#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dki s ALA 5 N 0.00 3.21 -0.32 4.37 0.00 -1.26 0.19 121.76 127.95 1dki s ALA 5 Ca 0.00 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.50 1dki s ALA 5 Cb 0.00 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1dki s ALA 5 CO 0.00 -0.27 0.11 0.50 0.00 0.00 0.00 175.76 176.10 1dki s ARG 6 N 1.00 2.96 0.83 0.00 3.52 -0.30 -4.86 118.95 122.10 1dki s ARG 6 Ca 0.53 -0.95 -0.13 0.00 -0.13 0.00 0.00 55.73 55.05 1dki s ARG 6 Cb -0.23 -3.45 0.10 0.00 -1.56 0.00 0.00 34.95 29.81 1dki s ARG 6 CO 0.28 -0.53 1.20 -0.80 -0.81 0.00 0.00 175.30 174.64 1dki s ASN 7 N 1.49 4.29 0.09 -2.12 0.01 -1.26 -4.61 114.94 112.83 1dki s ASN 7 Ca 0.02 0.69 -0.21 0.00 -0.71 0.00 0.00 52.86 52.65 1dki s ASN 7 Cb -0.18 -1.12 -0.07 0.00 0.41 0.00 0.00 41.25 40.30 1dki s ASN 7 CO 0.03 -2.03 1.36 -0.08 -1.51 0.00 0.00 177.10 174.87 1dki h GLU 8 N -1.14 -0.18 -0.73 -0.60 4.22 -1.96 -3.65 114.58 110.53 1dki h GLU 8 Ca -0.46 0.01 -0.00 0.00 0.08 0.00 0.00 59.36 58.99 1dki h GLU 8 Cb 1.31 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.57 1dki h GLU 8 CO 0.61 -0.12 0.45 1.57 -2.18 0.00 0.00 179.01 179.34 1dki h LYS 9 N -0.19 0.98 -0.17 1.92 5.09 -2.00 -0.79 116.57 121.41 1dki h LYS 9 Ca 0.06 -0.08 -0.03 0.00 0.09 0.00 0.00 60.65 60.69 1dki h LYS 9 Cb 0.36 -0.21 -0.01 0.00 0.10 0.00 0.00 32.23 32.47 1dki h LYS 9 CO -0.45 0.68 -0.01 1.05 -2.09 0.00 0.00 179.45 178.63 1dki h GLU 10 N 1.00 0.31 -0.67 0.07 -0.00 -1.99 -2.60 114.58 110.70 1dki h GLU 10 Ca 0.26 -0.10 0.08 0.00 -0.00 0.00 0.00 59.36 59.60 1dki h GLU 10 Cb -0.05 -0.03 -0.06 0.00 -0.00 0.00 0.00 28.75 28.61 1dki h GLU 10 CO -0.05 0.54 0.34 0.00 -0.00 0.00 0.00 179.01 179.84 1dki h ALA 11 N 0.76 0.91 -0.27 1.06 0.00 -1.69 0.13 119.26 120.16 1dki h ALA 11 Ca 0.05 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1dki h ALA 11 Cb 0.41 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1dki h ALA 11 CO 0.01 -0.03 -0.03 -0.22 0.00 0.00 0.00 179.25 178.98 1dki h LYS 12 N 0.60 0.04 -0.82 0.00 3.64 -1.03 -0.71 116.57 118.30 1dki h LYS 12 Ca 0.32 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 1dki h LYS 12 Cb 0.29 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1dki h LYS 12 CO -0.24 0.03 0.43 -0.44 -2.27 0.00 0.00 179.45 176.97 1dki h ASP 13 N 0.04 1.03 -0.66 4.20 3.32 -0.92 -1.41 116.42 122.02 1dki h ASP 13 Ca 0.13 -0.11 0.08 0.00 0.02 0.00 0.00 57.03 57.15 1dki h ASP 13 Cb 0.18 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.40 1dki h ASP 13 CO -0.24 0.85 0.32 0.28 -1.72 0.00 0.00 179.24 178.73 1dki h SER 14 N 1.14 0.43 -0.17 6.45 0.02 0.34 0.40 113.55 122.16 1dki h SER 14 Ca 0.29 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.28 1dki h SER 14 Cb 0.05 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1dki h SER 14 CO -0.04 0.26 0.06 0.00 -1.14 0.00 0.00 176.83 175.96 1dki h ALA 15 N 1.39 0.22 -0.87 3.77 0.00 -0.62 -0.94 119.26 122.22 1dki h ALA 15 Ca 0.32 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1dki h ALA 15 Cb 0.30 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1dki h ALA 15 CO -0.24 -0.17 0.58 0.82 0.00 0.00 0.00 179.25 180.24 1dki h ILE 16 N 0.10 1.22 -0.32 0.00 2.04 -0.49 -0.50 117.51 119.56 1dki h ILE 16 Ca 0.05 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1dki h ILE 16 Cb 0.22 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.23 1dki h ILE 16 CO -0.00 0.21 0.13 0.74 0.00 0.00 0.00 178.15 179.23 1dki h THR 17 N 1.18 1.18 -0.75 -0.27 2.02 -0.08 -2.66 112.91 113.54 1dki h THR 17 Ca 0.32 -0.57 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1dki h THR 17 Cb -0.14 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 67.19 1dki h THR 17 CO -0.07 0.20 0.48 0.15 0.37 0.00 0.00 175.52 176.65 1dki h PHE 18 N 0.37 0.90 -0.70 3.16 3.57 -0.63 0.15 116.94 123.76 1dki h PHE 18 Ca 0.11 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.64 1dki h PHE 18 Cb 0.19 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.59 1dki h PHE 18 CO -0.00 0.53 0.46 0.82 -2.23 0.00 0.00 178.31 177.89 1dki h ILE 19 N 0.95 1.17 -0.04 1.41 2.04 -0.95 -3.12 117.51 118.97 1dki h ILE 19 Ca 0.29 -0.32 -0.11 0.00 1.00 0.00 0.00 64.86 65.72 1dki h ILE 19 Cb -0.02 0.15 0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1dki h ILE 19 CO -0.10 0.17 -0.40 1.56 0.00 0.00 0.00 178.15 179.38 1dki h GLN 20 N 0.93 0.35 -0.04 2.37 4.20 -1.11 -3.52 115.11 118.30 1dki h GLN 20 Ca 0.26 -0.32 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1dki h GLN 20 Cb -0.10 0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1dki h GLN 20 CO -0.06 0.98 0.00 1.63 -0.67 0.00 0.00 178.83 180.71 1dki n LYS 21 N -4.36 1.16 0.00 1.46 5.02 0.48 -5.12 118.16 116.80 1dki n LYS 21 Ca -0.09 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 55.96 1dki n LYS 21 Cb 0.56 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 1dki n LYS 21 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1dki n ILE 35 N -0.53 0.00 -3.95 -0.18 -0.00 -1.26 -4.94 119.36 108.51 1dki n ILE 35 Ca 0.13 0.00 -0.35 0.00 -0.00 0.00 0.00 62.75 62.54 1dki n ILE 35 Cb 0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 39.64 39.61 1dki n ILE 35 CO 0.00 0.00 0.00 -0.54 -0.00 0.00 0.00 176.55 176.01 1dki s LYS 36 N -3.98 3.04 -0.03 0.38 -0.14 -1.26 -5.06 119.74 112.68 1dki s LYS 36 Ca 0.00 -0.84 -0.02 0.00 -1.36 0.00 0.00 55.97 53.75 1dki s LYS 36 Cb 0.00 -2.97 -0.04 0.00 -1.68 0.00 0.00 37.83 33.14 1dki s LYS 36 CO 0.00 -0.32 0.11 -0.51 -0.76 0.00 0.00 175.35 173.87 1dki s LEU 37 N 1.38 4.07 -0.22 3.17 1.43 -1.26 -1.08 118.68 126.17 1dki s LEU 37 Ca 0.03 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.39 1dki s LEU 37 Cb -0.16 -2.29 0.05 0.00 0.03 0.00 0.00 46.19 43.82 1dki s LEU 37 CO -0.05 0.30 -0.08 -1.81 0.23 0.00 0.00 176.35 174.95 1dki s ASP 38 N -1.61 3.74 0.25 2.29 -0.00 -0.40 -4.96 116.67 115.98 1dki s ASP 38 Ca 0.22 -1.09 -0.30 0.00 -0.00 0.00 0.00 52.55 51.38 1dki s ASP 38 Cb -0.12 -1.24 -0.10 0.00 -0.00 0.00 0.00 42.92 41.46 1dki s ASP 38 CO 0.13 -0.20 1.42 -0.75 -0.00 0.00 0.00 175.17 175.77 1dki s LYS 39 N 1.36 4.28 -0.10 8.23 2.20 -1.26 -1.37 119.74 133.08 1dki s LYS 39 Ca -0.04 2.28 -0.21 0.00 -0.36 0.00 0.00 55.97 57.63 1dki s LYS 39 Cb -0.18 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 32.99 1dki s LYS 39 CO -0.07 -0.40 0.61 0.08 -0.36 0.00 0.00 175.35 175.21 1dki s VAL 40 N -0.05 5.10 -0.41 4.02 1.01 0.14 -4.93 120.40 125.28 1dki s VAL 40 Ca 0.59 1.23 -0.29 0.00 0.00 0.00 0.00 61.98 63.51 1dki s VAL 40 Cb -0.41 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1dki s VAL 40 CO 0.43 0.27 1.49 0.54 0.00 0.00 0.00 175.10 177.84 1dki s ASN 41 N 0.76 6.22 -0.21 3.32 6.03 -1.26 -4.69 114.94 125.11 1dki s ASN 41 Ca 0.32 0.88 -0.06 0.00 -1.03 0.00 0.00 52.86 52.97 1dki s ASN 41 Cb -0.17 -2.54 -0.03 0.00 -3.03 0.00 0.00 41.25 35.49 1dki s ASN 41 CO 0.14 -1.52 0.04 -0.76 -2.03 0.00 0.00 177.10 172.97 1dki s LEU 42 N 5.81 3.46 0.00 3.54 1.43 -1.26 -5.03 118.68 126.62 1dki s LEU 42 Ca 0.64 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 1dki s LEU 42 Cb -0.15 -1.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.18 1dki s LEU 42 CO 0.32 0.06 0.01 0.61 0.23 0.00 0.00 176.35 177.58 1dki n GLY 43 N 4.28 3.88 7.00 -3.19 0.00 -1.26 -3.95 105.19 111.95 1dki n GLY 43 Ca -0.17 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.61 1dki n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 44 N 2.04 3.18 0.20 -0.02 0.00 -1.26 -1.91 105.19 107.42 1dki n GLY 44 Ca -0.08 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.81 1dki n GLY 44 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dki h GLU 45 N 0.00 0.00 -0.51 1.61 -0.00 -2.00 0.21 114.58 113.89 1dki h GLU 45 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1dki h GLU 45 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1dki h GLU 45 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 179.01 180.29 1dki n LEU 46 N -2.36 3.55 -4.77 3.06 4.77 -0.80 -4.94 117.00 115.51 1dki n LEU 46 Ca -0.02 -2.10 -0.37 0.00 -0.03 0.00 0.00 56.01 53.49 1dki n LEU 46 Cb 0.16 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 1dki n LEU 46 CO 0.10 0.83 0.79 -0.55 -1.33 0.00 0.00 177.39 177.24 1dki s SER 47 N -1.04 6.55 0.00 -1.43 0.15 0.06 -4.52 113.70 113.47 1dki s SER 47 Ca 0.36 2.22 0.00 0.00 0.70 0.00 0.00 55.95 59.23 1dki s SER 47 Cb 0.20 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.91 1dki s SER 47 CO 0.23 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.63 1dki n GLY 48 N 0.50 1.33 1.25 9.45 0.00 -1.26 -4.87 105.19 111.58 1dki n GLY 48 Ca 0.05 -2.16 0.08 0.00 0.00 0.00 0.00 46.02 44.00 1dki n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dki n SER 49 N 0.00 4.29 0.14 1.61 3.41 -1.26 -4.48 113.62 117.34 1dki n SER 49 Ca 0.00 -2.58 0.13 0.00 -0.26 0.00 0.00 58.87 56.16 1dki n SER 49 Cb 0.00 -0.52 0.38 0.00 -0.26 0.00 0.00 64.21 63.82 1dki n SER 49 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1dki h ASN 50 N 3.05 0.00 -4.35 4.04 2.35 -1.89 -3.38 115.58 115.40 1dki h ASN 50 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1dki h ASN 50 Cb 1.38 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.54 1dki h ASN 50 CO 0.22 0.00 0.09 -0.32 -1.65 0.00 0.00 177.43 175.77 1dki s MET 51 N -3.19 0.86 -0.01 0.81 1.75 -1.26 -0.93 119.30 117.33 1dki s MET 51 Ca 0.08 0.66 0.05 0.00 -1.25 0.00 0.00 55.69 55.24 1dki s MET 51 Cb 0.10 0.41 -0.01 0.00 2.84 0.00 0.00 34.83 38.17 1dki s MET 51 CO 0.58 -0.17 -0.17 0.71 -0.65 0.00 0.00 175.02 175.32 1dki s TYR 52 N -0.21 1.51 -0.09 4.11 1.51 0.51 -4.90 117.35 119.78 1dki s TYR 52 Ca -0.04 -0.29 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 1dki s TYR 52 Cb -0.03 -0.96 0.01 0.00 -0.11 0.00 0.00 41.96 40.86 1dki s TYR 52 CO 0.04 -0.02 -0.20 0.08 -1.11 0.00 0.00 175.55 174.34 1dki s VAL 53 N -0.44 1.76 -0.12 0.71 1.01 -1.26 0.09 120.40 122.16 1dki s VAL 53 Ca 0.06 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1dki s VAL 53 Cb -0.07 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.78 1dki s VAL 53 CO -0.00 0.49 -0.19 -0.31 0.00 0.00 0.00 175.10 175.09 1dki s TYR 54 N 0.50 2.31 -0.16 5.22 1.51 -0.11 -0.69 117.35 125.92 1dki s TYR 54 Ca -0.16 -1.10 -0.16 0.00 -1.01 0.00 0.00 57.07 54.65 1dki s TYR 54 Cb -0.17 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.03 1dki s TYR 54 CO 0.06 -0.52 0.37 -0.80 -1.11 0.00 0.00 175.55 173.56 1dki s ASN 55 N 0.82 6.50 0.04 2.29 0.01 -0.47 -0.91 114.94 123.21 1dki s ASN 55 Ca -0.09 0.58 -0.30 0.00 -0.71 0.00 0.00 52.86 52.34 1dki s ASN 55 Cb -0.16 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1dki s ASN 55 CO -0.00 0.01 1.02 -0.63 -1.51 0.00 0.00 177.10 175.99 1dki s ILE 56 N 0.80 4.62 0.37 0.60 1.01 0.24 -1.28 121.20 127.56 1dki s ILE 56 Ca 0.20 1.94 0.13 0.00 0.00 0.00 0.00 60.65 62.91 1dki s ILE 56 Cb -0.14 -4.24 0.35 0.00 0.01 0.00 0.00 42.46 38.44 1dki s ILE 56 CO 0.07 0.18 1.82 0.77 0.00 0.00 0.00 174.94 177.78 1dki h SER 57 N 6.51 0.57 0.45 3.58 4.64 -1.42 -0.81 113.55 127.06 1dki h SER 57 Ca -0.42 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1dki h SER 57 Cb 1.22 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1dki h SER 57 CO 0.75 0.21 -0.26 0.35 -0.87 0.00 0.00 176.83 177.02 1dki n THR 58 N -4.61 0.00 0.00 2.95 -2.24 -1.26 -5.01 114.28 104.11 1dki n THR 58 Ca 0.21 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1dki n THR 58 Cb 0.66 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1dki n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dki n GLY 59 N 1.39 4.12 0.00 3.38 0.00 -0.31 -4.93 105.19 108.84 1dki n GLY 59 