 2nti s LEU 112 Ca -0.05 -0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 2nti s LEU 112 Cb -0.14 -1.25 -0.12 0.00 0.03 0.00 0.00 46.19 44.70 2nti s LEU 112 CO 0.04 0.07 1.44 -2.65 0.23 0.00 0.00 176.35 175.49 2nti n PRO 113 N 3.96 2.42 -1.87 1.29 -0.02 -1.26 -0.15 135.00 139.37 2nti n PRO 113 Ca -0.20 0.85 -0.40 0.00 -2.02 0.00 0.00 63.50 61.73 2nti n PRO 113 Cb 0.52 -2.54 0.01 0.00 -0.02 0.00 0.00 33.50 31.46 2nti n PRO 113 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nti s LEU 114 N -1.04 4.21 0.29 2.45 1.43 -0.65 -4.77 118.68 120.60 2nti s LEU 114 Ca 0.59 2.89 0.11 0.00 -1.03 0.00 0.00 54.13 56.69 2nti s LEU 114 Cb -0.53 -3.84 -0.05 0.00 0.03 0.00 0.00 46.19 41.80 2nti s LEU 114 CO 0.58 -0.99 -0.14 0.27 0.23 0.00 0.00 176.35 176.30 2nti s ILE 115 N -1.19 2.59 -0.06 -0.59 -4.36 -1.00 -5.00 121.20 111.59 2nti s ILE 115 Ca 0.57 -2.27 -0.21 0.00 -0.26 0.00 0.00 60.65 58.48 2nti s ILE 115 Cb -0.43 -2.47 -0.05 0.00 1.25 0.00 0.00 42.46 40.76 2nti s ILE 115 CO 0.57 -0.35 0.59 -1.58 0.24 0.00 0.00 174.94 174.41 2nti s GLN 116 N -3.57 4.35 0.07 0.37 0.74 -1.26 -3.62 119.66 116.75 2nti s GLN 116 Ca 0.31 0.69 0.05 0.00 0.05 0.00 0.00 55.36 56.46 2nti s GLN 116 Cb -0.04 -3.40 -0.03 0.00 1.10 0.00 0.00 33.01 30.65 2nti s GLN 116 CO 0.16 0.22 -0.14 0.08 -0.55 0.00 0.00 175.29 175.06 2nti s VAL 117 N 0.32 1.13 0.86 1.34 1.01 -1.26 -4.99 120.40 118.80 2nti s VAL 117 Ca 0.31 -1.31 -0.12 0.00 0.00 0.00 0.00 61.98 60.87 2nti s VAL 117 Cb -0.17 -1.08 0.10 0.00 0.00 0.00 0.00 36.38 35.23 2nti s VAL 117 CO 0.15 -0.22 1.09 -0.62 0.00 0.00 0.00 175.10 175.51 2nti n GLU 118 N 1.29 -0.10 -3.25 2.72 4.71 -1.26 -4.97 120.64 119.77 2nti n GLU 118 Ca -0.21 0.05 -0.40 0.00 -0.01 0.00 0.00 57.16 56.58 2nti n GLU 118 Cb 0.54 -2.35 -0.08 0.00 -1.01 0.00 0.00 31.44 28.55 2nti n GLU 118 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2nti s SER 119 N -2.28 6.38 -0.24 1.62 0.01 -1.26 -4.81 113.70 113.12 2nti s SER 119 Ca 0.69 0.36 -0.11 0.00 1.31 0.00 0.00 55.95 58.21 2nti s SER 119 Cb -0.26 -2.27 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 2nti s SER 119 CO 0.55 -0.32 0.16 0.28 0.41 0.00 0.00 173.24 174.32 2nti s THR 120 N 2.31 5.36 0.17 1.44 -1.32 -1.26 -5.08 115.64 117.25 2nti s THR 120 Ca 0.20 0.19 -0.30 0.00 -1.21 0.00 0.00 61.69 60.56 2nti s THR 120 Cb -0.16 -3.50 -0.08 0.00 -1.51 0.00 0.00 72.50 67.25 2nti s THR 120 CO 0.10 0.34 1.29 -1.10 -2.21 0.00 0.00 174.62 173.05 2nti s GLN 121 N 1.09 4.40 0.75 7.08 -1.52 -1.26 -4.85 119.66 125.35 2nti s GLN 121 Ca 0.08 2.00 -0.12 0.00 -1.95 0.00 0.00 55.36 55.37 2nti s GLN 121 Cb -0.14 -3.22 0.05 0.00 -0.22 0.00 0.00 33.01 29.48 2nti s GLN 121 CO 0.05 -0.25 1.11 -1.25 -0.25 0.00 0.00 175.29 174.70 2nti s PRO 122 N 0.11 2.28 -0.08 2.91 0.04 -1.26 -4.86 135.00 134.14 2nti s PRO 122 Ca 0.57 1.29 -0.38 0.00 0.04 0.00 0.00 61.00 62.53 2nti s PRO 122 Cb -0.35 -1.89 -0.16 0.00 0.04 0.00 0.00 34.50 32.14 2nti s PRO 122 CO 0.36 -1.64 1.54 -2.30 0.04 0.00 0.00 177.00 175.00 2nti n PRO 123 N -3.26 1.21 0.00 0.56 -0.02 -1.26 -4.93 135.00 127.30 2nti n PRO 123 Ca 0.10 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2nti n PRO 123 Cb 0.52 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2nti n PRO 123 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2nti n SER 124 N 3.92 0.00 -4.60 2.55 3.41 -1.26 -4.97 113.62 112.68 2nti n SER 124 Ca 0.22 0.10 -0.27 0.00 -0.26 0.00 0.00 58.87 58.66 2nti n SER 124 Cb 0.17 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.24 2nti n SER 124 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2nti s VAL 125 N -0.20 2.12 0.25 -3.33 -7.23 -1.26 -5.09 120.40 105.67 2nti s VAL 125 Ca 0.00 -0.22 -0.15 0.00 -1.81 0.00 0.00 61.98 59.80 2nti s VAL 125 Cb 0.00 -2.90 -0.08 0.00 0.56 0.00 0.00 36.38 33.96 2nti s VAL 125 CO 0.00 0.00 0.67 0.20 -0.31 0.00 0.00 175.10 175.66 2nti s ASN 126 N -4.70 6.82 0.35 4.85 -0.87 -1.26 -5.11 114.94 115.01 2nti s ASN 126 Ca 0.66 1.21 0.07 0.00 -1.57 0.00 0.00 52.86 53.24 2nti s ASN 126 Cb -0.07 -2.34 -0.02 0.00 -0.02 0.00 0.00 41.25 38.80 2nti s ASN 126 CO 0.48 -0.08 0.38 -0.76 -2.57 0.00 0.00 177.10 174.55 2nti s LEU 127 N -2.57 3.70 -0.14 0.60 1.43 -1.26 -5.12 118.68 115.32 2nti s LEU 127 Ca 0.48 -0.42 -0.04 0.00 -1.03 0.00 0.00 54.13 53.12 2nti s LEU 127 Cb -0.13 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 2nti s LEU 127 CO 0.19 -0.44 -0.00 -1.83 0.23 0.00 0.00 176.35 174.50 2nti s GLU 128 N -4.09 3.55 -0.12 1.70 -1.05 -1.26 -5.10 118.70 112.32 2nti s GLU 128 Ca 0.44 -0.45 0.01 0.00 -0.15 0.00 0.00 54.97 54.82 2nti s GLU 128 Cb -0.07 -2.95 0.02 0.00 -0.44 0.00 0.00 34.13 30.69 2nti s GLU 128 CO 0.29 0.38 -0.13 -0.06 0.95 0.00 0.00 175.26 176.69 2nti s PHE 129 N 0.01 1.91 0.29 4.83 0.40 -1.26 -5.01 117.98 119.14 2nti s PHE 129 Ca 0.02 -0.97 -0.00 0.00 -0.60 0.00 0.00 56.93 55.38 2nti s PHE 129 Cb -0.13 -1.43 0.44 0.00 0.51 0.00 0.00 43.02 42.41 2nti s PHE 129 CO 0.02 -0.55 1.83 -1.35 0.70 0.00 0.00 175.22 175.87 2nti h PRO 130 N 7.81 0.76 -5.82 0.24 0.11 -1.97 -3.44 132.00 129.69 2nti h PRO 130 Ca -0.34 -0.16 -0.62 0.00 0.11 0.00 0.00 66.00 65.00 2nti h PRO 130 Cb 1.15 -0.11 -0.31 0.00 0.11 0.00 0.00 31.00 31.84 2nti h PRO 130 CO 0.49 0.71 -0.86 0.12 -0.21 0.00 0.00 178.00 178.25 2nti s PHE 131 N -5.13 1.97 -0.03 0.65 5.36 -1.18 -2.15 117.98 117.47 2nti s PHE 131 Ca -0.09 -0.49 0.01 0.00 -0.96 0.00 0.00 56.93 55.40 2nti s PHE 131 Cb 0.15 -1.29 0.02 0.00 -0.34 0.00 0.00 43.02 41.56 2nti s PHE 131 CO 0.79 -0.12 -0.03 0.21 -1.46 0.00 0.00 175.22 174.61 2nti s LYS 132 N -0.25 0.61 0.11 10.12 2.20 -0.76 -2.98 119.74 128.79 2nti s LYS 132 Ca 0.02 -0.07 0.08 0.00 -0.36 0.00 0.00 55.97 55.64 2nti s LYS 132 Cb -0.11 -0.66 -0.04 0.00 -1.51 0.00 0.00 37.83 35.52 2nti s LYS 132 CO 0.01 -0.06 -0.21 0.00 -0.36 0.00 0.00 175.35 174.74 2nti s ALA 133 N 0.74 1.85 -0.06 3.13 0.00 0.50 -1.46 121.76 126.47 2nti s ALA 133 Ca -0.09 -1.29 0.05 0.00 0.00 0.00 0.00 51.96 50.63 2nti s ALA 133 Cb -0.12 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 22.75 2nti s ALA 133 CO -0.00 0.35 -0.20 -1.14 0.00 0.00 0.00 175.76 174.76 2nti s GLN 134 N -2.03 2.17 0.21 0.00 0.74 0.29 -0.20 119.66 120.85 2nti s GLN 134 Ca 0.08 -0.72 -0.15 0.00 0.05 0.00 0.00 55.36 54.62 2nti s GLN 134 Cb -0.09 -1.82 0.01 0.00 1.10 0.00 0.00 33.01 32.20 2nti s GLN 134 CO 0.05 0.27 0.48 -0.48 -0.55 0.00 0.00 175.29 175.05 2nti s LEU 135 N 0.04 0.30 0.13 3.68 2.34 -0.90 -0.37 118.68 123.90 2nti s LEU 135 Ca -0.06 -0.72 -0.30 0.00 0.06 0.00 0.00 54.13 53.11 2nti s LEU 135 Cb -0.13 1.88 -0.07 0.00 -0.56 0.00 0.00 46.19 47.31 2nti s LEU 135 CO 0.04 -1.08 1.21 -0.76 -1.06 0.00 0.00 176.35 174.70 2nti s LEU 136 N -2.94 4.41 0.38 1.48 1.43 -1.26 -1.19 118.68 120.98 2nti s LEU 136 Ca 0.15 2.16 0.10 0.00 -1.03 0.00 0.00 54.13 55.51 2nti s LEU 136 Cb -0.00 -3.59 0.86 0.00 0.03 0.00 0.00 46.19 43.48 2nti s LEU 136 CO 0.03 -0.43 1.92 0.74 0.23 0.00 0.00 176.35 178.84 2nti h THR 137 N 4.08 0.89 -0.71 5.49 2.02 -1.35 -1.24 112.91 122.10 2nti h THR 137 Ca -0.43 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 2nti h THR 137 Cb 1.21 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 2nti h THR 137 CO 0.78 0.12 0.28 0.40 0.37 0.00 0.00 175.52 177.46 2nti h ILE 138 N 0.63 1.24 -0.36 3.11 5.03 -1.85 0.11 117.51 125.43 2nti h ILE 138 Ca 0.37 -0.77 -0.04 0.00 -0.12 0.00 0.00 64.86 64.30 2nti h ILE 138 Cb 0.58 0.40 -0.01 0.00 -3.03 0.00 0.00 36.82 34.76 2nti h ILE 138 CO -0.14 0.31 0.08 0.74 -0.68 0.00 0.00 178.15 178.45 2nti h THR 139 N 1.03 1.23 -0.05 -0.27 2.02 -1.62 -1.39 112.91 113.86 2nti h THR 139 Ca 0.24 -0.80 -0.00 0.00 0.77 0.00 0.00 66.41 66.62 2nti h THR 139 Cb 0.20 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2nti h THR 139 CO -0.02 0.27 0.02 0.15 0.37 0.00 0.00 175.52 176.31 2nti h PHE 140 N 0.44 0.07 -0.58 3.16 3.57 -1.13 -2.69 116.94 119.79 2nti h PHE 140 Ca 0.11 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2nti h PHE 140 Cb 0.33 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 2nti h PHE 140 CO 0.02 0.19 0.33 0.00 -2.23 0.00 0.00 178.31 176.62 2nti h ALA 141 N 0.88 0.74 0.13 2.41 0.00 -0.71 -1.21 119.26 121.50 2nti h ALA 141 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2nti h ALA 141 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2nti h ALA 141 CO -0.00 0.24 -0.13 -0.44 0.00 0.00 0.00 179.25 178.91 2nti h ASP 142 N 0.78 -0.35 -0.57 0.00 3.45 -1.24 -1.05 116.42 117.44 2nti h ASP 142 Ca 0.20 0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.68 2nti h ASP 142 Cb 0.01 0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 2nti h ASP 142 CO -0.04 -0.20 0.27 -0.29 -1.57 0.00 0.00 179.24 177.41 2nti h ILE 143 N -0.29 1.21 -0.31 0.35 6.09 -1.29 -2.30 117.51 120.97 2nti h ILE 143 Ca 0.00 -0.58 -0.12 0.00 -1.37 0.00 0.00 64.86 62.78 2nti h ILE 143 Cb 0.28 0.54 -0.01 0.00 0.47 0.00 0.00 36.82 38.10 2nti h ILE 143 CO -0.03 0.24 -0.32 0.40 -3.07 0.00 0.00 178.15 175.36 2nti h ILE 144 N 0.77 1.28 -0.19 2.19 1.08 -1.14 -1.66 117.51 119.84 2nti h ILE 144 Ca 0.19 -1.45 -0.00 0.00 -0.39 0.00 0.00 64.86 63.21 2nti h ILE 144 Cb 0.12 1.39 -0.01 0.00 -3.07 0.00 0.00 36.82 35.26 2nti h ILE 144 CO -0.02 0.47 0.11 0.44 -0.69 0.00 0.00 178.15 