#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xtz n ASP 20 N 0.00 -0.52 0.03 1.62 5.75 -1.26 -2.03 116.55 120.14 1xtz n ASP 20 Ca 0.00 1.25 -0.12 0.00 -0.01 0.00 0.00 54.79 55.90 1xtz n ASP 20 Cb 0.00 -0.30 -0.08 0.00 -1.03 0.00 0.00 41.12 39.71 1xtz n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xtz h ALA 21 N -0.13 -0.01 -0.83 2.12 0.00 -1.84 -3.06 119.26 115.52 1xtz h ALA 21 Ca 0.08 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.12 1xtz h ALA 21 Cb 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.84 1xtz h ALA 21 CO -0.46 -0.45 -0.11 0.87 0.00 0.00 0.00 179.25 179.09 1xtz h LYS 22 N -0.10 0.03 -0.25 0.00 1.57 -1.81 -1.96 116.57 114.04 1xtz h LYS 22 Ca -0.00 -0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 1xtz h LYS 22 Cb 0.10 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1xtz h LYS 22 CO 0.00 0.02 -0.32 -0.09 -0.57 0.00 0.00 179.45 178.49 1xtz h ARG 23 N 0.03 0.51 -0.07 3.15 2.43 -1.35 -3.02 114.38 116.06 1xtz h ARG 23 Ca 0.43 -0.22 0.02 0.00 -0.81 0.00 0.00 59.98 59.39 1xtz h ARG 23 Cb 0.73 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 1xtz h ARG 23 CO -0.80 0.77 -0.03 0.00 -1.51 0.00 0.00 179.97 178.40 1xtz h ALA 24 N 1.22 0.04 -0.37 2.80 0.00 -1.26 -2.47 119.26 119.21 1xtz h ALA 24 Ca 0.05 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xtz h ALA 24 Cb 0.77 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1xtz h ALA 24 CO 0.06 -0.50 0.17 0.00 0.00 0.00 0.00 179.25 178.98 1xtz h ALA 25 N 1.06 0.48 -0.18 0.00 0.00 -1.54 -3.02 119.26 116.06 1xtz h ALA 25 Ca 0.04 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xtz h ALA 25 Cb 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xtz h ALA 25 CO -0.08 0.05 0.10 0.00 0.00 0.00 0.00 179.25 179.32 1xtz h ALA 26 N 1.02 0.22 -0.30 0.00 0.00 -1.38 -1.02 119.26 117.80 1xtz h ALA 26 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1xtz h ALA 26 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xtz h ALA 26 CO -0.01 -0.32 0.09 1.88 0.00 0.00 0.00 179.25 180.88 1xtz h TYR 27 N 0.20 0.48 -0.57 0.00 -1.99 -1.46 -2.02 116.97 111.62 1xtz h TYR 27 Ca 0.07 -0.05 0.01 0.00 2.00 0.00 0.00 58.73 60.76 1xtz h TYR 27 Cb 0.00 -0.14 -0.03 0.00 2.00 0.00 0.00 36.73 38.57 1xtz h TYR 27 CO -0.08 0.51 0.37 -0.09 -0.00 0.00 0.00 178.16 178.87 1xtz h ARG 28 N 0.32 0.74 -0.44 4.88 2.43 -1.39 -1.01 114.38 119.91 1xtz h ARG 28 Ca 0.09 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.29 1xtz h ARG 28 Cb 0.26 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.58 1xtz h ARG 28 CO -0.00 0.49 0.08 0.00 -1.51 0.00 0.00 179.97 179.03 1xtz h ALA 29 N 1.21 0.48 0.34 2.80 0.00 -0.95 0.53 119.26 123.66 1xtz h ALA 29 Ca 0.21 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1xtz h ALA 29 Cb -0.08 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xtz h ALA 29 CO -0.05 -0.32 -0.16 0.28 0.00 0.00 0.00 179.25 179.00 1xtz h VAL 30 N 0.22 0.57 -0.65 0.00 2.07 -1.23 -2.56 116.25 114.67 1xtz h VAL 30 Ca 0.22 -0.65 0.12 0.00 0.82 0.00 0.00 66.70 67.20 1xtz h VAL 30 Cb 0.27 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 1xtz h VAL 30 CO -0.29 0.11 0.20 0.44 0.02 0.00 0.00 177.57 178.05 1xtz h ASP 31 N -0.87 0.14 1.36 0.57 3.32 -1.06 0.17 116.42 120.04 1xtz h ASP 31 Ca -0.05 0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 1xtz h ASP 31 Cb 0.53 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1xtz h ASP 31 CO 0.08 0.07 -0.28 -0.33 -1.72 0.00 0.00 179.24 177.06 1xtz h GLU 32 N 0.35 0.00 0.00 3.56 5.08 -0.96 -3.39 114.58 119.21 1xtz h GLU 32 Ca 0.34 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1xtz h GLU 32 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1xtz h GLU 32 CO -0.38 0.28 -1.03 0.09 -1.00 0.00 0.00 179.01 176.97 1xtz n ASN 33 N -3.26 4.84 -4.63 1.42 3.02 -0.83 -4.96 115.26 110.87 1xtz n ASN 33 Ca 0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.14 1xtz n ASN 33 Cb 0.56 0.92 -0.03 0.00 -0.61 0.00 0.00 39.78 40.63 1xtz n ASN 33 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1xtz s LEU 34 N -3.25 3.93 -0.56 3.41 0.20 0.53 -4.97 118.68 117.96 1xtz s LEU 34 Ca -0.00 0.88 -0.13 0.00 0.69 0.00 0.00 54.13 55.56 1xtz s LEU 34 Cb 0.00 -3.45 0.14 0.00 -0.43 0.00 0.00 46.19 42.45 1xtz s LEU 34 CO 0.03 -0.89 0.49 -0.54 -0.29 0.00 0.00 176.35 175.15 1xtz s LYS 35 N 3.63 2.91 0.61 1.98 1.02 -1.26 -4.89 119.74 123.74 1xtz s LYS 35 Ca 0.43 -1.87 0.30 0.00 0.02 0.00 0.00 55.97 54.85 1xtz s LYS 35 Cb -0.12 -4.18 1.65 0.00 -0.52 0.00 0.00 37.83 34.66 1xtz s LYS 35 CO 0.17 -1.28 2.02 0.74 -0.92 0.00 0.00 175.35 176.08 1xtz h PHE 36 N 8.52 0.00 0.04 3.18 -1.00 -1.93 0.40 116.94 126.16 1xtz h PHE 36 Ca -0.20 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.33 1xtz h PHE 36 Cb 1.08 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.62 1xtz h PHE 36 CO 0.75 0.00 -1.20 -0.44 -1.61 0.00 0.00 178.31 175.81 1xtz h ASP 37 N 0.00 0.15 0.00 2.17 3.45 -2.02 -3.40 116.42 116.77 1xtz h ASP 37 Ca 0.10 -0.17 -0.30 0.00 0.43 0.00 0.00 57.03 57.08 1xtz h ASP 37 Cb 0.70 -0.05 -0.06 0.00 -0.56 0.00 0.00 39.33 39.37 1xtz h ASP 37 CO -0.00 1.14 -2.14 0.47 -1.57 0.00 0.00 179.24 177.14 1xtz n ASP 38 N -3.37 1.05 -4.55 6.45 8.00 -0.16 -5.01 116.55 118.95 1xtz n ASP 38 Ca -0.06 -0.01 -0.34 0.00 0.71 0.00 0.00 54.79 55.09 1xtz n ASP 38 Cb 0.98 0.80 -0.11 0.00 -0.02 0.00 0.00 41.12 42.77 1xtz n ASP 38 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1xtz s HIS 39 N -2.40 3.14 0.00 1.24 3.76 0.12 -4.93 115.29 116.22 1xtz s HIS 39 Ca -0.10 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.67 1xtz s HIS 39 Cb 0.05 -2.05 0.00 0.00 1.11 0.00 0.00 32.58 31.69 1xtz s HIS 39 CO 0.66 0.01 0.00 1.17 -0.85 0.00 0.00 