Ca 0.10 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1dki n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 60 N -1.47 1.02 3.71 -0.02 0.00 0.13 -4.47 105.19 104.09 1dki n GLY 60 Ca 0.00 -1.95 -0.08 0.00 0.00 0.00 0.00 46.02 43.99 1dki n GLY 60 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1dki s PHE 61 N -2.02 -0.17 -0.11 1.61 -0.12 -0.44 -0.59 117.98 116.14 1dki s PHE 61 Ca 0.00 -0.22 -0.08 0.00 -0.05 0.00 0.00 56.93 56.58 1dki s PHE 61 Cb 0.00 0.58 0.04 0.00 -0.63 0.00 0.00 43.02 43.00 1dki s PHE 61 CO 0.00 -1.10 0.27 0.08 -0.05 0.00 0.00 175.22 174.42 1dki s VAL 62 N -3.90 -0.02 -0.18 -2.49 1.01 -0.09 -1.43 120.40 113.31 1dki s VAL 62 Ca 0.10 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.11 1dki s VAL 62 Cb -0.04 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 1dki s VAL 62 CO 0.03 0.02 -0.04 -0.63 0.00 0.00 0.00 175.10 174.48 1dki s ILE 63 N 0.64 3.70 0.01 2.22 1.01 0.33 -0.94 121.20 128.17 1dki s ILE 63 Ca -0.04 -0.41 0.07 0.00 0.00 0.00 0.00 60.65 60.28 1dki s ILE 63 Cb -0.05 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 1dki s ILE 63 CO -0.04 0.46 -0.22 -0.69 0.00 0.00 0.00 174.94 174.45 1dki s VAL 64 N 0.84 2.44 0.48 2.92 1.01 0.11 -0.82 120.40 127.39 1dki s VAL 64 Ca -0.01 -1.16 -0.16 0.00 0.00 0.00 0.00 61.98 60.66 1dki s VAL 64 Cb -0.15 -1.95 -0.08 0.00 0.00 0.00 0.00 36.38 34.21 1dki s VAL 64 CO 0.02 0.45 0.93 -0.94 0.00 0.00 0.00 175.10 175.55 1dki s SER 65 N -1.06 6.63 -0.01 3.32 1.04 -0.42 -0.36 113.70 122.83 1dki s SER 65 Ca 0.12 1.48 0.22 0.00 0.48 0.00 0.00 55.95 58.25 1dki s SER 65 Cb -0.10 -2.47 0.65 0.00 0.10 0.00 0.00 66.02 64.20 1dki s SER 65 CO 0.02 -0.52 1.55 0.61 0.98 0.00 0.00 173.24 175.87 1dki n GLY 66 N -1.43 2.54 2.89 7.32 0.00 -0.11 -4.79 105.19 111.61 1dki n GLY 66 Ca 0.06 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 1dki n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dki s ASP 67 N -0.99 -0.03 0.00 1.61 -1.08 -1.26 -1.14 116.67 113.77 1dki s ASP 67 Ca 0.49 0.11 0.24 0.00 -0.52 0.00 0.00 52.55 52.88 1dki s ASP 67 Cb 0.26 0.07 1.46 0.00 -1.46 0.00 0.00 42.92 43.26 1dki s ASP 67 CO 0.32 -0.06 1.84 0.29 0.52 0.00 0.00 175.17 178.08 1dki n LYS 68 N 3.45 0.80 -0.12 4.34 5.02 0.50 -2.45 118.16 129.70 1dki n LYS 68 Ca -0.17 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.22 1dki n LYS 68 Cb 0.57 -1.48 0.31 0.00 -0.02 0.00 0.00 35.03 34.41 1dki n LYS 68 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1dki n ARG 69 N -0.98 1.92 -4.34 1.97 1.74 -1.26 -1.37 116.66 114.35 1dki n ARG 69 Ca 0.18 -1.40 -0.21 0.00 -0.77 0.00 0.00 57.85 55.65 1dki n ARG 69 Cb 0.08 -1.41 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 1dki n ARG 69 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1dki s SER 70 N -1.46 2.69 0.54 0.55 0.01 -1.03 -4.54 113.70 110.45 1dki s SER 70 Ca 0.33 -0.89 -0.21 0.00 1.31 0.00 0.00 55.95 56.49 1dki s SER 70 Cb 0.18 -0.16 -0.07 0.00 0.21 0.00 0.00 66.02 66.18 1dki s SER 70 CO 0.26 -0.05 0.98 -0.81 0.41 0.00 0.00 173.24 174.03 1dki n PRO 71 N 0.16 1.09 0.16 12.44 -0.04 -1.26 -4.73 135.00 142.82 1dki n PRO 71 Ca -0.12 0.41 -0.13 0.00 -0.04 0.00 0.00 63.50 63.62 1dki n PRO 71 Cb 0.58 -2.13 -0.08 0.00 -0.04 0.00 0.00 33.50 31.83 1dki n PRO 71 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1dki h GLU 72 N 0.90 -0.43 -5.11 0.54 4.81 -1.94 -3.39 114.58 109.96 1dki h GLU 72 Ca -0.47 0.03 -0.62 0.00 -0.13 0.00 0.00 59.36 58.17 1dki h GLU 72 Cb 1.35 0.10 -0.14 0.00 0.63 0.00 0.00 28.75 30.69 1dki h GLU 72 CO 0.53 -0.10 -0.45 0.42 -0.73 0.00 0.00 179.01 178.68 1dki s ILE 73 N -4.37 5.32 -0.06 2.32 -1.09 -1.26 -1.30 121.20 120.77 1dki s ILE 73 Ca -0.13 0.27 0.22 0.00 -2.23 0.00 0.00 60.65 58.77 1dki s ILE 73 Cb 0.02 -3.54 -0.30 0.00 -1.58 0.00 0.00 42.46 37.05 1dki s ILE 73 CO 0.50 0.31 0.52 0.18 -1.23 0.00 0.00 174.94 175.22 1dki n LEU 74 N 4.46 0.08 -3.61 2.97 4.77 0.00 -4.92 117.00 120.76 1dki n LEU 74 Ca -0.14 0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 55.86 1dki n LEU 74 Cb 0.52 0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 1dki n LEU 74 CO 0.36 0.00 1.06 -0.83 -1.33 0.00 0.00 177.39 176.64 1dki s GLY 75 N -4.54 -0.34 0.02 -0.72 0.00 -1.24 -1.79 107.32 98.72 1dki s GLY 75 Ca -0.07 1.26 -0.29 0.00 0.00 0.00 0.00 44.72 45.62 1dki s GLY 75 CO 0.90 0.37 1.22 -2.52 0.00 0.00 0.00 173.10 173.07 1dki s TYR 76 N -2.37 -0.03 -0.08 1.90 -0.85 0.16 -0.51 117.35 115.57 1dki s TYR 76 Ca 0.12 -0.12 -0.28 0.00 -0.52 0.00 0.00 57.07 56.26 1dki s TYR 76 Cb 0.02 0.57 0.06 0.00 0.38 0.00 0.00 41.96 42.99 1dki s TYR 76 CO -0.04 -0.40 0.64 0.45 -1.52 0.00 0.00 175.55 174.68 1dki s SER 77 N -3.15 -0.62 0.00 -0.18 0.15 -0.51 -0.12 113.70 109.27 1dki s SER 77 Ca 0.17 0.76 0.27 0.00 0.70 0.00 0.00 55.95 57.85 1dki s SER 77 Cb 0.03 0.65 0.81 0.00 -1.71 0.00 0.00 66.02 65.80 1dki s SER 77 CO -0.02 -0.53 1.60 0.35 1.20 0.00 0.00 173.24 175.84 1dki n THR 78 N 1.24 0.00 -4.12 6.45 -2.24 -1.26 -1.33 114.28 113.01 1dki n THR 78 Ca -0.18 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.27 1dki n THR 78 Cb 0.57 0.58 -0.09 0.00 -2.10 0.00 0.00 70.33 69.29 1dki n THR 78 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1dki s SER 79 N -2.22 0.19 0.39 3.42 1.04 -1.26 -3.95 113.70 111.31 1dki s SER 79 Ca 0.31 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.55 1dki s SER 79 Cb 0.20 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1dki s SER 79 CO 0.42 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1dki n GLY 80 N -0.18 0.14 3.67 7.32 0.00 -1.26 -3.21 105.19 111.67 1dki n GLY 80 Ca -0.03 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 1dki n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dki s SER 81 N -4.00 -0.21 -0.08 1.61 1.04 -1.26 0.22 113.70 111.02 1dki s SER 81 Ca 0.00 -0.68 0.03 0.00 0.48 0.00 0.00 55.95 55.78 1dki s SER 81 Cb 0.00 0.64 -0.02 0.00 0.10 0.00 0.00 66.02 66.74 1dki s SER 81 CO 0.00 -1.20 -0.18 0.12 0.98 0.00 0.00 173.24 172.97 1dki s PHE 82 N -3.94 2.65 -0.13 5.02 5.36 -1.26 -0.92 117.98 124.76 1dki s PHE 82 Ca 0.14 -0.53 -0.23 0.00 -0.96 0.00 0.00 56.93 55.36 1dki s PHE 82 Cb -0.03 -1.69 0.05 0.00 -0.34 0.00 0.00 43.02 41.01 1dki s PHE 82 CO 0.05 -0.09 0.56 0.34 -1.46 0.00 0.00 175.22 174.62 1dki s ASP 83 N -0.16 -0.55 0.00 6.13 -1.08 -1.26 -4.94 116.67 114.81 1dki s ASP 83 Ca -0.02 0.83 0.00 0.00 -0.52 0.00 0.00 52.55 52.84 1dki s ASP 83 Cb -0.14 0.82 0.00 0.00 -1.46 0.00 0.00 42.92 42.15 1dki s ASP 83 CO 0.04 -0.37 0.41 1.33 0.52 0.00 0.00 175.17 177.10 1dki n VAL 84 N 1.92 0.00 -1.66 1.11 0.24 -1.26 -4.73 118.33 113.95 1dki n VAL 84 Ca -0.17 -0.43 -0.43 0.00 -2.04 0.00 0.00 64.34 61.27 1dki n VAL 84 Cb 0.56 1.14 -0.03 0.00 -1.47 0.00 0.00 33.84 34.04 1dki n VAL 84 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1dki n ASN 85 N -0.02 3.96 -0.77 -1.34 3.02 -1.26 -1.15 115.26 117.71 1dki n ASN 85 Ca 0.00 0.87 -0.10 0.00 -0.03 0.00 0.00 54.58 55.32 1dki n ASN 85 Cb 0.04 -1.50 -0.04 0.00 -0.61 0.00 0.00 39.78 37.67 1dki n ASN 85 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dki n GLY 86 N 4.63 1.11 2.73 7.41 0.00 -1.26 -4.94 105.19 114.87 1dki n GLY 86 Ca 0.21 -0.34 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1dki n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dki s LYS 87 N -2.68 1.72 0.49 1.61 1.02 -0.30 -4.97 119.74 116.63 1dki s LYS 87 Ca 0.00 -2.60 0.19 0.00 0.02 0.00 0.00 55.97 53.58 1dki s LYS 87 Cb 0.00 -2.64 1.23 0.00 -0.52 0.00 0.00 37.83 35.90 1dki s LYS 87 CO 0.00 -1.25 2.07 1.49 -0.92 0.00 0.00 175.35 176.73 1dki h GLU 88 N 5.96 0.00 -0.06 1.68 4.57 -1.92 -2.39 114.58 122.42 1dki h GLU 88 Ca 0.10 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.18 1dki h GLU 88 Cb 0.85 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 1dki h GLU 88 CO 0.57 0.11 -0.44 -2.95 -1.18 0.00 0.00 179.01 175.12 1dki h ASN 89 N 0.00 0.14 0.00 1.04 -1.07 -1.91 -0.36 115.58 113.42 1dki h ASN 89 Ca -0.00 -0.06 -0.00 0.00 0.07 0.00 0.00 56.30 56.31 1dki h ASN 89 Cb 0.22 -0.04 0.00 0.00 -2.07 0.00 0.00 38.32 36.43 1dki h ASN 89 CO 0.01 0.56 -0.00 0.40 0.07 0.00 0.00 177.43 178.47 1dki h ILE 90 N 0.11 1.52 -0.56 6.14 2.04 -1.81 -2.93 117.51 122.03 1dki h ILE 90 Ca 0.01 -1.55 0.07 0.00 1.00 0.00 0.00 64.86 64.38 1dki h ILE 90 Cb 0.82 2.57 -0.06 0.00 -0.74 0.00 0.00 36.82 39.41 1dki h ILE 90 CO 0.06 0.40 0.24 0.00 0.00 0.00 0.00 178.15 178.85 1dki h ALA 91 N 0.32 0.71 -0.30 1.87 0.00 -1.39 -1.38 119.26 119.09 1dki h ALA 91 Ca -0.00 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1dki h ALA 91 Cb 0.66 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1dki h ALA 91 CO 0.00 -0.15 -0.04 1.03 0.00 0.00 0.00 179.25 180.09 1dki h SER 92 N 0.44 -0.21 -0.44 0.00 0.87 -1.12 0.13 113.55 113.22 1dki h SER 92 Ca 0.26 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.90 1dki h SER 92 Cb 0.26 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1dki h SER 92 CO -0.24 -0.07 0.23 0.15 -0.53 0.00 0.00 176.83 176.38 1dki h PHE 93 N 0.04 0.60 -0.24 2.24 3.57 -1.22 -1.93 116.94 120.01 1dki h PHE 93 Ca 0.15 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.63 1dki h PHE 93 Cb 0.21 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 1dki h PHE 93 CO -0.26 0.46 0.16 0.52 -2.23 0.00 0.00 178.31 176.96 1dki h MET 94 N 0.57 0.29 -0.21 1.11 2.86 -0.76 -0.91 114.93 117.88 1dki h MET 94 Ca 0.15 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.70 1dki h MET 94 Cb 0.06 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1dki h MET 94 CO -0.02 0.19 -0.19 0.93 1.06 0.00 0.00 176.91 178.88 1dki h GLU 95 N 0.30 0.37 -0.32 1.72 5.08 0.02 -2.00 114.58 119.76 1dki h GLU 95 Ca 0.09 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1dki h GLU 95 Cb -0.01 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1dki h GLU 95 CO -0.02 0.55 -0.25 0.77 -1.00 0.00 0.00 179.01 179.06 1dki h SER 96 N 0.34 0.64 -0.22 1.42 0.02 -0.76 -1.79 113.55 113.20 1dki h SER 96 Ca 0.06 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1dki h SER 96 Cb 0.53 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1dki h SER 96 CO 0.03 0.87 0.13 1.88 -1.14 0.00 0.00 176.83 178.61 1dki h TYR 97 N 0.55 0.30 -0.30 3.45 0.99 -1.12 -1.23 116.97 119.61 1dki h TYR 97 Ca 0.08 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 60.84 1dki h TYR 97 Cb 0.72 -0.10 -0.03 0.00 1.00 0.00 0.00 36.73 38.32 1dki h TYR 97 CO 0.03 0.23 0.10 0.28 -0.00 0.00 0.00 178.16 178.80 1dki h VAL 98 N 0.27 0.90 -3.36 -2.88 2.07 -1.12 0.98 116.25 113.11 1dki h VAL 98 Ca 0.08 -0.08 -0.46 0.00 0.82 0.00 0.00 66.70 67.06 1dki h VAL 98 Cb 0.03 0.66 -0.35 0.00 -1.52 0.00 0.00 31.29 30.10 1dki h VAL 98 CO -0.01 0.04 -0.79 -1.61 0.02 0.00 0.00 177.57 175.22 1dki s GLU 99 N -6.17 1.11 0.00 1.57 8.01 -0.70 -1.69 118.70 120.83 1dki s GLU 99 Ca -0.13 -0.16 0.00 0.00 0.01 0.00 0.00 54.97 54.69 1dki s GLU 99 Cb 0.11 -1.12 0.00 0.00 -4.31 0.00 0.00 34.13 28.81 1dki s GLU 99 CO 0.70 -0.13 0.00 1.04 0.01 0.00 0.00 175.26 176.88 1dki n GLN 100 N 4.36 0.00 -0.18 1.61 6.02 -0.48 -5.65 117.38 123.06 1dki n GLN 100 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.80 1dki n GLN 100 Cb 0.51 0.00 0.26 0.00 1.02 0.00 0.00 30.24 32.02 1dki n GLN 100 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1dki h ILE 101 N 0.00 1.19 -0.33 5.09 2.04 -0.45 -1.31 117.51 123.74 1dki h ILE 101 Ca 0.00 -0.41 -0.18 0.00 1.00 0.00 0.00 64.86 65.28 1dki h ILE 101 Cb 0.00 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1dki h ILE 101 CO 0.00 0.20 -0.48 0.11 0.00 0.00 0.00 178.15 177.98 1dki h LYS 102 N 0.93 0.91 0.00 2.37 1.57 -1.57 -2.99 116.57 117.78 1dki h LYS 102 Ca 0.24 -0.54 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 1dki h LYS 102 Cb -0.04 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1dki h LYS 102 CO -0.05 1.18 -0.15 0.93 -0.57 0.00 0.00 179.45 180.80 1dki h GLU 103 N 0.71 0.00 0.00 3.15 5.08 -1.67 -2.16 114.58 119.70 1dki h GLU 103 Ca 0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1dki h GLU 103 Cb 1.