178.46 2nti h ASP 145 N 0.56 0.22 -0.34 1.72 3.45 -1.00 -0.29 116.42 120.75 2nti h ASP 145 Ca 0.06 -0.05 0.01 0.00 0.43 0.00 0.00 57.03 57.48 2nti h ASP 145 Cb 0.82 -0.06 -0.02 0.00 -0.56 0.00 0.00 39.33 39.52 2nti h ASP 145 CO 0.07 0.21 0.21 -0.33 -1.57 0.00 0.00 179.24 177.83 2nti h GLU 146 N 0.22 0.42 0.00 3.56 5.08 -1.27 -2.92 114.58 119.66 2nti h GLU 146 Ca 0.07 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 2nti h GLU 146 Cb 0.03 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2nti h GLU 146 CO -0.01 0.28 -0.39 -0.07 -1.00 0.00 0.00 179.01 177.82 2nti h LEU 147 N 0.43 0.00 -2.37 1.33 3.38 -1.25 -3.33 115.31 113.51 2nti h LEU 147 Ca 0.13 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2nti h LEU 147 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2nti h LEU 147 CO -0.04 0.39 0.09 0.77 0.09 0.00 0.00 178.44 179.73 2nti h SER 148 N 0.00 0.00 0.35 -0.43 4.64 -0.84 -0.48 113.55 116.79 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 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2nti h SER 148 CO 0.05 0.00 -0.40 0.47 -0.87 0.00 0.00 176.83 176.08 2nti n ASP 149 N -3.82 0.80 0.00 4.97 8.00 -1.25 -4.23 116.55 121.02 2nti n ASP 149 Ca -0.01 -0.61 0.11 0.00 0.71 0.00 0.00 54.79 54.99 2nti n ASP 149 Cb 0.18 0.23 0.13 0.00 -0.02 0.00 0.00 41.12 41.64 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 -1.06 0.64 0.00 0.64 4.77 -0.19 -5.01 117.00 116.79 2nti n LEU 150 Ca 0.09 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2nti n LEU 150 Cb 0.34 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2nti n LEU 150 CO 0.31 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2nti n GLY 151 N 1.48 -0.90 0.00 -0.72 0.00 -1.25 -4.68 105.19 99.12 2nti n GLY 151 Ca 0.05 -1.04 0.07 0.00 0.00 0.00 0.00 46.02 45.10 2nti n GLY 151 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nti n GLU 152 N -0.14 0.99 -4.79 1.61 1.02 -1.26 -4.84 120.64 113.22 2nti n GLU 152 Ca 0.00 -0.10 -0.33 0.00 -0.02 0.00 0.00 57.16 56.72 2nti n GLU 152 Cb 0.00 -1.31 -0.15 0.00 -0.02 0.00 0.00 31.44 29.96 2nti n GLU 152 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2nti s VAL 153 N -2.85 2.76 -0.25 2.62 1.01 -1.26 -0.76 120.40 121.67 2nti s VAL 153 Ca -0.02 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 2nti s VAL 153 Cb 0.10 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2nti s VAL 153 CO 0.62 0.53 0.17 -0.22 0.00 0.00 0.00 175.10 176.20 2nti s LEU 154 N 0.48 4.07 -0.17 3.92 2.96 0.07 -4.58 118.68 125.42 2nti s LEU 154 Ca -0.11 0.06 -0.11 0.00 -0.22 0.00 0.00 54.13 53.75 2nti s LEU 154 Cb -0.16 -2.11 -0.05 0.00 0.50 0.00 0.00 46.19 44.37 2nti s LEU 154 CO 0.05 0.02 0.20 0.20 -1.32 0.00 0.00 176.35 175.51 2nti s ASN 155 N 1.31 6.33 -0.05 3.68 0.01 0.86 -0.90 114.94 126.19 2nti s ASN 155 Ca 0.07 0.39 0.02 0.00 -0.71 0.00 0.00 52.86 52.63 2nti s ASN 155 Cb -0.14 -2.13 0.01 0.00 0.41 0.00 0.00 41.25 39.40 2nti s ASN 155 CO 0.07 0.18 -0.11 -0.63 -1.51 0.00 0.00 177.10 175.09 2nti s ILE 156 N 0.22 1.00 0.04 0.60 1.01 -0.05 -0.23 121.20 123.79 2nti s ILE 156 Ca 0.13 -0.42 -0.11 0.00 0.00 0.00 0.00 60.65 60.24 2nti s ILE 156 Cb -0.12 -0.91 0.01 0.00 0.01 0.00 0.00 42.46 41.45 2nti s ILE 156 CO 0.01 0.32 0.23 -1.38 0.00 0.00 0.00 174.94 174.12 2nti s HIS 157 N 0.53 0.01 -0.05 3.97 -3.43 -1.03 -0.73 115.29 114.56 2nti s HIS 157 Ca -0.11 -0.21 0.03 0.00 -0.80 0.00 0.00 55.06 53.97 2nti s HIS 157 Cb -0.14 0.01 -0.03 0.00 -1.43 0.00 0.00 32.58 31.00 2nti s HIS 157 CO 0.02 -0.46 -0.12 -1.54 -2.00 0.00 0.00 174.74 170.64 2nti s SER 158 N -2.12 4.23 -0.10 7.38 1.04 0.10 -1.04 113.70 123.19 2nti s SER 158 Ca -0.04 -0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.20 2nti s SER 158 Cb -0.01 -0.94 0.05 0.00 0.10 0.00 0.00 66.02 65.22 2nti s SER 158 CO -0.04 0.34 0.12 -0.75 0.98 0.00 0.00 173.24 173.89 2nti s LYS 159 N -0.85 0.02 -1.32 4.02 2.47 -0.44 -3.73 119.74 119.92 2nti s LYS 159 Ca 0.12 0.31 -0.15 0.00 -1.56 0.00 0.00 55.97 54.69 2nti s LYS 159 Cb -0.11 -0.83 0.01 0.00 -1.46 0.00 0.00 37.83 35.44 2nti s LYS 159 CO 0.02 -0.44 0.50 0.39 0.16 0.00 0.00 175.35 175.97 2nti n GLU 160 N 5.31 -1.44 -0.98 4.03 1.02 -1.26 -1.32 120.64 125.99 2nti n GLU 160 Ca -0.05 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 2nti n GLU 160 Cb 0.50 -3.66 0.00 0.00 -0.02 0.00 0.00 31.44 28.26 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 -2.65 -4.53 -4.90 1.62 4.13 -1.26 -5.00 115.26 102.66 2nti n ASN 161 Ca -0.21 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.77 2nti n ASN 161 Cb 0.63 -2.28 -0.04 0.00 -1.54 0.00 0.00 39.78 36.55 