174.74 175.73 1xtz n LYS 40 N 3.71 1.22 -3.64 1.40 4.81 -1.26 -4.72 118.16 119.67 1xtz n LYS 40 Ca -0.17 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 56.88 1xtz n LYS 40 Cb 0.52 -0.85 -0.12 0.00 0.02 0.00 0.00 35.03 34.61 1xtz n LYS 40 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1xtz s ILE 41 N -1.69 4.57 -0.14 3.15 -1.09 -1.26 -0.79 121.20 123.96 1xtz s ILE 41 Ca 0.00 -0.54 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 1xtz s ILE 41 Cb 0.00 -3.39 0.01 0.00 -1.58 0.00 0.00 42.46 37.50 1xtz s ILE 41 CO 0.00 -0.01 -0.22 -0.63 -1.23 0.00 0.00 174.94 172.85 1xtz s ILE 42 N 1.59 2.07 -0.06 2.92 -1.09 -0.01 -0.62 121.20 126.00 1xtz s ILE 42 Ca 0.04 -0.98 -0.28 0.00 -2.23 0.00 0.00 60.65 57.20 1xtz s ILE 42 Cb -0.18 -1.82 -0.03 0.00 -1.58 0.00 0.00 42.46 38.85 1xtz s ILE 42 CO 0.06 0.55 0.89 -0.83 -1.23 0.00 0.00 174.94 174.38 1xtz s GLY 43 N 0.80 2.64 -0.16 6.18 0.00 0.11 -0.42 107.32 116.48 1xtz s GLY 43 Ca -0.07 0.34 0.01 0.00 0.00 0.00 0.00 44.72 45.00 1xtz s GLY 43 CO -0.02 1.59 -0.19 -0.42 0.00 0.00 0.00 173.10 174.06 1xtz s ILE 44 N 1.26 2.30 0.65 0.90 -1.09 -0.11 -1.21 121.20 123.90 1xtz s ILE 44 Ca 0.46 -0.89 -0.05 0.00 -2.23 0.00 0.00 60.65 57.94 1xtz s ILE 44 Cb -0.19 -1.95 0.14 0.00 -1.58 0.00 0.00 42.46 38.87 1xtz s ILE 44 CO 0.22 0.53 0.89 0.61 -1.23 0.00 0.00 174.94 175.96 1xtz n GLY 45 N 4.21 -0.10 0.92 6.18 0.00 -0.03 -2.83 105.19 113.54 1xtz n GLY 45 Ca -0.20 -1.90 0.09 0.00 0.00 0.00 0.00 46.02 44.02 1xtz n GLY 45 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xtz n SER 46 N -3.20 2.71 -3.20 1.61 7.64 -1.26 -4.48 113.62 113.43 1xtz n SER 46 Ca 0.13 -1.94 -0.29 0.00 1.01 0.00 0.00 58.87 57.78 1xtz n SER 46 Cb 0.47 -0.29 0.02 0.00 -1.01 0.00 0.00 64.21 63.40 1xtz n SER 46 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xtz n GLY 47 N 1.33 -3.09 1.03 0.23 0.00 -1.26 -4.85 105.19 98.57 1xtz n GLY 47 Ca 0.18 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.92 1xtz n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xtz n SER 48 N 2.35 3.16 -0.04 1.61 3.41 -1.26 -4.27 113.62 118.58 1xtz n SER 48 Ca 0.02 -1.99 -0.01 0.00 -0.26 0.00 0.00 58.87 56.63 1xtz n SER 48 Cb 0.40 -0.10 -0.09 0.00 -0.26 0.00 0.00 64.21 64.17 1xtz n SER 48 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1xtz n THR 49 N 1.39 0.48 0.23 6.66 -1.04 -1.26 -4.42 114.28 116.32 1xtz n THR 49 Ca 0.16 -0.39 0.09 0.00 -2.04 0.00 0.00 64.05 61.87 1xtz n THR 49 Cb 0.60 -0.39 0.57 0.00 -1.82 0.00 0.00 70.33 69.28 1xtz n THR 49 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1xtz h VAL 50 N 0.00 0.83 -0.84 12.58 2.07 -1.88 -2.74 116.25 126.27 1xtz h VAL 50 Ca -0.19 -0.81 0.25 0.00 0.82 0.00 0.00 66.70 66.76 1xtz h VAL 50 Cb 1.27 1.48 -0.16 0.00 -1.52 0.00 0.00 31.29 32.37 1xtz h VAL 50 CO 0.01 0.20 0.08 0.52 0.02 0.00 0.00 177.57 178.40 