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1dki h GLU 103 CO 0.11 0.15 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.31 1dki h ASN 104 N 0.00 0.00 0.27 1.42 2.35 -1.11 -3.05 115.58 115.45 1dki h ASN 104 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1dki h ASN 104 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1dki h ASN 104 CO 0.02 0.05 0.00 0.29 -1.65 0.00 0.00 177.43 176.14 1dki n LYS 105 N -3.13 0.12 0.00 0.81 5.02 -0.81 -1.53 118.16 118.63 1dki n LYS 105 Ca 0.02 0.51 0.09 0.00 -2.02 0.00 0.00 58.31 56.91 1dki n LYS 105 Cb 0.44 -1.80 0.39 0.00 -0.02 0.00 0.00 35.03 34.04 1dki n LYS 105 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1dki n LYS 106 N -2.03 0.06 -2.52 1.97 4.76 -1.15 -4.76 118.16 114.48 1dki n LYS 106 Ca 0.00 0.18 -0.18 0.00 -2.87 0.00 0.00 58.31 55.44 1dki n LYS 106 Cb 0.10 -1.50 0.08 0.00 -1.84 0.00 0.00 35.03 31.86 1dki n LYS 106 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1dki n LEU 107 N -1.45 0.00 -0.83 -0.35 4.32 -0.59 -5.07 117.00 113.04 1dki n LEU 107 Ca 0.05 -2.00 0.01 0.00 -0.02 0.00 0.00 56.01 54.05 1dki n LEU 107 Cb 0.19 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.56 1dki n LEU 107 CO 0.16 -0.78 0.19 -0.90 -1.22 0.00 0.00 177.39 174.84 1dki n ASP 108 N -2.63 0.30 -3.95 -1.43 5.75 -1.26 -5.09 116.55 108.23 1dki n ASP 108 Ca 0.14 -1.96 -0.14 0.00 -0.01 0.00 0.00 54.79 52.82 1dki n ASP 108 Cb 0.51 -0.21 -0.14 0.00 -1.03 0.00 0.00 41.12 40.25 1dki n ASP 108 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1dki s SER 109 N -1.28 0.49 0.72 -1.12 0.15 -1.26 -5.14 113.70 106.27 1dki s SER 109 Ca 0.11 -0.14 -0.17 0.00 0.70 0.00 0.00 55.95 56.45 1dki s SER 109 Cb 0.13 -0.03 -0.07 0.00 -1.71 0.00 0.00 66.02 64.33 1dki s SER 109 CO -0.05 0.00 0.23 0.41 1.20 0.00 0.00 173.24 175.03 1dki n THR 110 N 2.75 1.15 -1.68 6.45 -1.04 -1.26 -4.67 114.28 115.98 1dki n THR 110 Ca -0.14 -0.42 -0.41 0.00 -2.04 0.00 0.00 64.05 61.03 1dki n THR 110 Cb 0.58 -0.50 0.01 0.00 -1.82 0.00 0.00 70.33 68.60 1dki n THR 110 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dki n TYR 111 N -2.26 1.90 0.00 -1.42 9.36 -0.47 -4.93 117.16 119.34 1dki n TYR 111 Ca 0.08 0.52 0.00 0.00 3.32 0.00 0.00 57.90 61.82 1dki n TYR 111 Cb 0.50 -2.34 0.00 0.00 -0.63 0.00 0.00 39.34 36.87 1dki n TYR 111 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1dki n ALA 112 N -0.22 0.00 0.00 2.98 0.00 -1.26 -5.05 120.51 116.96 1dki n ALA 112 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1dki n ALA 112 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1dki n ALA 112 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1dki n GLN 1 N 0.00 0.00 -2.18 0.00 7.27 -1.26 -5.06 117.38 116.14 1dki n GLN 1 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.77 1dki n GLN 1 Cb 0.00 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 32.65 1dki n GLN 1 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1dki s PRO 2 N -4.93 3.66 -0.05 3.69 0.04 -1.26 -4.24 135.00 131.90 1dki s PRO 2 Ca 0.00 0.65 -0.18 0.00 0.04 0.00 0.00 61.00 61.51 1dki s PRO 2 Cb 0.00 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1dki s PRO 2 CO 0.00 -0.41 0.49 0.08 0.04 0.00 0.00 177.00 177.21 1dki s VAL 3 N -2.94 5.06 -0.13 -0.36 1.01 -1.26 -3.87 120.40 117.90 1dki s VAL 3 Ca 0.54 1.01 -0.03 0.00 0.00 0.00 0.00 61.98 63.50 1dki s VAL 3 Cb -0.11 -3.82 0.05 0.00 0.00 0.00 0.00 36.38 32.50 1dki s VAL 3 CO 0.47 0.42 0.05 -0.69 0.00 0.00 0.00 175.10 175.35 1dki s VAL 4 N -0.07 0.15 0.42 2.92 1.01 -0.81 -4.94 120.40 119.07 1dki s VAL 4 Ca 0.27 -0.09 -0.25 0.00 0.00 0.00 0.00 61.98 61.91 1dki s VAL 4 Cb -0.16 -0.60 -0.08 0.00 0.00 0.00 0.00 36.38 35.54 1dki s VAL 4 CO 0.13 -0.06 1.22 -0.54 0.00 0.00 0.00 175.10 175.85 1dki s LYS 5 N 2.04 3.93 -0.49 2.72 -0.14 -1.26 -0.96 119.74 125.58 1dki s LYS 5 Ca 0.02 1.96 -0.45 0.00 -1.36 0.00 0.00 55.97 56.14 1dki s LYS 5 Cb -0.15 -2.64 -0.19 0.00 -1.68 0.00 0.00 37.83 33.17 1dki s LYS 5 CO -0.07 -0.46 1.87 0.45 -0.76 0.00 0.00 175.35 176.38 1dki n SER 6 N -0.06 1.07 -0.05 2.83 2.88 -1.26 -4.73 113.62 114.31 1dki n SER 6 Ca 0.05 0.93 -0.12 0.00 -1.33 0.00 0.00 58.87 58.40 1dki n SER 6 Cb 0.46 -0.91 -0.06 0.00 -0.75 0.00 0.00 64.21 62.94 1dki n SER 6 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1dki h LEU 7 N 7.15 0.26 -1.00 2.46 3.38 -1.09 -1.43 115.31 125.03 1dki h LEU 7 Ca -0.28 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.29 1dki h LEU 7 Cb 1.39 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 1dki h LEU 7 CO 1.03 0.53 0.07 -0.07 0.09 0.00 0.00 178.44 180.10 1dki h LEU 8 N -0.03 0.75 -1.07 1.67 3.38 -1.89 -2.47 115.31 115.66 1dki h LEU 8 Ca 0.04 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1dki h LEU 8 Cb 0.41 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1dki h LEU 8 CO 0.01 0.78 0.02 0.44 0.09 0.00 0.00 178.44 179.78 1dki h ASP 9 N 0.76 0.65 0.08 -0.43 3.32 -1.79 -0.71 116.42 118.31 1dki h ASP 9 Ca 0.16 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1dki h ASP 9 Cb 0.36 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1dki h ASP 9 CO 0.01 0.70 -0.01 0.77 -1.72 0.00 0.00 179.24 178.99 1dki h SER 10 N 0.65 0.00 -0.18 6.45 4.64 -0.77 -0.86 113.55 123.49 1dki h SER 10 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1dki h SER 10 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1dki h SER 10 CO 0.01 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.27 1dki n LYS 11 N -3.27 2.64 -2.68 4.77 5.02 -0.74 -4.99 118.16 118.92 1dki n LYS 11 Ca -0.03 -1.73 -0.18 0.00 -2.02 0.00 0.00 58.31 54.35 1dki n LYS 11 Cb 0.10 -1.15 0.02 0.00 -0.02 0.00 0.00 35.03 33.97 1dki n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dki n GLY 12 N 0.11 -0.34 3.59 0.72 0.00 -0.33 -4.84 105.19 104.10 1dki n GLY 12 Ca 0.06 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1dki n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dki s ILE 13 N -3.00 4.87 -0.36 -0.61 1.01 -0.36 -4.07 121.20 118.68 1dki s ILE 13 Ca 0.16 0.80 0.02 0.00 0.00 0.00 0.00 60.65 61.62 1dki s ILE 13 Cb -0.07 -4.08 0.15 0.00 0.01 0.00 0.00 42.46 38.47 1dki s ILE 13 CO 0.19 -0.26 0.31 -1.00 0.00 0.00 0.00 174.94 174.18 1dki s HIS 14 N 2.76 0.06 0.50 3.97 3.76 -0.13 -4.62 115.29 121.59 1dki s HIS 14 Ca 0.27 -1.08 0.03 0.00 -0.15 0.00 0.00 55.06 54.13 1dki s HIS 14 Cb -0.14 -0.59 0.02 0.00 1.11 0.00 0.00 32.58 32.98 1dki s HIS 14 CO 0.14 -0.92 0.70 0.71 -0.85 0.00 0.00 174.74 174.52 1dki s TYR 15 N 1.35 2.87 0.04 1.40 4.12 -1.26 -4.47 117.35 121.40 1dki s TYR 15 Ca 0.17 -0.13 0.01 0.00 0.02 0.00 0.00 57.07 57.14 1dki s TYR 15 Cb -0.18 -2.59 -0.00 0.00 -1.52 0.00 0.00 41.96 37.67 1dki s TYR 15 CO -0.04 -0.68 0.03 -1.71 0.02 0.00 0.00 175.55 173.18 1dki n ASN 16 N -2.15 0.04 -0.10 2.29 2.85 -1.26 -1.19 115.26 115.74 1dki n ASN 16 Ca 0.07 -1.29 0.04 0.00 -0.11 0.00 0.00 54.58 53.30 1dki n ASN 16 Cb 0.59 0.21 -0.03 0.00 1.24 0.00 0.00 39.78 41.79 1dki n ASN 16 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1dki n GLN 17 N -0.09 3.12 0.00 1.20 6.02 -1.25 -4.86 117.38 121.52 1dki n GLN 17 Ca 0.01 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.72 1dki n GLN 17 Cb 0.08 -0.99 0.00 0.00 1.02 0.00 0.00 30.24 30.35 1dki n GLN 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dki n GLY 18 N 1.05 3.36 3.77 1.08 0.00 -1.26 -1.52 105.19 111.67 1dki n GLY 18 Ca 0.03 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1dki n GLY 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dki s ASN 19 N -0.08 6.70 0.00 1.61 3.84 -1.26 -0.40 114.94 125.35 1dki s ASN 19 Ca 0.00 2.74 0.24 0.00 0.21 0.00 0.00 52.86 56.05 1dki s ASN 19 Cb 0.00 -2.65 0.70 0.00 -0.55 0.00 0.00 41.25 38.75 1dki s ASN 19 CO 0.00 -0.59 1.54 -0.81 -2.79 0.00 0.00 177.10 174.45 1dki n PRO 20 N 0.89 1.94 -0.06 0.43 -0.04 -1.26 -4.87 135.00 132.04 1dki n PRO 20 Ca 0.01 -1.38 0.08 0.00 -0.04 0.00 0.00 63.50 62.16 1dki n PRO 20 Cb 0.41 -1.45 0.45 0.00 -0.04 0.00 0.00 33.50 32.87 1dki n PRO 20 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1dki h TYR 21 N 3.07 0.51 -0.58 0.54 -1.99 -1.06 -2.48 116.97 114.97 1dki h TYR 21 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1dki h TYR 21 Cb 0.66 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 39.22 1dki h TYR 21 CO 0.07 0.28 0.00 0.27 -0.00 0.00 0.00 178.16 178.78 1dki n ASN 22 N -4.47 5.48 0.22 3.88 6.94 -0.38 -4.31 115.26 122.61 1dki n ASN 22 Ca 0.07 -2.83 0.15 0.00 -0.02 0.00 0.00 54.58 51.95 1dki n ASN 22 Cb 0.22 -0.67 0.78 0.00 -2.36 0.00 0.00 39.78 37.76 1dki n ASN 22 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1dki h LEU 23 N 3.94 0.00 -2.82 -4.53 3.38 -1.72 -2.66 115.31 110.91 1dki h LEU 23 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dki h LEU 23 Cb 1.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.61 1dki h LEU 23 CO 0.44 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.15 1dki n LEU 24 N -2.54 2.28 -4.86 1.67 4.77 -1.26 -5.02 117.00 112.03 1dki n LEU 24 Ca -0.02 -1.92 -0.30 0.00 -0.03 0.00 0.00 56.01 53.74 1dki n LEU 24 Cb 0.07 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1dki n LEU 24 CO 0.14 0.57 0.75 0.42 -1.33 0.00 0.00 177.39 177.93 1dki s THR 25 N -0.95 3.04 0.39 -5.08 -4.23 -1.00 -4.84 115.64 102.97 1dki s THR 25 Ca 0.09 0.34 -0.28 0.00 -1.18 0.00 0.00 61.69 60.66 1dki s THR 25 Cb 0.05 -3.26 -0.11 0.00 1.34 0.00 0.00 72.50 70.52 1dki s THR 25 CO 0.06 -0.44 1.49 -2.84 -0.54 0.00 0.00 174.62 172.34 1dki s PRO 26 N -5.34 4.05 -0.13 3.99 0.02 -1.26 -4.55 135.00 131.78 1dki s PRO 26 Ca 0.60 2.57 -0.26 0.00 0.02 0.00 0.00 61.00 63.92 1dki s PRO 26 Cb -0.12 -2.93 -0.02 0.00 0.02 0.00 0.00 34.50 31.45 1dki s PRO 26 CO 0.52 -0.58 0.87 0.08 -0.33 0.00 0.00 177.00 177.56 1dki s VAL 27 N -1.13 4.87 0.18 3.83 1.01 -1.26 -1.48 120.40 126.43 1dki s VAL 27 Ca 0.54 1.75 -0.33 0.00 0.00 0.00 0.00 61.98 63.94 1dki s VAL 27 Cb -0.46 -4.19 -0.13 0.00 0.00 0.00 0.00 36.38 31.60 1dki s VAL 27 CO 0.63 0.06 1.62 -0.38 0.00 0.00 0.00 175.10 177.03 1dki n ILE 28 N 4.50 0.07 -0.05 2.22 5.41 0.37 -4.83 119.36 127.06 1dki n ILE 28 Ca 0.05 -0.02 -0.00 0.00 1.00 0.00 0.00 62.75 63.78 1dki n ILE 28 Cb 0.49 -1.70 -0.14 0.00 -0.71 0.00 0.00 39.64 37.58 1dki n ILE 28 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1dki n GLU 29 N 3.51 0.91 -4.21 0.38 1.02 -0.03 -1.09 120.64 121.14 1dki n GLU 29 Ca 0.16 -0.08 -0.12 0.00 -0.02 0.00 0.00 57.16 57.10 1dki n GLU 29 Cb 0.31 -1.43 -0.10 0.00 -0.02 0.00 0.00 31.44 30.20 1dki n GLU 29 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1dki s LYS 30 N -2.81 0.94 -0.03 3.49 1.02 -0.25 -4.90 119.74 117.20 1dki s LYS 30 Ca -0.08 -1.39 -0.14 0.00 0.02 0.00 0.00 55.97 54.38 1dki s LYS 30 Cb 0.08 -0.37 -0.05 0.00 -0.52 0.00 0.00 37.83 36.97 1dki s LYS 30 CO 0.72 0.01 0.38 0.08 -0.92 0.00 0.00 175.35 175.63 1dki s VAL 31 N -3.51 5.10 -0.06 3.17 1.01 -1.26 -4.60 120.40 120.25 1dki s VAL 31 Ca 0.15 0.77 -0.24 0.00 0.00 0.00 0.00 61.98 62.66 1dki s VAL 31 Cb 0.04 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1dki s VAL 31 CO -0.02 0.55 0.73 -0.75 0.00 0.00 0.00 175.10 175.61 1dki s LYS 32 N -0.80 4.45 0.15 2.72 2.20 -1.26 -4.92 119.74 122.28 1dki s LYS 32 Ca 0.23 0.94 -0.34 0.00 -0.36 0.00 0.00 55.97 