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 -1.18 3.32 -0.10 3.52 1.02 -0.44 -4.73 119.74 121.15 2nti s LYS 162 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2nti s LYS 162 Cb 0.00 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 34.35 2nti s LYS 162 CO 0.00 0.56 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.71 2nti s LEU 163 N -2.79 2.87 -0.13 3.17 2.96 0.97 -1.33 118.68 124.40 2nti s LEU 163 Ca 0.34 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 2nti s LEU 163 Cb -0.12 -1.63 0.01 0.00 0.50 0.00 0.00 46.19 44.95 2nti s LEU 163 CO 0.27 0.24 -0.21 -0.31 -1.32 0.00 0.00 176.35 175.02 2nti s TYR 164 N -0.08 2.51 -0.19 5.38 2.02 -0.20 0.69 117.35 127.48 2nti s TYR 164 Ca -0.01 -1.23 -0.08 0.00 -0.37 0.00 0.00 57.07 55.39 2nti s TYR 164 Cb -0.14 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 2nti s TYR 164 CO 0.03 -0.56 0.07 -0.06 -1.57 0.00 0.00 175.55 173.46 2nti s PHE 165 N 0.79 3.26 -0.01 2.71 2.99 -0.70 -2.48 117.98 124.54 2nti s PHE 165 Ca -0.08 0.08 0.02 0.00 0.00 0.00 0.00 56.93 56.95 2nti s PHE 165 Cb -0.16 -2.10 -0.00 0.00 0.00 0.00 0.00 43.02 40.76 2nti s PHE 165 CO -0.01 0.14 -0.06 -1.21 -0.00 0.00 0.00 175.22 174.09 2nti s GLU 166 N 0.45 0.54 -0.24 0.44 2.02 0.68 -1.21 118.70 121.38 2nti s GLU 166 Ca 0.04 -0.21 -0.00 0.00 0.02 0.00 0.00 54.97 54.82 2nti s GLU 166 Cb -0.12 -0.52 0.07 0.00 0.10 0.00 0.00 34.13 33.65 2nti s GLU 166 CO 0.00 0.11 -0.01 0.08 0.02 0.00 0.00 175.26 175.47 2nti s VAL 167 N -0.04 1.28 -0.94 2.63 1.01 -0.35 -0.10 120.40 123.90 2nti s VAL 167 Ca 0.01 -1.17 -0.20 0.00 0.00 0.00 0.00 61.98 60.61 2nti s VAL 167 Cb -0.04 -1.67 0.10 0.00 0.00 0.00 0.00 36.38 34.77 2nti s VAL 167 CO -0.00 -0.23 1.22 -0.63 0.00 0.00 0.00 175.10 175.46 2nti s ILE 168 N 1.49 4.44 0.00 2.22 1.09 -1.26 -1.41 121.20 127.77 2nti s ILE 168 Ca -0.02 -1.22 0.00 0.00 -1.10 0.00 0.00 60.65 58.31 2nti s ILE 168 Cb -0.18 -4.86 0.00 0.00 -1.06 0.00 0.00 42.46 36.36 2nti s ILE 168 CO -0.09 -1.64 0.00 0.61 -0.10 0.00 0.00 174.94 173.72 2nti n GLY 169 N 5.90 0.44 3.58 6.18 0.00 -0.41 -5.00 105.19 115.88 2nti n GLY 169 Ca 0.25 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 2nti n GLY 169 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2nti s ASP 170 N -1.00 6.16 -1.46 1.61 2.15 -1.26 -3.50 116.67 119.37 2nti s ASP 170 Ca 0.00 0.27 -0.08 0.00 0.43 0.00 0.00 52.55 53.17 2nti s ASP 170 Cb 0.00 -2.55 0.03 0.00 -0.30 0.00 0.00 42.92 40.10 2nti s ASP 170 CO 0.00 -1.69 0.88 0.18 -0.17 0.00 0.00 175.17 174.38 2nti n LEU 171 N 9.47 -2.85 -3.53 -1.34 4.77 -1.26 -4.96 117.00 117.30 2nti n LEU 171 Ca 0.12 -0.47 -0.10 0.00 -0.03 0.00 0.00 56.01 55.53 2nti n LEU 171 Cb 0.49 -2.87 -0.03 0.00 -2.33 0.00 0.00 43.42 38.68 2nti n LEU 171 CO 0.71 0.43 0.72 -0.55 -1.33 0.00 0.00 177.39 177.37 2nti s SER 172 N -3.04 -0.37 -0.09 -1.43 0.15 -1.23 -5.17 113.70 102.52 2nti s SER 172 Ca 0.48 0.19 -0.04 0.00 0.70 0.00 0.00 55.95 57.28 2nti s SER 172 Cb -0.22 0.35 0.05 0.00 -1.71 0.00 0.00 66.02 64.49 2nti s SER 172 CO 0.59 -0.50 0.19 -0.89 1.20 0.00 0.00 173.24 173.83 2nti s THR 173 N -2.25 -0.18 -0.11 6.45 2.01 -1.26 -1.29 115.64 119.01 2nti s THR 173 Ca 0.02 0.25 -0.03 0.00 0.31 0.00 0.00 61.69 62.24 2nti s THR 173 Cb -0.01 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.15 2nti s THR 173 CO -0.04 0.11 0.00 0.00 -0.69 0.00 0.00 174.62 174.00 2nti s ALA 174 N 1.79 3.26 -0.06 7.40 0.00 -0.50 -4.98 121.76 128.66 2nti s ALA 174 Ca -0.03 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 51.07 2nti s ALA 174 Cb -0.12 -1.55 0.01 0.00 0.00 0.00 0.00 23.12 21.47 2nti s ALA 174 CO -0.07 0.48 0.17 0.21 0.00 0.00 0.00 175.76 176.55 2nti s LYS 175 N -0.53 0.23 -0.02 0.00 2.20 -1.26 -1.21 119.74 119.15 2nti s LYS 175 Ca 0.09 0.16 0.02 0.00 -0.36 0.00 0.00 55.97 55.89 2nti s LYS 175 Cb -0.12 0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2nti s LYS 175 CO 0.02 -0.03 -0.08 0.08 -0.36 0.00 0.00 175.35 174.97 2nti s VAL 176 N -0.07 0.74 -0.22 4.02 1.01 -0.35 -4.99 120.40 120.53 2nti s VAL 176 Ca -0.02 -0.