1xtz n VAL 51 N -3.83 -0.35 0.45 2.57 0.31 -1.26 0.31 118.33 116.53 1xtz n VAL 51 Ca -0.02 1.83 0.12 0.00 -0.01 0.00 0.00 64.34 66.26 1xtz n VAL 51 Cb 0.31 -2.71 0.27 0.00 -0.91 0.00 0.00 33.84 30.80 1xtz n VAL 51 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1xtz h TYR 52 N 0.00 0.00 0.16 3.52 0.05 -1.80 -1.49 116.97 117.40 1xtz h TYR 52 Ca 0.54 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.31 1xtz h TYR 52 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 1xtz h TYR 52 CO -0.37 0.00 -0.08 0.28 -1.05 0.00 0.00 178.16 176.94 1xtz h VAL 53 N 0.00 0.96 -0.98 -2.88 2.07 0.48 -0.76 116.25 115.13 1xtz h VAL 53 Ca 0.00 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1xtz h VAL 53 Cb 0.84 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.09 1xtz h VAL 53 CO 0.00 0.22 0.65 0.00 0.02 0.00 0.00 177.57 178.45 1xtz h ALA 54 N -0.06 1.29 -0.13 1.67 0.00 -1.10 -0.44 119.26 120.49 1xtz h ALA 54 Ca -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1xtz h ALA 54 Cb 0.52 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1xtz h ALA 54 CO 0.04 0.65 0.07 1.49 0.00 0.00 0.00 179.25 181.50 1xtz h GLU 55 N 1.33 0.14 -0.16 0.00 4.81 -1.32 0.20 114.58 119.60 1xtz h GLU 55 Ca 0.36 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 1xtz h GLU 55 Cb -0.15 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1xtz h GLU 55 CO -0.08 0.09 0.10 -0.09 -0.73 0.00 0.00 179.01 178.31 1xtz h ARG 56 N 0.15 0.21 -0.25 1.92 9.65 -0.37 -0.29 114.38 125.39 1xtz h ARG 56 Ca 0.05 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 58.94 1xtz h ARG 56 Cb 0.00 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 1xtz h ARG 56 CO -0.03 0.15 0.07 0.82 2.80 0.00 0.00 179.97 183.79 1xtz h ILE 57 N 0.20 0.92 -0.85 1.20 2.04 -0.86 -1.95 117.51 118.20 1xtz h ILE 57 Ca 0.06 -0.06 0.17 0.00 1.00 0.00 0.00 64.86 66.02 1xtz h ILE 57 Cb -0.01 0.72 -0.10 0.00 -0.74 0.00 0.00 36.82 36.69 1xtz h ILE 57 CO -0.01 0.03 0.41 1.23 0.00 0.00 0.00 178.15 179.81 1xtz h GLY 58 N 0.18 1.40 1.32 5.37 0.00 -0.39 -1.49 103.07 109.47 1xtz h GLY 58 Ca 0.11 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 47.27 1xtz h GLY 58 CO -0.13 -0.11 0.36 1.46 0.00 0.00 0.00 176.54 178.12 1xtz h GLN 59 N 0.54 0.57 0.00 4.80 4.20 -0.27 -1.21 115.11 123.74 1xtz h GLN 59 Ca 0.49 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 59.11 1xtz h GLN 59 Cb 0.77 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1xtz h GLN 59 CO -0.41 0.38 -0.24 1.88 -0.67 0.00 0.00 178.83 179.76 1xtz h TYR 60 N 0.59 0.00 0.00 2.96 -1.99 -0.99 -2.50 116.97 115.04 1xtz h TYR 60 Ca 0.22 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.82 1xtz h TYR 60 Cb 0.15 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.86 1xtz h TYR 60 CO -0.00 0.24 -0.64 1.25 -0.00 0.00 0.00 178.16 179.02 1xtz h LEU 61 N 0.00 0.00 -0.15 