56.44 1dki s LYS 32 Cb -0.16 -3.45 -0.15 0.00 -1.51 0.00 0.00 37.83 32.56 1dki s LYS 32 CO 0.12 0.05 1.38 -2.30 -0.36 0.00 0.00 175.35 174.24 1dki n PRO 33 N 3.79 1.58 -0.49 4.03 -0.02 -1.26 -0.83 135.00 141.79 1dki n PRO 33 Ca -0.00 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1dki n PRO 33 Cb 0.51 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1dki n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dki n GLY 34 N 2.62 0.93 3.39 -1.23 0.00 -1.26 -5.05 105.19 104.59 1dki n GLY 34 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1dki n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dki s GLU 35 N -0.42 1.42 0.80 1.61 2.12 -0.01 -5.14 118.70 119.08 1dki s GLU 35 Ca 0.00 -1.51 -0.11 0.00 0.36 0.00 0.00 54.97 53.71 1dki s GLU 35 Cb 0.00 -1.57 0.07 0.00 0.26 0.00 0.00 34.13 32.89 1dki s GLU 35 CO 0.00 0.32 1.09 -0.65 -0.54 0.00 0.00 175.26 175.48 1dki s GLN 36 N -2.89 2.08 0.21 4.30 -0.21 -1.26 -4.61 119.66 117.28 1dki s GLN 36 Ca 0.20 0.86 -0.30 0.00 0.02 0.00 0.00 55.36 56.14 1dki s GLN 36 Cb -0.06 -1.90 -0.08 0.00 1.00 0.00 0.00 33.01 31.97 1dki s GLN 36 CO 0.09 -1.68 1.03 0.45 -2.12 0.00 0.00 175.29 173.06 1dki s SER 37 N -3.65 7.43 -0.03 5.90 0.15 -1.26 -4.71 113.70 117.53 1dki s SER 37 Ca 0.61 2.04 0.04 0.00 0.70 0.00 0.00 55.95 59.34 1dki s SER 37 Cb -0.16 -2.61 0.06 0.00 -1.71 0.00 0.00 66.02 61.61 1dki s SER 37 CO 0.55 -0.06 0.98 0.49 1.20 0.00 0.00 173.24 176.41 1dki n PHE 38 N 1.90 0.00 -1.70 3.44 3.01 -1.26 -5.07 117.46 117.79 1dki n PHE 38 Ca 0.00 -0.54 -0.44 0.00 1.01 0.00 0.00 57.45 57.49 1dki n PHE 38 Cb 0.47 -0.07 -0.03 0.00 -0.01 0.00 0.00 39.48 39.84 1dki n PHE 38 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1dki n VAL 39 N -0.63 0.56 0.00 -4.37 0.31 -1.26 -1.25 118.33 111.69 1dki n VAL 39 Ca 0.03 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1dki n VAL 39 Cb 0.38 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 1dki n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dki n GLY 40 N 2.78 1.46 3.88 2.92 0.00 -0.25 -4.99 105.19 110.99 1dki n GLY 40 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1dki n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dki s GLN 41 N -0.70 3.77 0.28 1.61 -0.21 -0.38 -4.83 119.66 119.21 1dki s GLN 41 Ca 0.00 0.21 -0.29 0.00 0.02 0.00 0.00 55.36 55.30 1dki s GLN 41 Cb 0.00 -2.70 -0.09 0.00 1.00 0.00 0.00 33.01 31.22 1dki s GLN 41 CO 0.00 0.35 1.04 -1.01 -2.12 0.00 0.00 175.29 173.55 1dki s HIS 42 N -1.77 3.67 0.80 0.91 3.76 -1.26 -0.48 115.29 120.92 1dki s HIS 42 Ca 0.46 1.76 -0.11 0.00 -0.15 0.00 0.00 55.06 57.02 1dki s HIS 42 Cb -0.11 -3.16 0.08 0.00 1.11 0.00 0.00 32.58 30.50 1dki s HIS 42 CO 0.22 -0.22 1.12 0.00 -0.85 0.00 0.00 174.74 175.01 1dki s ALA 43 N -1.25 2.01 0.66 -1.40 0.00 -0.55 -4.86 121.76 116.37 1dki s ALA 43 Ca 0.45 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 52.72 1dki s ALA 43 Cb -0.28 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1dki s ALA 43 CO 0.36 -2.05 1.18 0.00 0.00 0.00 0.00 175.76 175.25 1dki s ALA 44 N -2.65 2.37 0.35 0.00 0.00 -0.52 -4.78 121.76 116.53 1dki s ALA 44 Ca 0.65 0.83 0.15 0.00 0.00 0.00 0.00 51.96 53.59 1dki s ALA 44 Cb -0.21 -3.42 0.78 0.00 0.00 0.00 0.00 23.12 20.28 1dki s ALA 44 CO 0.54 -1.44 1.83 1.79 0.00 0.00 0.00 175.76 178.48 1dki h THR 45 N 0.23 1.15 0.00 0.00 1.35 -1.62 -3.42 112.91 110.60 1dki h THR 45 Ca -0.48 -1.26 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 1dki h THR 45 Cb 1.28 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 1dki h THR 45 CO 0.53 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 1dki n GLY 46 N -0.37 2.08 0.22 5.82 0.00 -1.26 -4.40 105.19 107.29 1dki n GLY 46 Ca -0.02 -1.52 0.06 0.00 0.00 0.00 0.00 46.02 44.54 1dki n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dki h SER 47 N 0.00 0.00 -0.45 1.61 4.64 -1.90 -1.30 113.55 116.14 1dki h SER 47 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1dki h SER 47 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1dki h SER 47 CO 0.00 0.18 0.10 0.58 -0.87 0.00 0.00 176.83 176.82 1dki h VAL 48 N 0.00 1.24 -0.22 0.95 2.07 -1.85 -0.01 116.25 118.43 1dki h VAL 48 Ca -0.00 -0.85 -0.15 0.00 0.82 0.00 0.00 66.70 66.52 1dki h VAL 48 Cb 0.32 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1dki h VAL 48 CO 0.02 0.30 -0.44 0.00 0.02 0.00 0.00 177.57 177.47 1dki h ALA 49 N 0.96 0.34 -0.47 1.67 0.00 -1.63 -2.36 119.26 117.77 1dki h ALA 49 Ca 0.14 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1dki h ALA 49 Cb 0.34 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1dki h ALA 49 CO 0.00 0.47 0.13 1.15 0.00 0.00 0.00 179.25 181.01 1dki h THR 50 N 0.38 1.23 -0.04 0.00 2.02 -1.17 0.11 112.91 115.44 1dki h THR 50 Ca 0.01 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.40 1dki h THR 50 Cb 1.04 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1dki h THR 50 CO 0.10 0.28 0.02 0.00 0.37 0.00 0.00 175.52 176.30 1dki h ALA 51 N 0.99 0.05 -0.63 6.16 0.00 -1.04 -1.81 119.26 122.98 1dki h ALA 51 Ca 0.15 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1dki h ALA 51 Cb 0.30 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1dki h ALA 51 CO -0.00 -0.45 0.42 1.15 0.00 0.00 0.00 179.25 180.37 1dki h THR 52 N 0.04 1.16 -0.49 0.00 2.02 -1.30 -2.54 112.91 111.81 1dki h THR 52 Ca 0.01 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.86 1dki h THR 52 Cb 0.01 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1dki h THR 52 CO -0.00 0.16 0.13 0.00 0.37 0.00 0.00 175.52 176.17 1dki h ALA 53 N 1.23 1.31 -0.27 6.16 0.00 -0.55 -1.21 119.26 125.94 1dki h ALA 53 Ca 0.23 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1dki h ALA 53 Cb -0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1dki h ALA 53 CO -0.05 0.49 -0.23 1.96 0.00 0.00 0.00 179.25 181.41 1dki h GLN 54 N 0.71 0.50 -0.08 0.00 4.20 -1.05 -0.04 115.11 119.35 1dki h GLN 54 Ca 0.16 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 58.49 1dki h GLN 54 Cb 0.25 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1dki h GLN 54 CO -0.00 0.70 -0.76 0.82 -0.67 0.00 0.00 178.83 178.92 1dki h ILE 55 N 0.45 1.36 -0.45 2.54 2.04 -0.99 -2.27 117.51 120.19 1dki h ILE 55 Ca 0.07 -2.15 -0.11 0.00 1.00 0.00 0.00 64.86 63.67 1dki h ILE 55 Cb 0.65 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.84 1dki h ILE 55 CO 0.05 0.65 -0.16 0.24 0.00 0.00 0.00 178.15 178.93 1dki h MET 56 N 0.31 0.86 -0.69 2.37 2.86 -0.90 -2.51 114.93 117.23 1dki h MET 56 Ca -0.04 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.22 1dki h MET 56 Cb 1.35 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.93 1dki h MET 56 CO 0.14 0.96 0.22 -0.22 1.06 0.00 0.00 176.91 179.06 1dki h LYS 57 N 0.76 1.06 -0.90 1.72 1.63 -0.90 0.23 116.57 120.17 1dki h LYS 57 Ca 0.11 -0.22 0.10 0.00 -0.85 0.00 0.00 60.65 59.80 1dki h LYS 57 Cb 0.69 -0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 32.09 1dki h LYS 57 CO 0.05 0.90 0.58 -0.92 -3.45 0.00 0.00 179.45 176.61 1dki h TYR 58 N 1.02 0.97 0.00 1.91 3.20 -0.97 -1.13 116.97 121.97 1dki h TYR 58 Ca 0.22 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1dki h TYR 58 Cb 0.28 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.24 1dki h TYR 58 CO 0.02 0.44 -0.78 0.72 -1.64 0.00 0.00 178.16 176.92 1dki n HIS 59 N -4.53 0.35 -3.76 -3.82 8.25 -0.92 -4.98 115.22 105.80 1dki n HIS 59 Ca 0.15 0.10 -0.29 0.00 -0.26 0.00 0.00 57.72 57.43 1dki n HIS 59 Cb 0.31 -0.50 0.02 0.00 1.12 0.00 0.00 29.99 30.95 1dki n HIS 59 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1dki n ASN 60 N -1.95 -3.41 -3.73 0.41 3.02 0.77 -4.98 115.26 105.38 1dki n ASN 60 Ca 0.03 -0.99 -0.14 0.00 -0.03 0.00 0.00 54.58 53.45 1dki n ASN 60 Cb 0.42 -3.37 -0.09 0.00 -0.61 0.00 0.00 39.78 36.13 1dki n ASN 60 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1dki s TYR 61 N -3.63 -0.29 0.59 3.10 5.04 -1.16 -4.68 117.35 116.33 1dki s TYR 61 Ca 0.29 0.53 -0.04 0.00 -2.44 0.00 0.00 57.07 55.41 1dki s TYR 61 Cb -0.10 0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.37 1dki s TYR 61 CO 0.86 -0.37 0.87 -1.25 -1.34 0.00 0.00 175.55 174.33 1dki s PRO 62 N -0.96 2.73 0.16 4.97 0.04 -1.26 -4.78 135.00 135.90 1dki s PRO 62 Ca -0.10 -0.24 0.18 0.00 0.04 0.00 0.00 61.00 60.87 1dki s PRO 62 Cb -0.04 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 1dki s PRO 62 CO 0.04 -0.75 1.06 -0.91 0.04 0.00 0.00 177.00 176.48 1dki h ASN 63 N -0.15 0.00 -3.36 6.66 4.21 -1.83 -3.41 115.58 117.70 1dki h ASN 63 Ca -0.45 0.00 -0.51 0.00 1.21 0.00 0.00 56.30 56.55 1dki h ASN 63 Cb 1.27 0.00 -0.34 0.00 -1.12 0.00 0.00 38.32 38.13 1dki h ASN 63 CO 0.59 0.43 -0.81 -0.75 -1.29 0.00 0.00 177.43 175.60 1dki s LYS 64 N -3.03 1.58 0.60 0.81 2.20 -1.26 -0.64 119.74 120.00 1dki s LYS 64 Ca -0.00 -0.34 -0.18 0.00 -0.36 0.00 0.00 55.97 55.08 1dki s LYS 64 Cb 0.08 -1.40 -0.03 0.00 -1.51 0.00 0.00 37.83 34.98 1dki s LYS 64 CO 0.78 -0.06 1.19 0.20 -0.36 0.00 0.00 175.35 177.11 1dki s GLY 65 N 0.95 2.64 -0.26 5.54 0.00 0.56 -4.88 107.32 111.87 1dki s GLY 65 Ca -0.09 0.94 -0.13 0.00 0.00 0.00 0.00 44.72 45.43 1dki s GLY 65 CO 0.00 1.32 -0.23 1.04 0.00 0.00 0.00 173.10 175.24 1dki n LEU 66 N -1.72 2.08 -3.80 0.66 4.77 -0.16 -4.46 117.00 114.36 1dki n LEU 66 Ca 0.13 0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 56.28 1dki n LEU 66 Cb 0.50 -0.86 -0.11 0.00 -2.33 0.00 0.00 43.42 40.62 1dki n LEU 66 CO 0.45 0.58 -0.09 -0.75 -1.33 0.00 0.00 177.39 176.24 1dki s LYS 67 N -2.49 0.38 0.89 3.23 2.20 -1.15 -4.52 119.74 118.27 1dki s LYS 67 Ca -0.36 0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 55.26 1dki s LYS 67 Cb 0.13 0.17 0.13 0.00 -1.51 0.00 0.00 37.83 36.75 1dki s LYS 67 CO 0.53 -0.07 1.09 -0.51 -0.36 0.00 0.00 175.35 176.03 1dki s ASP 68 N -0.36 3.50 0.01 1.43 1.01 -1.26 -4.02 116.67 116.97 1dki s ASP 68 Ca -0.05 1.51 -0.05 0.00 0.71 0.00 0.00 52.55 54.68 1dki s ASP 68 Cb -0.03 -2.19 -0.01 0.00 1.01 0.00 0.00 42.92 41.70 1dki s ASP 68 CO 0.01 -2.63 0.08 -0.47 0.21 0.00 0.00 175.17 172.37 1dki s TYR 69 N -2.92 0.11 -0.08 4.23 5.04 -0.99 -4.93 117.35 117.81 1dki s TYR 69 Ca 0.63 -0.24 -0.20 0.00 -2.44 0.00 0.00 57.07 54.82 1dki s TYR 69 Cb -0.18 -0.09 0.04 0.00 0.35 0.00 0.00 41.96 42.08 1dki s TYR 69 CO 0.57 -0.24 0.47 -0.08 -1.34 0.00 0.00 175.55 174.93 1dki s THR 70 N -1.31 0.02 0.21 4.34 -1.32 -1.26 -1.64 115.64 114.68 1dki s THR 70 Ca -0.14 -0.19 -0.16 0.00 -1.21 0.00 0.00 61.69 60.00 1dki s THR 70 Cb -0.08 -0.74 0.01 0.00 -1.51 0.00 0.00 72.50 70.19 1dki s THR 70 CO 0.01 -0.10 0.50 -0.72 -2.21 0.00 0.00 174.62 172.09 1dki s TYR 71 N -0.73 0.05 -0.20 9.09 -0.85 -0.73 -4.99 117.35 118.99 1dki s TYR 71 Ca -0.08 -0.41 -0.09 0.00 -0.52 0.00 0.00 57.07 55.97 1dki s TYR 71 Cb -0.03 0.32 -0.05 0.00 0.38 0.00 0.00 41.96 42.58 1dki s TYR 71 CO 0.04 -0.94 0.10 0.99 -1.52 0.00 0.00 175.55 174.23 1dki s THR 72 N -3.92 5.08 0.49 -3.49 2.01 -1.26 -0.60 115.64 113.95 1dki s THR 72 Ca 0.13 0.07 -0.23 0.00 0.31 0.00 0.00 61.69 61.98 1dki s THR 72 Cb -0.01 -3.32 -0.07 0.00 0.01 0.00 0.00 72.50 69.12 1dki s THR 72 CO 0.01 0.44 1.31 -0.22 -0.69 0.00 0.00 174.62 175.47 1dki s LEU 73 N 0.49 3.99 0.22 4.42 2.96 0.14 -4.89 118.68 126.01 1dki s LEU 73 Ca 0.06 2.65 -0.32 0.00 -0.22 0.00 0.00 54.13 56.30 1dki s LEU 73 Cb -0.12 -4.15 -0.14 0.00 0.50 0.00 0.00 46.19 42.27 1dki s LEU 73 CO -0.00 -1.23 1.30 -0.24 -1.32 0.00 0.00 176.35 174.85 1dki n SER 74 N -0.58 2.17 0.29 3.68 2.88 -1.26 -4.72 113.62 116.09 1dki n SER 74 Ca 0.08 1.15 0.15 0.00 -1.33 0.00 0.00 58.87 58.91 1dki n SER 74 Cb 0.45 -1.35 0.90 0.00 -0.75 0.00 0.00 64.21 63.47 1dki n SER 74 