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 2nti s VAL 176 Cb -0.02 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 2nti s VAL 176 CO 0.00 0.23 0.09 -0.70 0.00 0.00 0.00 175.10 174.73 2nti s GLU 177 N 0.20 3.88 -0.18 2.72 2.12 -1.26 -1.73 118.70 124.46 2nti s GLU 177 Ca -0.03 -0.38 -0.02 0.00 0.36 0.00 0.00 54.97 54.91 2nti s GLU 177 Cb -0.08 -3.33 -0.01 0.00 0.26 0.00 0.00 34.13 30.97 2nti s GLU 177 CO 0.00 0.06 -0.10 -0.51 -0.54 0.00 0.00 175.26 174.17 2nti s LEU 178 N 0.98 2.70 0.10 2.70 1.02 0.22 -4.97 118.68 121.43 2nti s LEU 178 Ca 0.05 -0.41 -0.05 0.00 0.02 0.00 0.00 54.13 53.74 2nti s LEU 178 Cb -0.14 -1.65 -0.02 0.00 0.02 0.00 0.00 46.19 44.40 2nti s LEU 178 CO 0.03 0.05 0.12 -0.94 0.02 0.00 0.00 176.35 175.63 2nti s SER 179 N 1.03 0.24 0.34 2.29 1.04 -1.26 -0.02 113.70 117.37 2nti s SER 179 Ca -0.00 -0.89 0.12 0.00 0.48 0.00 0.00 55.95 55.65 2nti s SER 179 Cb -0.15 0.31 0.60 0.00 0.10 0.00 0.00 66.02 66.89 2nti s SER 179 CO -0.02 -0.72 1.76 0.71 0.98 0.00 0.00 173.24 175.95 2nti h THR 180 N 2.84 1.32 -0.66 2.02 1.35 -1.85 0.13 112.91 118.07 2nti h THR 180 Ca -0.34 -1.52 -0.05 0.00 -0.55 0.00 0.00 66.41 63.96 2nti h THR 180 Cb 1.19 1.81 -0.03 0.00 -1.73 0.00 0.00 68.15 69.39 2nti h THR 180 CO 0.58 0.44 0.22 0.44 -0.25 0.00 0.00 175.52 176.94 2nti h ASP 181 N 0.02 0.92 -0.57 5.36 3.32 -1.95 -2.04 116.42 121.48 2nti h ASP 181 Ca -0.00 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2nti h ASP 181 Cb 0.79 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2nti h ASP 181 CO 0.06 0.85 0.00 -0.46 -1.72 0.00 0.00 179.24 177.97 2nti n ASN 182 N -4.28 4.07 0.00 6.45 0.23 -1.23 -4.93 115.26 115.57 2nti n ASN 182 Ca 0.05 -2.33 0.00 0.00 -0.53 0.00 0.00 54.58 51.77 2nti n ASN 182 Cb 0.21 -0.52 0.00 0.00 -2.08 0.00 0.00 39.78 37.38 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 1.09 0.19 0.08 4.83 0.00 -0.77 -4.82 105.19 105.79 2nti n GLY 183 Ca 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.19 2nti n GLY 183 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2nti h THR 184 N 0.00 1.62 -3.62 2.61 2.02 -1.66 -3.43 112.91 110.45 2nti h THR 184 Ca 0.00 -3.11 -0.68 0.00 0.77 0.00 0.00 66.41 63.39 2nti h THR 184 Cb 0.46 2.69 -0.18 0.00 -1.74 0.00 0.00 68.15 69.38 2nti h THR 184 CO 0.00 0.88 -0.69 -0.76 0.37 0.00 0.00 175.52 175.32 2nti s LEU 185 N -6.87 3.19 -0.03 2.58 1.43 -0.02 -4.65 118.68 114.30 2nti s LEU 185 Ca 0.01 -0.08 -0.06 0.00 -1.03 0.00 0.00 54.13 52.97 2nti s LEU 185 Cb 0.10 -1.77 -0.29 0.00 0.03 0.00 0.00 46.19 44.27 2nti s LEU 185 CO 0.80 0.32 0.72 -0.07 0.23 0.00 0.00 176.35 178.35 2nti h LEU 186 N 4.86 0.49 -7.56 1.79 3.38 -0.99 -3.34 115.31 113.94 2nti h LEU 186 Ca -0.49 -0.74 -0.11 0.00 0.09 0.00 0.00 57.88 56.63 2nti h LEU 186 Cb 1.17 -0.16 -0.19 0.00 0.09 0.00 0.00 40.66 41.57 2nti h LEU 186 CO 0.53 1.63 -0.29 -0.70 0.09 0.00 0.00 178.44 179.69 2nti s GLU 187 N -2.59 0.70 -0.29 1.13 2.12 -1.06 -4.97 118.70 113.74 2nti s GLU 187 Ca -0.13 -0.33 -0.16 0.00 0.36 0.00 0.00 54.97 54.70 2nti s GLU 187 Cb 0.06 0.30 0.12 0.00 0.26 0.00 0.00 34.13 34.87 2nti s GLU 187 CO 0.85 -0.20 0.87 0.00 -0.54 0.00 0.00 175.26 176.23 2nti s ALA 188 N -1.78 -2.12 -0.26 6.30 0.00 -1.26 -0.54 121.76 122.10 2nti s ALA 188 Ca -0.11 2.28 -0.17 0.00 0.00 0.00 0.00 51.96 53.96 2nti s ALA 188 Cb -0.04 -1.59 0.07 0.00 0.00 0.00 0.00 23.12 21.56 2nti s ALA 188 CO 0.01 -0.36 0.65 -1.12 0.00 0.00 0.00 175.76 174.94 2nti s SER 189 N 1.41 -0.81 0.00 0.00 0.01 -0.54 -4.95 113.70 108.81 2nti s SER 189 Ca -0.09 1.38 0.00 0.00 1.31 0.00 0.00 55.95 58.55 2nti s SER 189 Cb -0.04 1.30 0.00 0.00 0.21 0.00 0.00 66.02 67.49 2nti s SER 189 CO -0.16 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 173.87 2nti n GLY 190 N 3.83 0.32 3.67 3.44 0.00 -1.26 -1.82 105.19 113.36 2nti n GLY 190 Ca -0.19 -1.73 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.02 1.33 -0.69 4.61 0.00 -0.91 -4.61 121.76 120.46 2nti s ALA 191 Ca 0.00 0.42 -0.23 0.00 0.00 0.00 0.00 51.96 52.15 2nti s ALA 191 Cb 0.00 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.80 2nti s ALA 191 CO 0.00 -2.75 1.05 -0.51 0.00 0.00 0.00 175.76 173.55 2nti s ASP 192 N -2.79 6.19 0.33 0.00 1.11 -1.26 -4.66 116.67 115.59 2nti s ASP 192 Ca 0.66 -0.92 0.07 0.00 0.18 0.00 0.00 52.55 52.54 2nti s ASP 192 Cb -0.22 -2.45 -0.07 0.00 1.07 0.00 0.00 42.92 41.25 2nti s ASP 192 CO 0.58 -1.52 -0.04 0.68 1.18 0.00 0.00 175.17 176.06 2nti s VAL 193 N 4.39 1.87 -0.06 -1.27 -7.23 -1.24 -4.91 120.40 111.95 2nti s VAL 193 Ca 0.26 -2.11 -0.08 0.00 -1.81 0.00 0.00 61.98 58.23 2nti s VAL 193 Cb -0.14 -2.67 0.02 0.00 0.56 0.00 0.00 36.38 34.15 2nti s VAL 193 CO 0.10 -0.17 0.22 -0.55 -0.31 0.00 0.00 175.10 174.39 2nti s SER 194 N -3.56 -0.18 0.10 4.85 0.15 -1.26 -0.72 113.70 113.08 2nti s SER 194 Ca 0.32 0.28 -0.26 0.00 0.70 0.00 0.00 55.95 57.00 2nti s SER 194 Cb 0.05 0.39 0.08 0.00 -1.71 0.00 0.00 66.02 64.83 2nti s SER 194 CO 0.15 -0.17 0.93 -0.55 1.20 0.00 0.00 173.24 174.80 2nti s SER 195 N -0.33 -0.24 0.03 5.45 0.15 0.09 -3.98 113.70 114.86 2nti s SER 195 Ca -0.04 -0.27 0.01 0.00 0.70 0.00 0.00 55.95 56.35 2nti s SER 195 Cb -0.03 0.46 -0.02 0.00 -1.71 0.00 0.00 66.02 64.72 