3.88 5.85 -1.15 -2.83 115.31 120.92 1xtz h LEU 61 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xtz h LEU 61 Cb 0.65 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1xtz h LEU 61 CO 0.03 0.64 -0.00 1.41 -0.34 0.00 0.00 178.44 180.18 1xtz n HIS 62 N -3.32 0.00 -3.61 1.25 8.25 -0.95 -4.39 115.22 112.46 1xtz n HIS 62 Ca 0.01 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.09 1xtz n HIS 62 Cb 0.76 -0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.75 1xtz n HIS 62 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1xtz s ASP 63 N -2.02 5.89 0.59 0.41 -1.08 -1.07 -4.97 116.67 114.41 1xtz s ASP 63 Ca 0.46 -0.08 0.28 0.00 -0.52 0.00 0.00 52.55 52.69 1xtz s ASP 63 Cb 0.22 -2.09 1.61 0.00 -1.46 0.00 0.00 42.92 41.19 1xtz s ASP 63 CO 0.37 -0.07 2.06 1.55 0.52 0.00 0.00 175.17 179.60 1xtz h PRO 64 N 8.36 0.00 -0.42 4.34 0.13 -1.86 0.18 132.00 142.73 1xtz h PRO 64 Ca -0.35 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 1xtz h PRO 64 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1xtz h PRO 64 CO 0.56 0.00 -0.15 -0.22 -0.23 0.00 0.00 178.00 177.96 1xtz h LYS 65 N 0.00 0.79 0.00 0.86 3.64 -1.93 -3.37 116.57 116.56 1xtz h LYS 65 Ca 0.11 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1xtz h LYS 65 Cb 0.63 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1xtz h LYS 65 CO -0.00 0.89 -0.71 1.19 -2.27 0.00 0.00 179.45 178.55 1xtz n PHE 66 N -4.14 0.00 -0.31 1.91 3.01 -0.16 -4.69 117.46 113.08 1xtz n PHE 66 Ca 0.01 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.62 1xtz n PHE 66 Cb 0.39 -0.06 0.31 0.00 -0.01 0.00 0.00 39.48 40.11 1xtz n PHE 66 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 1xtz h TYR 67 N 0.00 0.26 -0.20 1.38 3.20 -0.71 0.36 116.97 121.27 1xtz h TYR 67 Ca 0.00 0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 1xtz h TYR 67 Cb 0.23 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.53 1xtz h TYR 67 CO 0.00 -0.30 -0.13 0.93 -1.64 0.00 0.00 178.16 177.03 1xtz h GLU 68 N 0.13 0.44 -0.24 1.82 4.39 -1.83 0.12 114.58 119.41 1xtz h GLU 68 Ca 0.58 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 60.02 1xtz h GLU 68 Cb 1.22 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 1xtz h GLU 68 CO -0.74 0.75 -0.09 0.28 -1.16 0.00 0.00 179.01 178.06 1xtz h VAL 69 N 0.13 1.29 0.00 3.13 2.07 -1.71 -3.23 116.25 117.93 1xtz h VAL 69 Ca 0.04 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.38 1xtz h VAL 69 Cb 0.64 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1xtz h VAL 69 CO 0.04 0.35 -0.28 0.00 0.02 0.00 0.00 177.57 177.69 1xtz h ALA 70 N 0.74 1.13 -0.35 1.67 0.00 -0.25 -2.05 119.26 120.15 1xtz h ALA 70 Ca 0.06 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.80 1xtz h ALA 70 Cb 0.57 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1xtz h ALA 70 CO 0.03 0.35 0.25 0.77 0.00 0.00 0.00 