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1dki h SER 75 N 3.75 0.00 -0.25 -3.46 4.64 -1.99 -2.14 113.55 114.11 1dki h SER 75 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1dki h SER 75 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1dki h SER 75 CO 0.73 0.02 0.00 -0.46 -0.87 0.00 0.00 176.83 176.24 1dki n ASN 76 N -3.81 2.15 -4.65 4.97 0.23 -1.26 -4.88 115.26 108.00 1dki n ASN 76 Ca -0.03 -1.81 -0.42 0.00 -0.53 0.00 0.00 54.58 51.78 1dki n ASN 76 Cb 0.10 -0.16 -0.03 0.00 -2.08 0.00 0.00 39.78 37.61 1dki n ASN 76 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1dki s ASN 77 N -1.48 6.58 0.00 0.53 3.84 -0.81 -4.86 114.94 118.74 1dki s ASN 77 Ca 0.33 2.20 0.30 0.00 0.21 0.00 0.00 52.86 55.90 1dki s ASN 77 Cb 0.18 -2.53 1.45 0.00 -0.55 0.00 0.00 41.25 39.80 1dki s ASN 77 CO 0.26 -1.00 1.97 -0.81 -2.79 0.00 0.00 177.10 174.73 1dki n PRO 78 N 7.27 1.34 0.01 0.43 -0.04 -1.26 -4.01 135.00 138.73 1dki n PRO 78 Ca 0.18 -0.49 0.11 0.00 -0.04 0.00 0.00 63.50 63.26 1dki n PRO 78 Cb 0.43 -1.48 0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1dki n PRO 78 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1dki n TYR 79 N -0.40 0.06 -4.17 0.54 4.02 -1.26 -4.55 117.16 111.39 1dki n TYR 79 Ca 0.21 0.02 -0.14 0.00 -0.01 0.00 0.00 57.90 57.98 1dki n TYR 79 Cb 0.23 -0.20 -0.11 0.00 -0.02 0.00 0.00 39.34 39.25 1dki n TYR 79 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1dki s PHE 80 N -3.05 1.05 0.38 -0.72 0.40 -1.26 -0.86 117.98 113.93 1dki s PHE 80 Ca 0.08 -0.66 -0.24 0.00 -0.60 0.00 0.00 56.93 55.51 1dki s PHE 80 Cb 0.16 -0.57 -0.10 0.00 0.51 0.00 0.00 43.02 43.02 1dki s PHE 80 CO 0.79 -0.01 1.00 -0.80 0.70 0.00 0.00 175.22 176.91 1dki s ASN 81 N -2.43 6.94 0.12 1.36 0.01 -1.26 -4.95 114.94 114.72 1dki s ASN 81 Ca 0.05 1.92 0.08 0.00 -0.71 0.00 0.00 52.86 54.21 1dki s ASN 81 Cb -0.03 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1dki s ASN 81 CO -0.00 -0.36 -0.14 -1.00 -1.51 0.00 0.00 177.10 174.09 1dki s HIS 82 N -1.74 2.62 0.65 2.20 3.76 -1.26 -4.12 115.29 117.40 1dki s HIS 82 Ca 0.57 -0.22 -0.13 0.00 -0.15 0.00 0.00 55.06 55.13 1dki s HIS 82 Cb -0.19 -1.37 -0.01 0.00 1.11 0.00 0.00 32.58 32.12 1dki s HIS 82 CO 0.24 0.41 1.06 -1.25 -0.85 0.00 0.00 174.74 174.35 1dki s PRO 83 N -2.23 3.08 -0.17 8.40 0.04 -1.26 -5.18 135.00 137.68 1dki s PRO 83 Ca 0.20 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 1dki s PRO 83 Cb -0.11 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.49 1dki s PRO 83 CO 0.12 -0.99 0.12 0.21 0.04 0.00 0.00 177.00 176.50 1dki s LYS 84 N -4.63 0.08 -0.12 4.56 2.47 -1.26 -5.07 119.74 115.77 1dki s LYS 84 Ca 0.60 0.05 -0.03 0.00 -1.56 0.00 0.00 55.97 55.04 1dki s LYS 84 Cb -0.15 -1.51 -0.03 0.00 -1.46 0.00 0.00 37.83 34.68 1dki s LYS 84 CO 0.47 -0.63 -0.01 -0.80 0.16 0.00 0.00 175.35 174.55 1dki s ASN 85 N 2.20 5.13 -0.03 1.43 0.01 -1.26 0.28 114.94 122.69 1dki s ASN 85 Ca 0.03 0.05 0.05 0.00 -0.71 0.00 0.00 52.86 52.28 1dki s ASN 85 Cb -0.15 -1.61 -0.03 0.00 0.41 0.00 0.00 41.25 39.87 1dki s ASN 85 CO -0.09 0.29 -0.16 -0.76 -1.51 0.00 0.00 177.10 174.87 1dki s LEU 86 N -0.35 2.65 -0.02 0.60 1.02 0.23 -4.96 118.68 117.85 1dki s LEU 86 Ca 0.07 -0.27 0.02 0.00 0.02 0.00 0.00 54.13 53.96 1dki s LEU 86 Cb -0.12 -1.53 0.01 0.00 0.02 0.00 0.00 46.19 44.56 1dki s LEU 86 CO 0.02 0.32 -0.06 0.12 0.02 0.00 0.00 176.35 176.78 1dki s PHE 87 N -0.77 0.65 -0.13 0.29 5.36 -1.26 -1.78 117.98 120.35 1dki s PHE 87 Ca 0.12 -0.14 0.01 0.00 -0.96 0.00 0.00 56.93 55.96 1dki s PHE 87 Cb -0.11 -0.49 0.02 0.00 -0.34 0.00 0.00 43.02 42.10 1dki s PHE 87 CO 0.01 -0.08 -0.15 0.00 -1.46 0.00 0.00 175.22 173.54 1dki s ALA 88 N 0.26 1.83 -1.14 11.12 0.00 -0.65 -5.03 121.76 128.15 1dki s ALA 88 Ca -0.03 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.01 1dki s ALA 88 Cb -0.07 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 22.06 1dki s ALA 88 CO -0.00 -0.23 2.82 0.00 0.00 0.00 0.00 175.76 178.35 1dki n ALA 89 N 4.49 6.99 -0.16 0.00 0.00 -1.26 -2.34 120.51 128.23 1dki n ALA 89 Ca -0.18 -3.43 0.09 0.00 0.00 0.00 0.00 53.44 49.92 1dki n ALA 89 Cb 0.51 -2.85 0.40 0.00 0.00 0.00 0.00 19.45 17.51 1dki n ALA 89 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1dki h ILE 90 N 2.58 0.96 0.00 0.00 2.04 -1.92 -1.76 117.51 119.42 1dki h ILE 90 Ca 0.66 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 66.30 1dki h ILE 90 Cb 0.52 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1dki h ILE 90 CO 1.34 0.12 0.01 0.77 0.00 0.00 0.00 178.15 180.39 1dki h SER 91 N 0.64 0.00 -0.60 1.72 4.64 -1.78 -1.28 113.55 116.89 1dki h SER 91 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1dki h SER 91 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1dki h SER 91 CO -0.11 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.20 1dki n THR 92 N -2.89 0.81 -3.14 2.95 -2.24 -0.66 -4.65 114.28 104.45 1dki n THR 92 Ca -0.03 -0.90 -0.39 0.00 -2.27 0.00 0.00 64.05 60.46 1dki n THR 92 Cb 0.07 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 68.94 1dki n THR 92 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dki s ARG 93 N -1.19 4.36 -0.55 -0.78 1.81 -0.48 -4.93 118.95 117.19 1dki s ARG 93 Ca 0.45 0.84 0.04 0.00 -1.72 0.00 0.00 55.73 55.34 1dki s ARG 93 Cb 0.25 -3.33 0.14 0.00 -0.45 0.00 0.00 34.95 31.55 1dki s ARG 93 CO 0.33 0.38 0.30 -0.65 -0.68 0.00 0.00 175.30 174.98 1dki s GLN 94 N -0.30 2.04 -0.06 3.54 -1.52 -1.26 -0.33 119.66 121.77 1dki s GLN 94 Ca 0.33 -2.73 -0.30 0.00 -1.95 0.00 0.00 55.36 50.71 1dki s GLN 94 Cb -0.19 -3.29 -0.04 0.00 -0.22 0.00 0.00 33.01 29.26 1dki s GLN 94 CO 0.19 -1.14 1.46 0.71 -0.25 0.00 0.00 175.29 176.26 1dki s TYR 95 N -0.48 2.52 -0.59 0.91 1.51 0.18 -4.97 117.35 116.43 1dki s TYR 95 Ca 0.18 0.63 -0.18 0.00 -1.01 0.00 0.00 57.07 56.70 1dki s TYR 95 Cb -0.22 -3.72 0.11 0.00 -0.11 0.00 0.00 41.96 38.03 1dki s TYR 95 CO -0.03 -2.79 0.66 1.21 -1.11 0.00 0.00 175.55 173.50 1dki s ASN 96 N 2.45 6.21 0.00 2.29 3.84 -1.26 -4.68 114.94 123.79 1dki s ASN 96 Ca 0.65 -1.57 0.09 0.00 0.21 0.00 0.00 52.86 52.24 1dki s ASN 96 Cb -0.30 -2.28 0.42 0.00 -0.55 0.00 0.00 41.25 38.55 1dki s ASN 96 CO 0.25 -1.04 1.26 0.79 -2.79 0.00 0.00 177.10 175.57 1dki n TRP 97 N 6.00 0.00 0.13 0.43 7.02 -1.26 -0.86 117.44 128.90 1dki n TRP 97 Ca -0.09 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.41 1dki n TRP 97 Cb 0.42 -0.43 0.02 0.00 -2.42 0.00 0.00 31.31 28.90 1dki n TRP 97 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1dki h ASN 98 N 0.00 0.00 0.94 -0.99 4.21 -2.01 -3.28 115.58 114.44 1dki h ASN 98 Ca 0.00 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.41 1dki h ASN 98 Cb 0.14 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.32 1dki h ASN 98 CO 0.00 0.48 -1.12 0.78 -1.29 0.00 0.00 177.43 176.27 1dki h ASN 99 N 0.00 0.00 -2.30 5.81 2.35 -1.38 -3.41 115.58 116.65 1dki h ASN 99 Ca -0.02 0.00 -0.66 0.00 -0.55 0.00 0.00 56.30 55.07 1dki h ASN 99 Cb 1.38 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 39.60 1dki h ASN 99 CO 0.06 0.37 0.84 -0.63 -1.65 0.00 0.00 177.43 176.42 1dki s ILE 100 N -3.08 4.50 0.77 2.81 1.01 -0.89 -4.39 121.20 121.93 1dki s ILE 100 Ca -0.01 -1.12 -0.11 0.00 0.00 0.00 0.00 60.65 59.41 1dki s ILE 100 Cb 0.09 -4.79 0.06 0.00 0.01 0.00 0.00 42.46 37.82 1dki s ILE 100 CO 0.79 -1.55 1.09 -0.76 0.00 0.00 0.00 174.94 174.51 1dki s LEU 101 N 3.39 3.05 0.49 2.97 1.43 -1.26 -4.88 118.68 123.88 1dki s LEU 101 Ca 0.32 1.85 0.28 0.00 -1.03 0.00 0.00 54.13 55.54 1dki s LEU 101 Cb -0.07 -4.53 1.20 0.00 0.03 0.00 0.00 46.19 42.82 1dki s LEU 101 CO -0.04 -2.05 1.94 1.55 0.23 0.00 0.00 176.35 177.99 1dki h PRO 102 N -1.07 0.00 -2.43 1.29 0.13 -1.88 -3.45 132.00 124.59 1dki h PRO 102 Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1dki h PRO 102 Cb 1.23 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.21 1dki h PRO 102 CO 0.51 0.14 0.29 -0.08 -0.23 0.00 0.00 178.00 178.63 1dki s THR 103 N -3.80 0.00 -0.02 1.56 -1.32 -1.26 -0.95 115.64 109.84 1dki s THR 103 Ca -0.00 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.55 1dki s THR 103 Cb 0.11 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 70.08 1dki s THR 103 CO 0.59 0.00 -0.25 -0.31 -2.21 0.00 0.00 174.62 172.44 1dki s TYR 104 N -2.60 2.28 -0.09 9.09 1.51 -1.26 -5.00 117.35 121.28 1dki s TYR 104 Ca -0.02 -0.46 0.21 0.00 -1.01 0.00 0.00 57.07 55.79 1dki s TYR 104 Cb -0.01 -1.47 -0.25 0.00 -0.11 0.00 0.00 41.96 40.12 1dki s TYR 104 CO -0.04 -0.06 0.57 -1.13 -1.11 0.00 0.00 175.55 173.78 1dki n SER 105 N 2.51 0.22 0.00 2.29 3.41 -1.26 -4.98 113.62 115.81 1dki n SER 105 Ca -0.16 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1dki n SER 105 Cb 0.51 1.48 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 1dki n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dki n GLY 106 N 1.30 0.33 0.84 5.00 0.00 -1.26 -4.94 105.19 106.47 1dki n GLY 106 Ca -0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.07 1dki n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dki n ARG 107 N -1.73 2.13 -1.44 1.61 1.74 -1.26 -4.99 116.66 112.71 1dki n ARG 107 Ca 0.00 -1.67 -0.32 0.00 -0.77 0.00 0.00 57.85 55.09 1dki n ARG 107 Cb 0.00 -1.46 0.07 0.00 -1.02 0.00 0.00 32.46 30.05 1dki n ARG 107 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1dki s GLU 108 N -1.78 2.48 0.97 5.56 8.01 -1.26 -5.05 118.70 127.64 1dki s GLU 108 Ca 0.34 1.23 -0.15 0.00 0.01 0.00 0.00 54.97 56.40 1dki s GLU 108 Cb 0.20 -1.92 0.18 0.00 -4.31 0.00 0.00 34.13 28.28 1dki s GLU 108 CO 0.30 -1.48 1.19 -1.54 0.01 0.00 0.00 175.26 173.74 1dki s SER 109 N -3.15 2.99 0.38 -0.19 1.04 -1.26 -4.79 113.70 108.72 1dki s SER 109 Ca 0.63 0.70 0.07 0.00 0.48 0.00 0.00 55.95 57.83 1dki s SER 109 Cb -0.18 -1.06 0.81 0.00 0.10 0.00 0.00 66.02 65.69 1dki s SER 109 CO 0.51 -2.85 1.97 0.78 0.98 0.00 0.00 173.24 174.63 1dki h ASN 110 N -1.71 0.59 -0.16 7.02 2.35 -1.98 -1.77 115.58 119.93 1dki h ASN 110 Ca -0.47 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.32 1dki h ASN 110 Cb 1.30 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 39.51 1dki h ASN 110 CO 0.51 0.38 -0.08 0.58 -1.65 0.00 0.00 177.43 177.16 1dki h VAL 111 N 0.67 0.74 0.02 2.81 2.07 -1.98 0.24 116.25 120.82 1dki h VAL 111 Ca 0.29 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 67.59 1dki h VAL 111 Cb 0.29 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1dki h VAL 111 CO -0.09 0.00 -0.96 1.56 0.02 0.00 0.00 177.57 178.10 1dki h GLN 112 N -0.07 0.32 -0.38 1.57 7.50 -1.71 -2.66 115.11 119.69 1dki h GLN 112 Ca 0.09 -0.37 -0.15 0.00 0.50 0.00 0.00 58.65 58.72 1dki h GLN 112 Cb 0.20 0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.84 1dki h GLN 112 CO -0.20 1.07 -0.37 0.87 -1.50 0.00 0.00 178.83 178.69 1dki h LYS 113 N 0.17 0.90 -0.32 1.46 1.57 -1.14 -2.47 116.57 116.74 1dki h LYS 113 Ca -0.07 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.14 1dki h LYS 113 Cb 1.61 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.91 1dki h LYS 113 CO 0.16 1.11 -0.22 1.98 -0.57 0.00 0.00 179.45 181.91 1dki h MET 114 N 0.74 0.62 0.26 3.15 4.05 -0.59 -2.02 114.93 121.14 1dki h MET 114 Ca 0.06 -0.23 -0.01 0.00 -0.28 0.00 0.00 59.70 59.24 1dki h MET 114 Cb 0.96 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.71 1dki h MET 114 CO 0.09 0.79 -0.18 0.00 0.23 0.00 0.00 176.91 177.84 1dki h ALA 115 N 1.21 -0.42 -0.29 0.39 0.00 -1.22 -0.35 119.26 118.58 1dki h ALA 115 Ca 0.08 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1dki h ALA 115 Cb 0.68 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1dki h ALA 115 CO 0.05 -0.75 -0.41 0.97 0.00 0.00 0.00 179.25 179.11 1dki h ILE 