2nti s SER 195 CO 0.01 -0.82 -0.05 -0.94 1.20 0.00 0.00 173.24 172.64 2nti s SER 196 N -2.80 0.56 0.03 5.45 1.04 -1.26 -0.87 113.70 115.85 2nti s SER 196 Ca 0.10 -0.45 -0.02 0.00 0.48 0.00 0.00 55.95 56.06 2nti s SER 196 Cb -0.01 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 2nti s SER 196 CO -0.02 -0.20 0.00 -0.31 0.98 0.00 0.00 173.24 173.70 2nti s TYR 197 N -1.20 0.31 -0.06 5.02 1.51 -0.08 -0.65 117.35 122.20 2nti s TYR 197 Ca -0.10 -0.67 -0.29 0.00 -1.01 0.00 0.00 57.07 55.00 2nti s TYR 197 Cb -0.09 -0.23 -0.07 0.00 -0.11 0.00 0.00 41.96 41.46 2nti s TYR 197 CO -0.00 -0.29 1.97 0.20 -1.11 0.00 0.00 175.55 176.32 2nti s GLY 198 N -2.03 1.20 0.27 0.71 0.00 -1.26 -0.75 107.32 105.46 2nti s GLY 198 Ca -0.07 1.07 -0.00 0.00 0.00 0.00 0.00 44.72 45.72 2nti s GLY 198 CO -0.04 3.47 1.75 1.98 0.00 0.00 0.00 173.10 180.26 2nti h MET 199 N 11.64 0.57 -0.54 2.90 4.05 -1.26 -2.62 114.93 129.67 2nti h MET 199 Ca -0.45 -0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.01 2nti h MET 199 Cb 1.22 -0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.83 2nti h MET 199 CO 0.95 0.38 0.20 1.49 0.23 0.00 0.00 176.91 180.16 2nti h GLU 200 N 0.59 0.37 -0.44 0.39 4.81 -1.90 0.65 114.58 119.04 2nti h GLU 200 Ca 0.48 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.61 2nti h GLU 200 Cb 0.71 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 2nti h GLU 200 CO -0.39 0.24 -0.02 1.88 -0.73 0.00 0.00 179.01 180.00 2nti h TYR 201 N 0.38 0.88 -0.27 0.92 -1.99 -1.86 -2.02 116.97 113.00 2nti h TYR 201 Ca 0.26 -0.16 -0.06 0.00 2.00 0.00 0.00 58.73 60.77 2nti h TYR 201 Cb 0.29 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 38.79 2nti h TYR 201 CO -0.16 0.86 -0.06 0.28 -0.00 0.00 0.00 178.16 179.07 2nti h VAL 202 N 0.64 1.28 -0.10 -2.88 2.07 -1.42 -2.98 116.25 112.86 2nti h VAL 202 Ca 0.12 -1.08 0.03 0.00 0.82 0.00 0.00 66.70 66.59 2nti h VAL 202 Cb 0.52 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2nti h VAL 202 CO 0.03 0.34 0.09 0.00 0.02 0.00 0.00 177.57 178.05 2nti h ALA 203 N 0.78 1.89 0.00 1.67 0.00 -0.78 -2.19 119.26 120.63 2nti h ALA 203 Ca 0.07 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2nti h ALA 203 Cb 0.54 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2nti h ALA 203 CO 0.03 -0.14 -0.20 -0.91 0.00 0.00 0.00 179.25 178.03 2nti h ASN 204 N 0.00 0.00 0.82 0.00 2.35 -1.20 -3.01 115.58 114.54 2nti h ASN 204 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2nti h ASN 204 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2nti h ASN 204 CO -0.00 0.20 -0.09 0.35 -1.65 0.00 0.00 177.43 176.24 2nti n THR 205 N -3.79 0.00 0.05 2.81 -2.24 -0.82 -4.09 114.28 106.19 2nti n THR 205 Ca -0.02 -0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.93 2nti n THR 205 Cb 0.30 -0.35 0.67 0.00 -2.10 0.00 0.00 70.33 68.86 2nti n THR 205 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2nti h THR 206 N 0.04 0.79 0.00 4.28 2.02 -1.65 -1.13 112.91 117.26 2nti h THR 206 Ca 0.00 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2nti h THR 206 Cb 0.46 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2nti h THR 206 CO 0.00 0.00 0.00 0.11 0.37 0.00 0.00 175.52 176.00 2nti h LYS 207 N 0.01 0.00 0.00 6.66 1.57 -1.83 -2.64 116.57 120.35 2nti h LYS 207 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2nti h LYS 207 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 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 -2.43 0.11 0.26 3.15 2.81 -0.43 -2.29 117.12 118.31 2nti n MET 208 Ca -0.00 0.48 0.17 0.00 -1.81 0.00 0.00 57.70 56.54 2nti n MET 208 Cb 0.13 -1.77 0.92 0.00 -0.71 0.00 0.00 33.22 31.78 2nti n MET 208 CO 0.00 0.00 0.00 0.07 1.51 0.00 0.00 175.97 177.55 2nti h ARG 209 N 0.00 0.00 -0.01 0.03 0.11 -1.69 0.12 114.38 112.95 2nti h ARG 209 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2nti h ARG 209 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 2nti h ARG 209 CO 0.00 0.00 -0.25 0.54 0.10 0.00 0.00 179.97 180.36 2nti n ARG 210 N -3.60 0.68 0.00 0.08 1.74 -0.97 -3.91 116.66 110.68 2nti n ARG 210 Ca -0.01 -0.37 0.00 0.00 -0.77 0.00 0.00 57.85 56.71 2nti n ARG 210 Cb 0.22 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2nti n ARG 210 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2nti n ALA 211 N -0.84 1.41 -3.17 7.54 0.00 -0.34 -4.33 120.51 120.78 2nti n ALA 211 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.41 2nti n ALA 211 Cb 0.33 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.63 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 -0.71 0.26 -0.16 0.00 0.15 0.29 -4.65 113.70 108.88 2nti s SER 212 Ca 0.00 -0.03 0.13 0.00 0.70 0.00 0.00 55.95 56.76 2nti s SER 212 Cb 0.00 -0.08 -0.24 0.00 -1.71 0.00 0.00 66.02 63.99 2nti s SER 212 CO 0.00 -0.03 0.23 0.47 1.20 0.00 0.00 173.24 175.11 2nti n ASP 213 N 3.45 0.58 -4.08 5.45 8.00 -1.26 -4.53 116.55 124.16 2nti n ASP 213 Ca -0.18 0.12 -0.17 0.00 0.71 0.00 0.00 54.79 55.27 2nti n ASP 213 Cb 0.56 0.44 -0.13 0.00 -0.02 0.00 0.00 41.12 41.97 2nti n ASP 213 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2nti s SER 214 N -5.86 1.22 0.17 -2.24 0.15 -1.26 -1.03 113.70 104.85 2nti s SER 214 Ca -0.12 -0.42 -0.03 0.00 0.70 0.00 0.00 55.95 56.09 2nti s SER 214 Cb 0.07 -0.06 -0.03 0.00 -1.71 0.00 0.00 66.02 64.29 2nti s SER 214 CO 0.80 -0.03 0.15 0.00 1.20 0.00 0.00 173.24 175.36 2nti s MET 215 N -1.08 1.12 -0.01 5.44 0.23 -0.33 -1.20 119.30 123.47 2nti s MET 215 Ca -0.02 -1.46 0.05 0.00 -1.03 0.00 0.00 55.69 53.23 2nti s MET 215 Cb -0.07 0.29 -0.01 0.00 -1.53 0.00 0.00 34.83 33.51 2nti s MET 215 CO 0.01 -0.37 -0.16 -1.21 -2.03 0.00 0.00 175.02 171.26 2nti s GLU 216 N -4.08 1.31 -0.15 3.16 2.02 0.65 -2.11 118.70 119.50 2nti s GLU 216 Ca 0.29 -0.57 0.02 0.00 0.02 0.00 0.00 54.97 54.72 2nti s GLU 216 Cb 0.06 -1.26 0.02 0.00 0.10 0.00 0.00 34.13 33.04 2nti s GLU 216 CO 0.06 0.34 -0.19 -1.17 0.02 0.00 0.00 175.26 174.32 2nti s LEU 217 N -0.37 1.99 -0.02 1.80 0.20 0.73 -0.79 118.68 122.22 2nti s LEU 217 Ca 0.06 -0.57 0.06 0.00 0.69 0.00 0.00 54.13 54.37 2nti s LEU 217 Cb -0.06 -1.36 -0.01 0.00 -0.43 0.00 0.00 46.19 44.32 2nti s LEU 217 CO -0.01 0.03 -0.20 -0.31 -0.29 0.00 0.00 176.35 175.57 2nti s TYR 218 N 1.07 1.83 0.34 5.38 1.51 0.37 -0.37 117.35 127.48 2nti s TYR 218 Ca -0.02 -0.39 -0.18 0.00 -1.01 0.00 0.00 57.07 55.47 2nti s TYR 218 Cb -0.14 -1.19 0.05 0.00 -0.11 0.00 0.00 41.96 40.57 2nti s TYR 218 CO -0.06 -0.07 0.79 -0.59 -1.11 0.00 0.00 175.55 174.51 2nti s PHE 219 N -0.35 0.04 0.21 2.71 -0.71 -1.16 0.11 117.98 118.82 2nti s PHE 219 Ca 0.05 -0.64 -0.21 0.00 -1.04 0.00 0.00 56.93 55.08 2nti s PHE 219 Cb -0.09 0.80 0.07 0.00 -1.21 0.00 0.00 43.02 42.59 2nti s PHE 219 CO 0.00 -1.44 1.00 0.20 -1.34 0.00 0.00 175.22 173.64 2nti s GLY 220 N -3.05 0.14 -0.16 1.99 0.00 -1.26 -3.09 107.32 101.89 2nti s GLY 220 Ca 0.15 -0.38 -0.29 0.00 0.00 0.00 0.00 44.72 44.19 2nti s GLY 220 CO 0.10 2.00 1.37 -0.56 0.00 0.00 0.00 173.10 176.01 2nti s SER 221 N -3.35 6.83 -1.61 1.64 0.01 -1.26 -2.88 113.70 113.09 2nti s SER 221 Ca 0.21 1.77 -0.13 0.00 1.31 0.00 0.00 55.95 59.10 2nti s SER 221 Cb -0.03 -2.54 0.11 0.00 0.21 0.00 0.00 66.02 63.77 2nti s SER 221 CO 0.06 -0.85 0.70 0.00 0.41 0.00 0.00 173.24 173.57 2nti n GLN 222 N 6.83 -3.40 -4.55 12.44 3.00 -1.26 -4.98 117.38 125.47 2nti n GLN 222 Ca 0.15 0.40 -0.28 0.00 -0.01 0.00 0.00 57.00 57.26 2nti n GLN 222 Cb 0.45 -4.97 -0.14 0.00 0.00 0.00 0.00 30.24 25.58 2nti n GLN 222 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2nti s ILE 223 N -3.48 2.06 0.68 5.09 1.01 -1.14 -4.92 121.20 120.50 2nti s ILE 223 Ca 0.54 -1.55 -0.17 0.00 0.00 0.00 0.00 60.65 59.47 2nti s ILE 223 Cb -0.29 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.38 2nti s ILE 223 CO 0.91 0.16 1.26 -2.16 0.00 0.00 0.00 174.94 175.10 2nti s PRO 224 N -1.69 2.39 -0.30 2.79 0.04 -1.26 -4.28 135.00 132.69 2nti s PRO 224 Ca 0.11 1.94 -0.28 0.00 0.04 0.00 0.00 61.00 62.81 2nti s PRO 224 Cb -0.10 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.61 2nti s PRO 224 CO 0.04 -1.69 1.01 -1.17 0.04 0.00 0.00 177.00 175.23 2nti s LEU 225 N -4.67 4.00 -0.26 -3.56 2.96 0.50 -4.39 118.68 113.26 2nti s LEU 225 Ca 0.79 1.05 -0.10 0.00 -0.22 0.00 0.00 54.13 55.65 2nti s LEU 225 Cb -0.34 -3.45 -0.04 0.00 0.50 0.00 0.00 46.19 42.86 2nti s LEU 225 CO 0.41 -0.78 0.15 -0.75 -1.32 0.00 0.00 176.35 174.06 2nti s LYS 226 N 3.41 3.90 -0.32 1.98 2.20 0.30 -0.63 119.74 130.58 2nti s LYS 226 Ca 0.42 -0.35 -0.05 0.00 -0.36 0.00 0.00 55.97 55.64 2nti s LYS 226 Cb -0.13 -3.52 0.04 0.00 -1.51 0.00 0.00 37.83 32.70 2nti s LYS 226 CO 0.13 -0.10 0.06 -0.51 -0.36 0.00 0.00 175.35 174.56 2nti s LEU 227 N 1.49 4.09 -0.29 5.43 1.43 -0.42 -0.48 118.68 129.93 2nti s LEU 227 Ca 0.07 -1.15 -0.10 0.00 -1.03 0.00 0.00 54.13 51.92 2nti s LEU 227 Cb -0.15 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 2nti s LEU 227 CO 0.07 -0.29 0.15 -0.60 0.23 0.00 0.00 176.35 175.91 2nti s ARG 228 N 1.35 3.52 -0.34 1.70 3.52 0.03 -1.32 118.95 127.42 2nti s ARG 228 Ca -0.03 -0.59 -0.16 0.00 -0.13 0.00 0.00 55.73 54.83 2nti s ARG 228 Cb -0.19 -3.55 -0.01 0.00 -1.56 0.00 0.00 34.95 29.64 2nti s ARG 228 CO 0.01 -0.33 0.39 -0.06 -0.81 0.00 0.00 175.30 174.50 2nti s PHE 229 