116 N -0.44 1.29 -0.07 0.00 6.09 -1.42 -2.77 117.51 120.19 1dki h ILE 116 Ca -0.02 -1.59 -0.14 0.00 -1.37 0.00 0.00 64.86 61.74 1dki h ILE 116 Cb 0.38 1.51 -0.01 0.00 0.47 0.00 0.00 36.82 39.16 1dki h ILE 116 CO 0.01 0.51 -0.58 0.77 -3.07 0.00 0.00 178.15 175.79 1dki h SER 117 N 0.58 0.25 -0.48 2.19 4.64 -1.27 -0.86 113.55 118.60 1dki h SER 117 Ca 0.05 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.17 1dki h SER 117 Cb 0.96 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.95 1dki h SER 117 CO 0.09 0.78 0.11 -0.08 -0.87 0.00 0.00 176.83 176.85 1dki h GLU 118 N 0.17 0.78 -0.18 4.77 4.81 -1.05 -0.37 114.58 123.50 1dki h GLU 118 Ca -0.00 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.03 1dki h GLU 118 Cb 1.07 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1dki h GLU 118 CO 0.09 0.77 0.08 1.25 -0.73 0.00 0.00 179.01 180.46 1dki h LEU 119 N 0.66 0.24 -1.11 1.64 5.85 -1.18 -0.10 115.31 121.31 1dki h LEU 119 Ca 0.15 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1dki h LEU 119 Cb 0.35 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1dki h LEU 119 CO 0.00 0.32 0.60 0.24 -0.34 0.00 0.00 178.44 179.26 1dki h MET 120 N 0.15 1.17 -0.23 1.25 2.86 -1.05 -0.00 114.93 119.08 1dki h MET 120 Ca 0.06 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.47 1dki h MET 120 Cb 0.15 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 1dki h MET 120 CO -0.01 0.78 -0.51 0.00 1.06 0.00 0.00 176.91 178.23 1dki h ALA 121 N 1.44 0.66 -0.18 6.32 0.00 -0.76 -1.36 119.26 125.39 1dki h ALA 121 Ca 0.34 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1dki h ALA 121 Cb -0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1dki h ALA 121 CO -0.08 0.68 -0.11 -0.44 0.00 0.00 0.00 179.25 179.30 1dki h ASP 122 N 0.51 0.41 -0.41 0.00 3.32 -0.57 -2.01 116.42 117.67 1dki h ASP 122 Ca 0.02 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.62 1dki h ASP 122 Cb 1.07 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 1dki h ASP 122 CO 0.10 0.75 0.19 0.58 -1.72 0.00 0.00 179.24 179.14 1dki h VAL 123 N 0.07 1.19 -0.75 -1.35 2.07 -1.02 -0.92 116.25 115.53 1dki h VAL 123 Ca 0.04 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 1dki h VAL 123 Cb 0.61 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 1dki h VAL 123 CO 0.03 0.20 0.46 1.23 0.02 0.00 0.00 177.57 179.52 1dki h GLY 124 N 0.53 1.08 1.12 2.17 0.00 -1.24 -2.14 103.07 104.59 1dki h GLY 124 Ca 0.14 -0.44 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 1dki h GLY 124 CO -0.02 0.42 -0.18 -2.22 0.00 0.00 0.00 176.54 174.55 1dki h ILE 125 N 1.02 1.27 0.00 2.60 2.04 -1.19 -1.81 117.51 121.44 1dki h ILE 125 Ca 0.27 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.79 1dki h ILE 125 Cb -0.06 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1dki h ILE 125 CO -0.05 0.47 0.00 0.77 0.00 0.00 0.00 178.15 179.33 1dki h SER 126 N 0.88 0.00 -0.24 1.72 4.64 -0.52 -1.74 113.55 118.28 1dki h SER 126 Ca 0.12 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.35 1dki h SER 126 Cb 0.75 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.79 1dki h SER 126 CO 0.06 0.00 -0.11 1.33 -0.87 0.00 0.00 176.83 177.25 1dki n VAL 127 N -2.53 2.36 -3.93 0.95 0.24 -1.00 -4.70 118.33 109.73 1dki n VAL 127 Ca -0.01 -2.55 -0.25 0.00 -2.04 0.00 0.00 64.34 59.48 1dki n VAL 127 Cb 0.10 -0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 32.17 1dki n VAL 127 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1dki n ASP 128 N -1.02 -0.51 -4.73 -1.34 10.43 -0.66 -4.52 116.55 114.20 1dki n ASP 128 Ca 0.26 -1.00 -0.42 0.00 2.57 0.00 0.00 54.79 56.21 1dki n ASP 128 Cb 0.91 -3.10 -0.03 0.00 1.84 0.00 0.00 41.12 40.74 1dki n ASP 128 CO 0.00 0.00 0.00 -0.32 -1.07 0.00 0.00 177.20 175.81 1dki s MET 129 N -6.51 4.12 -0.77 -1.24 1.75 -0.71 -4.79 119.30 111.16 1dki s MET 129 Ca 0.02 2.60 -0.17 0.00 -1.25 0.00 0.00 55.69 56.89 1dki s MET 129 Cb -0.01 -3.07 0.16 0.00 2.84 0.00 0.00 34.83 34.76 1dki s MET 129 CO 0.88 -0.73 0.82 0.34 -0.65 0.00 0.00 175.02 175.69 1dki s ASP 130 N 1.05 6.54 0.40 1.11 2.15 0.82 -4.94 116.67 123.80 1dki s ASP 130 Ca 0.72 -2.15 -0.25 0.00 0.43 0.00 0.00 52.55 51.30 1dki s ASP 130 Cb -0.49 -2.28 -0.08 0.00 -0.30 0.00 0.00 42.92 39.76 1dki s ASP 130 CO 0.35 -0.85 1.17 -0.31 -0.17 0.00 0.00 175.17 175.36 1dki s TYR 131 N 1.52 3.06 0.00 -5.34 1.51 -1.26 -1.98 117.35 114.85 1dki s TYR 131 Ca 0.19 1.55 0.00 0.00 -1.01 0.00 0.00 57.07 57.80 1dki s TYR 131 Cb -0.14 -3.39 0.00 0.00 -0.11 0.00 0.00 41.96 38.32 1dki s TYR 131 CO -0.04 -1.32 0.00 0.41 -1.11 0.00 0.00 175.55 173.48 1dki n GLY 132 N 0.61 0.99 0.36 0.71 0.00 -1.26 -4.82 105.19 101.78 1dki n GLY 132 Ca 0.04 -0.78 0.07 0.00 0.00 0.00 0.00 46.02 45.35 1dki n GLY 132 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dki h PRO 133 N 0.00 0.73 -6.83 1.61 0.11 -1.95 -1.37 132.00 124.31 1dki h PRO 133 Ca 0.00 -0.04 -0.69 0.00 0.11 0.00 0.00 66.00 65.38 1dki h PRO 133 Cb 0.00 -0.16 -0.24 0.00 0.11 0.00 0.00 31.00 30.71 1dki h PRO 133 CO 0.00 0.48 -0.87 -1.54 -0.21 0.00 0.00 178.00 175.86 1dki s SER 134 N -6.13 3.24 -0.04 -2.05 1.04 -1.26 -4.16 113.70 104.34 1dki s SER 134 Ca -0.10 -0.69 0.04 0.00 0.48 0.00 0.00 55.95 55.68 1dki s SER 134 Cb 0.20 -0.24 -0.00 0.00 0.10 0.00 0.00 66.02 66.07 1dki s SER 134 CO 0.78 0.21 -0.16 -0.44 0.98 0.00 0.00 173.24 174.60 1dki s SER 135 N -1.74 2.06 0.09 7.02 0.01 -1.26 -4.81 113.70 115.08 1dki s SER 135 Ca 0.13 -0.34 0.09 0.00 1.31 0.00 0.00 55.95 57.14 1dki s SER 135 Cb -0.10 -0.61 -0.03 0.00 0.21 0.00 0.00 66.02 65.49 1dki s SER 135 CO 0.04 0.14 -0.22 -0.83 0.41 0.00 0.00 173.24 172.78 1dki s GLY 136 N 0.11 1.30 0.02 3.44 0.00 -0.84 -4.17 107.32 107.17 1dki s GLY 136 Ca -0.05 -1.26 -0.03 0.00 0.00 0.00 0.00 44.72 43.39 1dki s GLY 136 CO 0.02 -1.23 0.04 -0.45 0.00 0.00 0.00 173.10 171.48 1dki s SER 137 N -1.75 0.17 0.60 1.64 0.15 -1.26 -0.12 113.70 113.12 1dki s SER 137 Ca 0.08 -0.41 0.31 0.00 0.70 0.00 0.00 55.95 56.63 1dki s SER 137 Cb -0.10 0.15 1.80 0.00 -1.71 0.00 0.00 66.02 66.16 1dki s SER 137 CO 0.04 -0.35 2.19 0.00 1.20 0.00 0.00 173.24 176.32 1dki h ALA 138 N 4.41 1.60 0.00 5.45 0.00 -1.88 0.16 119.26 129.00 1dki h ALA 138 Ca -0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1dki h ALA 138 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1dki h ALA 138 CO 0.42 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.93 1dki n GLY 139 N -1.33 1.21 0.30 0.00 0.00 -1.26 -3.89 105.19 100.21 1dki n GLY 139 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1dki n GLY 139 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dki n SER 140 N 5.27 -0.47 0.04 1.61 7.64 -1.26 -0.01 113.62 126.43 1dki n SER 140 Ca 0.00 1.35 0.04 0.00 1.01 0.00 0.00 58.87 61.27 1dki n SER 140 Cb 0.00 -0.32 0.45 0.00 -1.01 0.00 0.00 64.21 63.32 1dki n SER 140 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1dki h SER 141 N 0.00 0.40 0.33 6.43 4.64 -1.97 -0.75 113.55 122.64 1dki h SER 141 Ca 0.28 -0.01 -0.33 0.00 -0.47 0.00 0.00 61.79 61.26 1dki h SER 141 Cb 0.48 -0.10 0.02 0.00 -0.31 0.00 0.00 62.40 62.49 1dki h SER 141 CO -0.77 0.31 -1.52 0.03 -0.87 0.00 0.00 176.83 174.00 1dki h ARG 142 N 0.47 0.43 -0.16 4.77 2.47 -0.76 -3.30 114.38 118.30 1dki h ARG 142 Ca 0.13 -0.73 -0.01 0.00 -1.26 0.00 0.00 59.98 58.11 1dki h ARG 142 Cb -0.03 0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1dki h ARG 142 CO -0.03 1.34 0.06 0.28 0.56 0.00 0.00 179.97 182.18 1dki h VAL 143 N 0.12 1.16 -0.87 2.04 2.07 -0.38 -0.13 116.25 120.25 1dki h VAL 143 Ca -0.26 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1dki h VAL 143 Cb 2.11 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 33.02 1dki h VAL 143 CO 0.23 0.15 0.47 0.06 0.02 0.00 0.00 177.57 178.50 1dki h GLN 144 N 0.10 1.22 -0.20 1.57 -0.00 -1.30 -1.27 115.11 115.22 1dki h GLN 144 Ca 0.05 -0.15 -0.03 0.00 -0.00 0.00 0.00 58.65 58.52 1dki h GLN 144 Cb 0.18 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.48 27.42 1dki h GLN 144 CO -0.00 0.90 0.01 -0.09 -0.00 0.00 0.00 178.83 179.65 1dki h ARG 145 N 1.22 0.35 -0.36 0.06 2.43 -1.60 -3.09 114.38 113.39 1dki h ARG 145 Ca 0.31 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1dki h ARG 145 Cb 0.04 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1dki h ARG 145 CO -0.05 0.53 0.19 0.00 -1.51 0.00 0.00 179.97 179.13 1dki h ALA 146 N 0.81 0.47 -0.92 2.80 0.00 -0.80 -0.27 119.26 121.35 1dki h ALA 146 Ca 0.06 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1dki h ALA 146 Cb 0.36 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 1dki h ALA 146 CO 0.01 0.00 0.59 -0.07 0.00 0.00 0.00 179.25 179.78 1dki h LEU 147 N 0.46 0.75 0.00 0.00 3.38 -1.24 0.18 115.31 118.84 1dki h LEU 147 Ca 0.13 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1dki h LEU 147 Cb 0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1dki h LEU 147 CO -0.02 0.39 -0.40 0.11 0.09 0.00 0.00 178.44 178.61 1dki h LYS 148 N 0.80 0.00 -0.21 1.13 1.57 -1.42 0.21 116.57 118.64 1dki h LYS 148 Ca 0.46 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 59.05 1dki h LYS 148 Cb 0.61 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 1dki h LYS 148 CO -0.22 0.49 -0.60 0.93 -0.57 0.00 0.00 179.45 179.47 1dki h GLU 149 N -1.00 0.72 0.00 3.15 5.08 -1.05 -2.24 114.58 119.25 1dki h GLU 149 Ca -0.08 -0.49 -0.37 0.00 -1.00 0.00 0.00 59.36 57.42 1dki h GLU 149 Cb 0.67 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.93 1dki h GLU 149 CO -0.05 1.11 -2.38 0.09 -1.00 0.00 0.00 179.01 176.78 1dki n ASN 150 N -3.96 0.77 -0.62 1.42 4.13 -0.03 -3.90 115.26 113.07 1dki n ASN 150 Ca -0.04 -0.03 0.06 0.00 1.68 0.00 0.00 54.58 56.25 1dki n ASN 150 Cb 0.65 0.43 0.11 0.00 -1.54 0.00 0.00 39.78 39.43 1dki n ASN 150 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1dki n PHE 151 N -2.95 0.24 -2.33 3.10 3.01 -0.71 -0.99 117.46 116.82 1dki n PHE 151 Ca -0.37 -0.22 -0.18 0.00 1.01 0.00 0.00 57.45 57.69 1dki n PHE 151 Cb 1.09 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 40.54 1dki n PHE 151 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dki n GLY 152 N 0.71 -0.35 3.81 1.37 0.00 -0.84 -4.31 105.19 105.57 1dki n GLY 152 Ca 0.10 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1dki n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dki s TYR 153 N -2.91 2.68 0.61 1.61 1.51 0.68 -4.94 117.35 116.60 1dki s TYR 153 Ca 0.00 0.95 -0.19 0.00 -1.01 0.00 0.00 57.07 56.81 1dki s TYR 153 Cb 0.00 -3.30 -0.03 0.00 -0.11 0.00 0.00 41.96 38.52 1dki s TYR 153 CO 0.00 -2.08 1.30 1.21 -1.11 0.00 0.00 175.55 174.87 1dki s ASN 154 N -4.05 4.87 0.22 2.29 3.84 -0.47 -4.52 114.94 117.13 1dki s ASN 154 Ca 0.62 2.64 0.15 0.00 0.21 0.00 0.00 52.86 56.48 1dki s ASN 154 Cb -0.14 -2.62 0.82 0.00 -0.55 0.00 0.00 41.25 38.75 1dki s ASN 154 CO 0.53 -1.83 1.46 0.00 -2.79 0.00 0.00 177.10 174.47 1dki n GLN 155 N -1.60 0.10 0.22 0.43 1.13 -1.26 -1.46 117.38 114.93 1dki n GLN 155 Ca 0.14 0.60 0.16 0.00 -1.94 0.00 0.00 57.00 55.95 1dki n GLN 155 Cb 0.47 -1.82 0.73 0.00 0.11 0.00 0.00 30.24 29.73 1dki n GLN 155 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1dki h SER 156 N 0.00 0.00 -2.71 1.08 4.64 -1.90 -3.43 113.55 111.23 1dki h SER 156 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1dki h SER 156 Cb 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1dki h SER 156 CO 0.00 0.00 0.98 -0.69 -0.87 0.00 0.00 176.83 176.25 1dki s VAL 157 N -3.65 3.10 0.09 0.95 1.01 -0.54 -4.24 120.40 117.11 1dki s VAL 157 Ca -0.00 0.55 -0.26 0.00 0.00 0.00 0.00 61.98 62.27 1dki s VAL 157 Cb 0.09 -3.35 0.08 0.00 0.00 0.00 0.00 36.38 33.20 1dki s VAL 