N 1.65 3.20 -0.14 5.12 0.08 0.06 -0.26 117.98 127.70 2nti s PHE 229 Ca 0.06 0.01 -0.29 0.00 0.12 0.00 0.00 56.93 56.82 2nti s PHE 229 Cb -0.16 -2.71 -0.02 0.00 -0.57 0.00 0.00 43.02 39.56 2nti s PHE 229 CO 0.07 -0.45 1.19 0.15 -0.10 0.00 0.00 175.22 176.08 2nti s LYS 230 N 2.08 4.29 0.34 0.44 1.02 -0.34 -1.23 119.74 126.34 2nti s LYS 230 Ca 0.13 1.60 0.07 0.00 0.02 0.00 0.00 55.97 57.79 2nti s LYS 230 Cb -0.16 -3.67 -0.02 0.00 -0.52 0.00 0.00 37.83 33.46 2nti s LYS 230 CO 0.12 -0.59 0.35 -0.51 -0.92 0.00 0.00 175.35 173.80 2nti s LEU 231 N 2.94 3.68 0.52 3.17 1.43 0.25 -4.01 118.68 126.66 2nti s LEU 231 Ca 0.53 -0.44 -0.21 0.00 -1.03 0.00 0.00 54.13 52.99 2nti s LEU 231 Cb -0.21 -2.34 -0.08 0.00 0.03 0.00 0.00 46.19 43.58 2nti s LEU 231 CO 0.16 -0.40 0.90 -2.65 0.23 0.00 0.00 176.35 174.59 2nti n PRO 232 N -1.46 1.02 -3.36 1.29 -0.02 -1.26 -3.03 135.00 128.17 2nti n PRO 232 Ca -0.01 0.38 -0.20 0.00 -2.02 0.00 0.00 63.50 61.66 2nti n PRO 232 Cb 0.59 -2.03 0.06 0.00 -0.02 0.00 0.00 33.50 32.11 2nti n PRO 232 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2nti n GLN 233 N -0.33 -6.37 -1.11 -0.52 -0.06 -1.26 -2.26 117.38 105.47 2nti n GLN 233 Ca 0.11 0.69 -0.04 0.00 -2.00 0.00 0.00 57.00 55.76 2nti n GLN 233 Cb 0.44 -5.28 -0.02 0.00 -4.06 0.00 0.00 30.24 21.32 2nti n GLN 233 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2nti n GLU 234 N -4.15 -0.42 -2.19 3.69 4.71 -1.24 -4.61 120.64 116.43 2nti n GLU 234 Ca 0.00 0.52 -0.31 0.00 -0.01 0.00 0.00 57.16 57.36 2nti n GLU 234 Cb 0.55 -4.14 -0.01 0.00 -1.01 0.00 0.00 31.44 26.84 2nti n GLU 234 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2nti s GLY 235 N -2.65 1.79 0.07 0.62 0.00 -0.96 -4.81 107.32 101.38 2nti s GLY 235 Ca 0.00 -0.06 -0.10 0.00 0.00 0.00 0.00 44.72 44.56 2nti s GLY 235 CO 0.00 0.19 0.22 -2.52 0.00 0.00 0.00 173.10 170.99 2nti s TYR 236 N -2.90 0.06 -0.26 1.90 1.13 -1.01 -0.58 117.35 115.69 2nti s TYR 236 Ca 0.55 -0.37 0.00 0.00 -1.41 0.00 0.00 57.07 55.84 2nti s TYR 236 Cb -0.11 -0.01 0.07 0.00 -1.10 0.00 0.00 41.96 40.82 2nti s TYR 236 CO 0.44 -0.51 0.00 0.20 -2.51 0.00 0.00 175.55 173.18 2nti s GLY 237 N -2.47 1.27 -0.17 5.49 0.00 -0.36 -1.45 107.32 109.63 2nti s GLY 237 Ca -0.00 -1.53 -0.08 0.00 0.00 0.00 0.00 44.72 43.11 2nti s GLY 237 CO -0.07 1.13 0.10 0.99 0.00 0.00 0.00 173.10 175.25 2nti s ASP 238 N 1.42 5.97 -0.16 1.64 -0.00 0.11 -0.76 116.67 124.89 2nti s ASP 238 Ca 0.01 0.22 -0.01 0.00 -0.00 0.00 0.00 52.55 52.77 2nti s ASP 238 Cb -0.18 -2.00 0.04 0.00 -0.00 0.00 0.00 42.92 40.78 2nti s ASP 238 CO -0.11 0.24 -0.04 -0.36 -0.00 0.00 0.00 175.17 174.91 2nti s PHE 239 N -0.03 1.55 -0.26 4.23 0.40 -0.43 -0.40 117.98 123.05 2nti s PHE 239 Ca 0.08 -1.00 -0.09 0.00 -0.60 0.00 0.00 56.93 55.32 2nti s PHE 239 Cb -0.12 -1.25 -0.04 0.00 0.51 0.00 0.00 43.02 42.13 2nti s PHE 239 CO 0.00 -0.60 0.12 0.71 0.70 0.00 0.00 175.22 176.16 2nti s TYR 240 N 1.68 3.16 -0.19 0.36 1.51 0.14 -1.30 117.35 122.72 2nti s TYR 240 Ca 0.01 -0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 55.92 2nti s TYR 240 Cb -0.15 -2.28 0.01 0.00 -0.11 0.00 0.00 41.96 39.42 2nti s TYR 240 CO -0.07 -0.22 -0.15 0.42 -1.11 0.00 0.00 175.55 174.41 2nti s ILE 241 N 1.56 2.49 0.45 2.71 1.01 0.19 -1.19 121.20 128.42 2nti s ILE 241 Ca 0.06 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.67 2nti s ILE 241 Cb -0.15 -2.08 -0.08 0.00 0.01 0.00 0.00 42.46 40.16 2nti s ILE 241 CO 0.06 0.50 1.35 0.00 0.00 0.00 0.00 174.94 176.85 2nti s ALA 242 N 1.34 3.17 0.47 9.38 0.00 0.12 -0.37 121.76 135.86 2nti s ALA 242 Ca 0.05 1.31 -0.22 0.00 0.00 0.00 0.00 51.96 53.10 2nti s ALA 242 Cb -0.13 -3.53 -0.07 0.00 0.00 0.00 0.00 23.12 19.38 2nti s ALA 242 CO -0.10 -1.03 1.14 -1.25 0.00 0.00 0.00 175.76 174.52 2nti s PRO 243 N -2.45 3.72 0.73 0.00 0.04 -1.26 -4.64 135.00 131.14 2nti s PRO 243 Ca 0.61 1.69 -0.16 0.00 0.04 0.00 0.00 61.00 63.19 2nti s PRO 243 Cb -0.40 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 31.82 2nti s PRO 243 CO 0.50 -0.56 0.91 0.54 0.04 0.00 0.00 177.00 178.43 2nti n ARG 244 N -0.63 0.43 0.00 4.56 1.74 0.17 -5.00 116.66 117.94 2nti n ARG 244 Ca 0.08 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 2nti n ARG 244 Cb 0.49 -2.17 0.00 0.00 -1.02 0.00 0.00 32.46 29.76 2nti n ARG 244 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2nti n ALA 245 N -2.58 0.00 -1.12 7.54 0.00 -1.26 -4.91 120.51 118.17 2nti n ALA 245 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2nti n ALA 245 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2nti n ALA 245 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03