157 CO 0.39 -0.00 0.68 -1.38 0.00 0.00 0.00 175.10 174.79 1dki s HIS 158 N 2.58 -0.51 0.23 5.22 -3.43 -0.75 -4.98 115.29 113.65 1dki s HIS 158 Ca 0.73 0.44 -0.23 0.00 -0.80 0.00 0.00 55.06 55.19 1dki s HIS 158 Cb -0.39 0.53 -0.09 0.00 -1.43 0.00 0.00 32.58 31.20 1dki s HIS 158 CO 0.32 -0.74 0.80 -1.14 -2.00 0.00 0.00 174.74 171.98 1dki s GLN 159 N -3.16 4.45 0.02 -0.38 0.74 -1.26 -1.35 119.66 118.72 1dki s GLN 159 Ca -0.00 1.08 0.03 0.00 0.05 0.00 0.00 55.36 56.52 1dki s GLN 159 Cb -0.01 -2.99 -0.01 0.00 1.10 0.00 0.00 33.01 31.10 1dki s GLN 159 CO -0.08 0.43 -0.08 0.96 -0.55 0.00 0.00 175.29 175.96 1dki s ILE 160 N -1.42 0.63 -0.10 -2.34 -4.36 -0.12 -4.96 121.20 108.52 1dki s ILE 160 Ca 0.42 -0.62 -0.00 0.00 -0.26 0.00 0.00 60.65 60.19 1dki s ILE 160 Cb -0.19 -0.58 -0.03 0.00 1.25 0.00 0.00 42.46 42.91 1dki s ILE 160 CO 0.24 -0.02 -0.08 0.20 0.24 0.00 0.00 174.94 175.51 1dki s ASN 161 N -0.71 4.48 0.32 4.36 0.01 -1.26 -0.66 114.94 121.47 1dki s ASN 161 Ca -0.01 -0.13 0.05 0.00 -0.71 0.00 0.00 52.86 52.06 1dki s ASN 161 Cb -0.05 -1.35 0.67 0.00 0.41 0.00 0.00 41.25 40.92 1dki s ASN 161 CO 0.00 0.28 1.85 -0.09 -1.51 0.00 0.00 177.10 177.63 1dki h ARG 162 N 5.88 0.84 0.00 -0.60 9.65 -1.53 -0.77 114.38 127.85 1dki h ARG 162 Ca -0.40 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 1dki h ARG 162 Cb 1.18 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 29.57 1dki h ARG 162 CO 0.55 0.55 0.00 0.41 2.80 0.00 0.00 179.97 184.28 1dki n GLY 163 N -1.39 -0.64 0.93 2.80 0.00 -1.26 -2.07 105.19 103.56 1dki n GLY 163 Ca 0.18 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1dki n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dki n ASP 164 N -1.42 2.84 -4.15 1.61 8.00 -0.29 -4.97 116.55 118.17 1dki n ASP 164 Ca 0.02 -1.90 -0.12 0.00 0.71 0.00 0.00 54.79 53.50 1dki n ASP 164 Cb 0.07 -0.12 -0.10 0.00 -0.02 0.00 0.00 41.12 40.94 1dki n ASP 164 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dki s PHE 165 N -1.75 0.89 0.71 1.24 0.40 -0.88 -5.06 117.98 113.52 1dki s PHE 165 Ca 0.34 -0.77 -0.11 0.00 -0.60 0.00 0.00 56.93 55.79 1dki s PHE 165 Cb 0.21 -0.51 0.01 0.00 0.51 0.00 0.00 43.02 43.24 1dki s PHE 165 CO 0.31 -0.10 1.07 -1.54 0.70 0.00 0.00 175.22 175.66 1dki s SER 166 N -2.62 5.37 0.15 1.36 1.04 -1.26 -4.82 113.70 112.92 1dki s SER 166 Ca 0.06 1.36 -0.17 0.00 0.48 0.00 0.00 55.95 57.68 1dki s SER 166 Cb 0.00 -2.21 0.05 0.00 0.10 0.00 0.00 66.02 63.96 1dki s SER 166 CO -0.03 -1.42 1.74 0.50 0.98 0.00 0.00 173.24 175.02 1dki h LYS 167 N -0.70 0.23 -1.00 4.02 3.64 -1.99 -1.14 116.57 119.63 1dki h LYS 167 Ca -0.45 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 58.93 1dki h LYS 167 Cb 1.23 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.95 1dki h LYS 167 CO 0.61 0.15 0.66 1.96 -2.27 0.00 0.00 179.45 180.56 1dki h GLN 168 N 0.24 1.31 0.00 1.90 7.50 -2.00 -1.39 115.11 122.68 1dki h GLN 168 Ca 0.16 -0.08 -0.11 0.00 0.50 0.00 0.00 58.65 59.11 1dki h GLN 168 Cb 0.14 -0.30 -0.02 0.00 0.05 0.00 0.00 27.48 27.36 1dki h GLN 168 CO -0.17 0.87 -0.55 -0.44 -1.50 0.00 0.00 178.83 177.04 1dki h ASP 169 N 1.35 0.00 -0.05 1.46 3.45 -1.84 -2.25 116.42 118.54 1dki h ASP 169 Ca 0.37 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.81 1dki h ASP 169 Cb -0.15 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.61 1dki h ASP 169 CO -0.08 0.55 -0.04 -0.25 -1.57 0.00 0.00 179.24 177.85 1dki h TRP 170 N 0.00 0.14 -0.29 4.55 2.91 -0.65 -2.26 115.95 120.35 1dki h TRP 170 Ca -0.01 -0.04 0.01 0.00 1.13 0.00 0.00 58.89 59.98 1dki h TRP 170 Cb 1.13 -0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 29.73 1dki h TRP 170 CO 0.00 0.55 0.19 0.93 -1.03 0.00 0.00 178.44 179.08 1dki h GLU 171 N -0.30 0.37 -0.27 2.65 5.08 -1.24 -1.49 114.58 119.38 1dki h GLU 171 Ca 0.01 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1dki h GLU 171 Cb 0.52 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1dki h GLU 171 CO 0.01 0.24 -0.15 0.00 -1.00 0.00 0.00 179.01 178.11 1dki h ALA 172 N 1.82 1.25 -0.48 3.43 0.00 -1.13 0.13 119.26 124.28 1dki h ALA 172 Ca 0.11 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1dki h ALA 172 Cb -0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1dki h ALA 172 CO -0.02 0.49 0.09 1.96 0.00 0.00 0.00 179.25 181.77 1dki h GLN 173 N 0.42 0.78 -0.24 0.00 1.08 -0.69 -1.17 115.11 115.29 1dki h GLN 173 Ca 0.08 -0.20 -0.09 0.00 -1.45 0.00 0.00 58.65 56.99 1dki h GLN 173 Cb 0.52 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1dki h GLN 173 CO 0.03 0.78 -0.19 0.82 -0.95 0.00 0.00 178.83 179.32 1dki h ILE 174 N 0.66 1.31 -0.89 2.54 2.04 -1.12 -2.78 117.51 119.26 1dki h ILE 174 Ca 0.15 -1.33 0.03 0.00 1.00 0.00 0.00 64.86 64.70 1dki h ILE 174 Cb 0.37 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1dki h ILE 174 CO 0.01 0.41 0.58 0.44 0.00 0.00 0.00 178.15 179.59 1dki h ASP 175 N 0.27 0.98 -0.22 1.72 3.32 -0.65 -1.47 116.42 120.38 1dki h ASP 175 Ca 0.04 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.10 1dki h ASP 175 Cb 0.73 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1dki h ASP 175 CO 0.05 0.69 0.08 0.50 -1.72 0.00 0.00 179.24 178.84 1dki h LYS 176 N 1.15 0.19 -0.31 3.56 3.64 -1.15 0.05 116.57 123.70 1dki h LYS 176 Ca 0.35 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.74 1dki h LYS 176 Cb -0.04 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.71 1dki h LYS 176 CO -0.10 0.12 0.15 0.93 -2.27 0.00 0.00 179.45 178.28 1dki h GLU 177 N 0.19 0.31 -0.15 1.90 4.39 -1.15 -2.15 114.58 117.92 1dki h GLU 177 Ca 0.09 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 1dki h GLU 177 Cb 0.05 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1dki h GLU 177 CO -0.09 0.21 -0.07 -0.07 -1.16 0.00 0.00 179.01 177.83 1dki h LEU 178 N 0.32 0.20 -1.88 1.33 3.38 -0.85 -1.39 115.31 116.43 1dki h LEU 178 Ca 0.13 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1dki h LEU 178 Cb 0.04 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1dki h LEU 178 CO -0.09 0.31 -0.03 0.77 0.09 0.00 0.00 178.44 179.49 1dki h SER 179 N 0.22 0.00 -0.50 -0.43 4.64 -0.34 -1.87 113.55 115.27 1dki h SER 179 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1dki h SER 179 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1dki h SER 179 CO 0.01 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 1dki n GLN 180 N -3.16 3.63 -3.71 4.77 6.02 -0.62 -4.94 117.38 119.36 1dki n GLN 180 Ca -0.01 -2.81 -0.24 0.00 -0.01 0.00 0.00 57.00 53.93 1dki n GLN 180 Cb 0.25 -1.86 0.05 0.00 1.02 0.00 0.00 30.24 29.70 1dki n GLN 180 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1dki n ASN 181 N 0.57 -3.75 -4.04 1.08 3.02 -0.70 -4.98 115.26 106.46 1dki n ASN 181 Ca 0.23 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.76 1dki n ASN 181 Cb 0.88 -4.39 -0.15 0.00 -0.61 0.00 0.00 39.78 35.51 1dki n ASN 181 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1dki s GLN 182 N -6.18 1.88 0.67 3.52 -0.21 -0.62 -5.03 119.66 113.68 1dki s GLN 182 Ca 0.36 -1.54 -0.17 0.00 0.02 0.00 0.00 55.36 54.04 1dki s GLN 182 Cb -0.17 -2.98 0.00 0.00 1.00 0.00 0.00 33.01 30.86 1dki s GLN 182 CO 0.79 -0.73 1.23 -2.14 -2.12 0.00 0.00 175.29 172.32 1dki s PRO 183 N 1.05 2.49 -0.11 2.91 0.02 -1.26 -3.97 135.00 136.12 1dki s PRO 183 Ca -0.01 1.85 -0.01 0.00 0.02 0.00 0.00 61.00 62.86 1dki s PRO 183 Cb -0.19 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 1dki s PRO 183 CO -0.07 -1.59 -0.07 0.08 -0.33 0.00 0.00 177.00 175.03 1dki s VAL 184 N -1.73 3.66 -0.10 3.83 1.01 -0.15 -4.79 120.40 122.13 1dki s VAL 184 Ca 0.77 -0.47 -0.28 0.00 0.00 0.00 0.00 61.98 62.01 1dki s VAL 184 Cb -0.31 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1dki s VAL 184 CO 0.40 0.55 0.91 -0.47 0.00 0.00 0.00 175.10 176.49 1dki s TYR 185 N -0.20 3.52 0.10 5.22 5.04 -1.07 -1.53 117.35 128.42 1dki s TYR 185 Ca 0.03 1.47 0.05 0.00 -2.44 0.00 0.00 57.07 56.17 1dki s TYR 185 Cb -0.13 -3.08 -0.03 0.00 0.35 0.00 0.00 41.96 39.07 1dki s TYR 185 CO 0.03 -0.15 -0.12 -0.47 -1.34 0.00 0.00 175.55 173.49 1dki s TYR 186 N 1.73 1.20 0.07 4.97 5.04 -0.27 -0.42 117.35 129.66 1dki s TYR 186 Ca 0.45 -0.58 -0.26 0.00 -2.44 0.00 0.00 57.07 54.24 1dki s TYR 186 Cb -0.18 -0.65 0.08 0.00 0.35 0.00 0.00 41.96 41.56 1dki s TYR 186 CO 0.18 0.06 0.67 1.14 -1.34 0.00 0.00 175.55 176.26 1dki s GLN 187 N -2.52 1.14 0.37 4.97 -2.07 -0.55 -1.01 119.66 119.99 1dki s GLN 187 Ca 0.05 -0.23 0.08 0.00 -1.82 0.00 0.00 55.36 53.44 1dki s GLN 187 Cb -0.05 0.53 -0.04 0.00 -1.09 0.00 0.00 33.01 32.36 1dki s GLN 187 CO 0.02 -0.46 0.17 0.20 -1.32 0.00 0.00 175.29 173.89 1dki s GLY 188 N -2.24 2.06 -0.06 2.60 0.00 -0.97 -1.89 107.32 106.82 1dki s GLY 188 Ca -0.02 -1.91 0.03 0.00 0.00 0.00 0.00 44.72 42.82 1dki s GLY 188 CO -0.06 -1.80 -0.14 0.14 0.00 0.00 0.00 173.10 171.24 1dki s VAL 189 N -2.48 3.03 0.27 1.40 1.01 -0.67 -0.49 120.40 122.48 1dki s VAL 189 Ca 0.39 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1dki s VAL 189 Cb -0.01 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 1dki s VAL 189 CO 0.23 0.58 0.03 0.61 0.00 0.00 0.00 175.10 176.55 1dki n GLY 190 N 2.53 3.74 0.21 4.51 0.00 -0.20 -4.85 105.19 111.13 1dki n GLY 190 Ca -0.17 -2.19 -0.00 0.00 0.00 0.00 0.00 46.02 43.65 1dki n GLY 190 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dki h LYS 191 N 0.00 0.22 -0.01 1.61 1.57 -2.02 -2.87 116.57 115.08 1dki h LYS 191 Ca -0.22 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1dki h LYS 191 Cb 0.72 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1dki h LYS 191 CO 0.36 0.52 -0.06 1.33 -0.57 0.00 0.00 179.45 181.03 1dki n VAL 192 N -4.12 0.00 0.00 0.50 0.24 -1.26 -5.04 118.33 108.66 1dki n VAL 192 Ca -0.01 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 1dki n VAL 192 Cb 0.40 0.17 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 1dki n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dki n GLY 193 N 1.18 0.65 3.74 7.63 0.00 -1.08 -4.16 105.19 113.14 1dki n GLY 193 Ca 0.18 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 1dki n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dki s GLY 194 N 0.00 2.79 -0.46 -0.02 0.00 0.57 -1.03 107.32 109.17 1dki s GLY 194 Ca 0.00 0.86 -0.08 0.00 0.00 0.00 0.00 44.72 45.50 1dki s GLY 194 CO 0.00 1.72 0.32 0.30 0.00 0.00 0.00 173.10 175.44 1dki s HIS 195 N -0.17 3.47 0.26 1.90 3.76 0.35 -4.66 115.29 120.21 1dki s HIS 195 Ca 0.51 -2.01 -0.02 0.00 -0.15 0.00 0.00 55.06 53.39 1dki s HIS 195 Cb -0.30 -3.44 -0.04 0.00 1.11 0.00 0.00 32.58 29.90 1dki s HIS 195 CO 0.35 -0.99 0.48 0.00 -0.85 0.00 0.00 174.74 173.74 1dki s ALA 196 N 1.30 3.73 0.35 -1.40 0.00 -1.26 -2.29 121.76 122.19 1dki s ALA 196 Ca 0.06 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 51.09 1dki s ALA 196 Cb -0.25 -2.12 0.04 0.00 0.00 0.00 0.00 23.12 20.79 1dki s ALA 196 CO -0.02 0.26 0.77 -0.59 0.00 0.00 0.00 175.76 176.19 1dki s PHE 197 N -2.04 0.03 -0.12 0.00 -0.12 -0.18 -4.75 117.98 110.80 1dki s PHE 197 Ca 0.41 -0.65 0.01 0.00 -0.05 0.00 0.00 56.93 56.65 1dki s PHE 197 Cb -0.11 0.80 -0.01 0.00 -0.63 0.00 0.00 43.02 43.08 1dki s PHE 197 CO 0.31 -1.48 -0.17 0.08 -0.05 0.00 0.00 175.22 173.91 1dki s VAL 198 N -2.78 2.66 -0.23 -2.49 1.01 -0.75 -1.12 120.40 116.70 1dki s VAL 198 Ca 0.14 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 1dki s VAL 198 Cb -0.05 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 1dki s VAL 198 CO 0.10 0.54 0.22 -0.63 0.00 0.00 0.00 175.10 175.33 1dki s ILE 199 N 0.37 5.32 -0.00 2.22 1.01 -0.58 -1.07 121.20 128.46 1dki s ILE 199 Ca -0.14 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.84 1dki s ILE 199 Cb -0.17 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.75 1dki s ILE 199 CO 0.07 0.32 0.88 -0.90 0.00 0.00 0.00 174.94 175.30 1dki n ASP 200 N 4.35 0.04 -3.59 3.58 5.75 -0.62 -0.97 116.55 125.08 1dki n ASP 200 Ca -0.13 -1.76 -0.02 0.00 -0.01 0.00 0.00 54.79 52.86 1dki n ASP 200 Cb 0.52 -0.15 -0.00 0.00 -1.03 0.00 0.00 41.12 40.46 1dki n ASP 200 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1dki s GLY 201 N -0.77 -0.13 -0.04 6.12 0.00 -1.24 -0.47 107.32 110.80 1dki s GLY 201 Ca 0.00 0.03 -0.15 0.00 0.00 0.00 0.00 44.72 44.60 1dki s GLY 201 CO 0.00 1.02 0.32 0.00 0.00 0.00 0.00 173.10 174.44 1dki s ALA 202 N -2.73 -0.82 -2.15 3.20 0.00 -0.13 -0.76 121.76 118.37 1dki s ALA 202 Ca 0.16 0.46 0.20 0.00 0.00 0.00 0.00 51.96 52.79 1dki s ALA 202 Cb -0.01 -0.04 0.35 0.00 0.00 0.00 0.00 23.12 23.42 1dki s ALA 202 CO 0.03 -0.25 1.30 -0.40 0.00 0.00 0.00 175.76 176.44 1dki n ASP 203 N 1.55 3.17 0.00 0.00 5.75 -0.61 -1.93 116.55 124.49 1dki n ASP 203 Ca -0.20 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.66 1dki n ASP 203 Cb 0.56 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1dki n ASP 203 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dki n GLY 204 N 1.25 2.21 0.74 6.12 0.00 -1.25 -4.81 105.19 109.45 1dki n GLY 204 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1dki n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dki n ARG 205 N -2.00 2.20 -1.01 1.61 1.74 -1.26 -4.15 116.66 113.79 1dki n ARG 205 Ca 0.00 -2.88 -0.00 0.00 -0.77 0.00 0.00 57.85 54.19 1dki n ARG 205 Cb 0.00 -1.74 -0.00 0.00 -1.02 0.00 0.00 32.46 29.70 1dki n ARG 205 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1dki n ASN 206 N -0.91 -3.11 -4.77 0.55 4.13 -1.26 -5.05 115.26 104.84 1dki n ASN 206 Ca 0.23 0.01 -0.34 0.00 1.68 0.00 0.00 54.58 56.16 1dki n ASN 206 Cb 0.85 -0.63 -0.07 0.00 -1.54 0.00 0.00 39.78 38.39 1dki n ASN 206 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1dki s PHE 207 N -1.98 3.29 -0.07 3.10 0.40 -1.26 -4.50 117.98 116.96 1dki s PHE 207 Ca 0.00 0.23 0.03 0.00 -0.60 0.00 0.00 56.93 56.60 1dki s PHE 207 Cb 0.00 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 1dki s PHE 207 CO 0.00 0.55 -0.16 0.71 0.70 0.00 0.00 175.22 177.02 1dki s TYR 208 N -1.13 2.66 0.09 0.36 1.51 0.67 -1.57 117.35 119.94 1dki s TYR 208 Ca 0.21 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.61 1dki s TYR 208 Cb -0.12 -1.66 -0.06 0.00 -0.11 0.00 0.00 41.96 40.01 1dki s TYR 208 CO 0.11 0.03 1.10 -1.58 -1.11 0.00 0.00 175.55 174.11 1dki s HIS 209 N -0.42 3.57 -0.02 2.71 2.46 0.06 -0.49 115.29 123.15 1dki s HIS 209 Ca 0.05 1.52 0.07 0.00 0.47 0.00 0.00 55.06 57.17 1dki s HIS 209 Cb -0.12 -3.28 -0.02 0.00 -0.13 0.00 0.00 32.58 29.03 1dki s HIS 209 CO 0.02 -0.67 -0.24 0.08 -2.47 0.00 0.00 174.74 171.46 1dki s VAL 210 N 0.54 1.92 -0.29 0.89 1.01 0.32 -1.58 120.40 123.21 1dki s VAL 210 Ca 0.53 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1dki s VAL 210 Cb -0.27 -1.60 0.06 0.00 0.00 0.00 0.00 36.38 34.57 1dki s VAL 210 CO 0.31 0.54 -0.03 0.21 0.00 0.00 0.00 175.10 176.13 1dki s ASN 211 N -0.51 4.75 0.00 3.32 3.84 -0.23 -2.72 114.94 123.38 1dki s ASN 211 Ca 0.08 -1.37 0.27 0.00 0.21 0.00 0.00 52.86 52.05 1dki s ASN 211 Cb -0.10 -1.66 1.31 0.00 -0.55 0.00 0.00 41.25 40.25 1dki s ASN 211 CO -0.00 -0.25 1.90 0.79 -2.79 0.00 0.00 177.10 176.75 1dki n TRP 212 N 4.54 0.00 -2.20 0.43 7.02 -1.26 -1.80 117.44 124.18 1dki n TRP 212 Ca -0.13 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.30 1dki n TRP 212 Cb 0.43 -0.33 0.00 0.00 -2.42 0.00 0.00 31.31 28.99 1dki n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dki n GLY 213 N 1.04 0.21 1.09 6.99 0.00 -1.26 -4.86 105.19 108.40 1dki n GLY 213 Ca 0.11 -0.64 -0.00 0.00 0.00 0.00 0.00 46.02 45.50 1dki n GLY 213 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dki n TRP 214 N -3.88 0.56 -0.78 1.61 7.02 -1.20 -3.96 117.44 116.81 1dki n TRP 214 Ca -0.05 -1.52 0.00 0.00 -1.02 0.00 0.00 57.50 54.91 1dki n TRP 214 Cb 0.54 -0.25 0.00 0.00 -2.42 0.00 0.00 31.31 29.18 1dki n TRP 214 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dki n GLY 215 N -0.79 1.30 0.00 6.99 0.00 -0.33 -3.79 105.19 108.56 1dki n GLY 215 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1dki n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 216 N -2.00 1.08 3.72 -0.02 0.00 -1.26 -4.89 105.19 101.82 1dki n GLY 216 Ca 0.00 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1dki n GLY 216 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1dki n VAL 217 N 0.00 1.73 -0.50 1.61 3.14 -1.25 -2.01 118.33 121.04 1dki n VAL 217 Ca 0.00 -0.43 0.00 0.00 -2.96 0.00 0.00 64.34 60.95 1dki n VAL 217 Cb 0.00 -1.73 0.00 0.00 -1.06 0.00 0.00 33.84 31.05 1dki n VAL 217 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1dki n SER 218 N 1.05 0.00 -4.76 6.55 7.64 -0.10 -4.74 113.62 119.25 1dki n SER 218 Ca 0.05 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.54 1dki n SER 218 Cb 0.36 -0.87 0.01 0.00 -1.01 0.00 0.00 64.21 62.70 1dki n SER 218 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1dki s ASP 219 N -2.81 6.01 0.00 6.43 1.11 -0.85 -4.90 116.67 121.67 1dki s ASP 219 Ca 0.00 2.67 0.00 0.00 0.18 0.00 0.00 52.55 55.40 1dki s ASP 219 Cb 0.00 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 41.36 1dki s ASP 219 CO 0.00 -1.05 0.00 0.61 1.18 0.00 0.00 175.17 175.91 1dki n GLY 220 N 0.63 -0.53 3.75 0.21 0.00 -1.10 -4.83 105.19 103.32 1dki n GLY 220 Ca 0.06 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 1dki n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dki s PHE 221 N -3.02 3.42 0.02 1.61 0.40 0.83 -0.52 117.98 120.71 1dki s PHE 221 Ca 0.00 0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.67 1dki s PHE 221 Cb 0.00 -2.06 -0.01 0.00 0.51 0.00 0.00 43.02 41.46 1dki s PHE 221 CO 0.00 0.41 -0.04 -0.06 0.70 0.00 0.00 175.22 176.23 1dki s PHE 222 N -0.14 0.39 0.46 0.36 0.40 0.36 -0.67 117.98 119.15 1dki s PHE 222 Ca 0.09 -0.30 -0.21 0.00 -0.60 0.00 0.00 56.93 55.92 1dki s PHE 222 Cb -0.12 -0.25 -0.09 0.00 0.51 0.00 0.00 43.02 43.07 1dki s PHE 222 CO 0.00 -0.07 1.01 1.03 0.70 0.00 0.00 175.22 177.89 1dki s ARG 223 N -0.86 3.97 0.56 0.44 0.52 -0.74 -0.24 118.95 122.61 1dki s ARG 223 Ca -0.06 1.27 0.34 0.00 -0.52 0.00 0.00 55.73 56.77 1dki s ARG 223 Cb -0.06 -2.14 1.52 0.00 0.52 0.00 0.00 34.95 34.79 1dki s ARG 223 CO -0.00 -0.27 2.04 -0.07 0.02 0.00 0.00 175.30 177.02 1dki h LEU 224 N 1.72 0.00 -7.18 2.53 3.38 -1.92 -3.45 115.31 110.38 1dki h LEU 224 Ca -0.49 0.00 0.13 0.00 0.09 0.00 0.00 57.88 57.61 1dki h LEU 224 Cb 1.21 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1dki h LEU 224 CO 0.60 0.03 0.50 1.51 0.09 0.00 0.00 178.44 181.17 1dki s ASP 225 N -5.68 -0.31 -0.22 -0.43 1.47 -1.26 -5.03 116.67 105.21 1dki s ASP 225 Ca -0.00 -0.11 0.15 0.00 1.18 0.00 0.00 52.55 53.76 1dki s ASP 225 Cb 0.10 0.41 0.63 0.00 -0.34 0.00 0.00 42.92 43.72 1dki s ASP 225 CO 0.53 -0.69 1.56 0.00 0.68 0.00 0.00 175.17 177.26 1dki n ALA 226 N -0.31 3.52 -1.91 2.11 0.00 -1.26 -5.01 120.51 117.64 1dki n ALA 226 Ca -0.08 -2.28 -0.41 0.00 0.00 0.00 0.00 53.44 50.67 1dki n ALA 226 Cb 0.61 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.14 1dki n ALA 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dki s LEU 227 N -2.87 4.49 -0.32 0.00 2.01 -1.26 -4.49 118.68 116.24 1dki s LEU 227 Ca 0.47 2.27 -0.24 0.00 0.01 0.00 0.00 54.13 56.65 1dki s LEU 227 Cb 0.38 -3.62 0.00 0.00 0.01 0.00 0.00 46.19 42.96 1dki s LEU 227 CO 0.11 -0.28 0.81 0.21 1.01 0.00 0.00 176.35 178.20 1dki s ASN 228 N -0.34 6.66 -0.47 2.29 3.84 -1.26 -4.90 114.94 120.76 1dki s ASN 228 Ca 0.49 0.63 -0.04 0.00 0.21 0.00 0.00 52.86 54.14 1dki s ASN 228 Cb -0.33 -2.41 -0.16 0.00 -0.55 0.00 0.00 41.25 37.80 1dki s ASN 228 CO 0.40 -0.66 1.54 -2.65 -2.79 0.00 0.00 177.10 172.94 1dki n PRO 229 N 6.30 0.00 0.00 0.43 -0.02 -1.26 -5.06 135.00 135.39 1dki n PRO 229 Ca 0.04 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1dki n PRO 229 Cb 0.48 -1.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.93 1dki n PRO 229 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dki n GLY 240 N 4.98 3.85 3.68 -1.23 0.00 -1.26 -5.16 105.19 110.06 1dki n GLY 240 Ca 0.32 -0.45 -0.45 0.00 0.00 0.00 0.00 46.02 45.44 1dki n GLY 240 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1dki n PHE 241 N 0.00 2.39 -0.68 1.61 7.35 -1.26 -4.90 117.46 121.97 1dki n PHE 241 Ca 0.00 0.26 0.07 0.00 -0.76 0.00 0.00 57.45 57.02 1dki n PHE 241 Cb 0.00 -2.55 0.14 0.00 0.35 0.00 0.00 39.48 37.42 1dki n PHE 241 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1dki n ASN 242 N 3.13 2.75 -1.10 -2.13 6.94 -1.26 -4.88 115.26 118.71 1dki n ASN 242 Ca 0.15 -2.66 -0.12 0.00 -0.02 0.00 0.00 54.58 51.92 1dki n ASN 242 Cb 0.31 -0.33 -0.05 0.00 -2.36 0.00 0.00 39.78 37.35 1dki n ASN 242 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1dki n GLY 243 N -0.70 1.16 2.24 4.83 0.00 -1.26 -1.59 105.19 109.87 1dki n GLY 243 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 1dki n GLY 243 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dki n TYR 244 N -1.95 -0.55 -1.67 1.61 4.02 -1.26 -1.66 117.16 115.70 1dki n TYR 244 Ca -0.12 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.37 1dki n TYR 244 Cb 0.50 -2.91 0.03 0.00 -0.02 0.00 0.00 39.34 36.94 1dki n TYR 244 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1dki n GLN 245 N -2.24 1.45 -4.03 -0.72 6.02 -0.62 -4.43 117.38 112.81 1dki n GLN 245 Ca -0.16 0.53 -0.10 0.00 -0.01 0.00 0.00 57.00 57.26 1dki n GLN 245 Cb 0.54 -2.31 -0.07 0.00 1.02 0.00 0.00 30.24 29.42 1dki n GLN 245 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1dki s SER 246 N -0.88 0.03 0.16 1.08 1.04 -0.79 -1.27 113.70 113.07 1dki s SER 246 Ca 0.69 -1.00 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 1dki s SER 246 Cb -0.47 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 1dki s SER 246 CO 0.52 -0.95 0.24 0.00 0.98 0.00 0.00 173.24 174.03 1dki s ALA 247 N -4.02 0.20 -0.16 5.32 0.00 0.17 -1.48 121.76 121.79 1dki s ALA 247 Ca 0.23 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1dki s ALA 247 Cb 0.03 0.88 0.03 0.00 0.00 0.00 0.00 23.12 24.06 1dki s ALA 247 CO 0.05 -0.62 -0.13 0.08 0.00 0.00 0.00 175.76 175.14 1dki s VAL 248 N -3.99 1.60 0.51 0.00 1.01 0.44 -0.95 120.40 119.02 1dki s VAL 248 Ca 0.19 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1dki s VAL 248 Cb 0.04 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 1dki s VAL 248 CO 0.01 0.39 0.05 0.68 0.00 0.00 0.00 175.10 176.23 1dki s VAL 249 N 1.46 1.27 -0.27 2.92 -7.23 -0.45 -2.59 120.40 115.51 1dki s VAL 249 Ca 0.03 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 1dki s VAL 249 Cb -0.14 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.59 1dki s VAL 249 CO -0.10 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1dki n GLY 250 N -1.31 0.59 3.61 2.32 0.00 -1.26 -1.81 105.19 107.32 1dki n GLY 250 Ca -0.16 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 1dki n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dki s ILE 251 N -2.05 4.24 -0.05 -0.61 1.01 -1.26 -2.92 121.20 119.54 1dki s ILE 251 Ca 0.00 1.28 -0.30 0.00 0.00 0.00 0.00 60.65 61.63 1dki s ILE 251 Cb 0.00 -4.57 0.11 0.00 0.01 0.00 0.00 42.46 38.01 1dki s ILE 251 CO 0.00 -0.94 0.96 -1.59 0.00 0.00 0.00 174.94 173.37 1dki s LYS 252 N 4.37 0.70 0.00 2.79 -2.85 -1.26 -4.81 119.74 118.68 1dki s LYS 252 Ca 0.48 -0.23 0.07 0.00 -1.00 0.00 0.00 55.97 55.29 1dki s LYS 252 Cb -0.08 0.32 0.44 0.00 -2.06 0.00 0.00 37.83 36.45 1dki s LYS 252 CO 0.30 -0.30 0.90 -2.30 0.10 0.00 0.00 175.35 174.04