179.25 180.65 1xtz h SER 71 N 0.00 0.07 0.15 0.00 0.02 -0.78 -2.55 113.55 110.46 1xtz h SER 71 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xtz h SER 71 Cb 0.69 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1xtz h SER 71 CO 0.04 0.04 -0.46 0.29 -1.14 0.00 0.00 176.83 175.59 1xtz n LYS 72 N -4.45 0.76 -1.78 3.45 5.02 -0.78 -4.76 118.16 115.62 1xtz n LYS 72 Ca 0.05 -0.55 -0.41 0.00 -2.02 0.00 0.00 58.31 55.38 1xtz n LYS 72 Cb 0.38 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1xtz n LYS 72 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1xtz s PHE 73 N -2.62 2.58 -0.17 2.13 2.99 -0.96 -4.94 117.98 116.98 1xtz s PHE 73 Ca 0.18 1.11 -0.01 0.00 0.00 0.00 0.00 56.93 58.22 1xtz s PHE 73 Cb 0.18 -4.05 -0.00 0.00 0.00 0.00 0.00 43.02 39.15 1xtz s PHE 73 CO 0.61 -3.12 -0.13 0.42 -0.00 0.00 0.00 175.22 173.00 1xtz s ILE 74 N -1.00 2.81 -0.18 0.64 1.01 0.03 -4.05 121.20 120.47 1xtz s ILE 74 Ca 0.54 -0.71 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 1xtz s ILE 74 Cb -0.47 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 1xtz s ILE 74 CO 0.62 0.50 0.02 0.00 0.00 0.00 0.00 174.94 176.07 1xtz s ILE 76 N 0.46 4.04 0.53 0.00 -1.09 0.44 -0.52 121.20 125.07 1xtz s ILE 76 Ca 0.00 -0.28 -0.04 0.00 -2.23 0.00 0.00 60.65 58.10 1xtz s ILE 76 Cb -0.13 -2.84 -0.00 0.00 -1.58 0.00 0.00 42.46 37.90 1xtz s ILE 76 CO 0.02 0.41 0.82 -2.16 -1.23 0.00 0.00 174.94 172.80 1xtz s PRO 77 N 1.16 3.09 0.00 2.79 0.04 -1.26 -0.94 135.00 139.88 1xtz s PRO 77 Ca 0.03 -0.07 0.08 0.00 0.04 0.00 0.00 61.00 61.08 1xtz s PRO 77 Cb -0.14 -2.36 0.20 0.00 0.04 0.00 0.00 34.50 32.24 1xtz s PRO 77 CO 0.02 -0.49 1.12 0.25 0.04 0.00 0.00 177.00 177.93 1xtz n THR 78 N -2.40 0.81 0.00 1.26 -2.24 -1.13 -4.88 114.28 105.71 1xtz n THR 78 Ca 0.03 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 1xtz n THR 78 Cb 0.57 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 1xtz n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xtz n GLY 79 N 0.32 -0.22 0.19 3.38 0.00 -1.26 -4.19 105.19 103.41 1xtz n GLY 79 Ca 0.08 -0.92 -0.17 0.00 0.00 0.00 0.00 46.02 45.01 1xtz n GLY 79 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xtz h PHE 80 N 0.00 0.89 -0.63 1.61 -1.00 -1.98 0.15 116.94 115.97 1xtz h PHE 80 Ca 0.00 -0.41 -0.08 0.00 2.81 0.00 0.00 57.97 60.28 1xtz h PHE 80 Cb 0.00 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 1xtz h PHE 80 CO 0.00 1.23 0.07 1.96 -1.61 0.00 0.00 178.31 179.96 1xtz h GLN 81 N 0.29 1.07 0.43 1.51 4.20 -1.95 -0.71 115.11 119.95 1xtz h GLN 81 Ca -0.06 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.32 1xtz h GLN 81 Cb 1.34 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.01 1xtz h GLN 81 CO 0.14 1.01 -0.21 1.03 -0.67 0.00 0.00 178.83 180.13 1xtz h SER 82 N 0.98 -0.49 -0.65 1.46 0.87 -1.77 0.19 113.55 114.14 1xtz h SER 82 Ca 0.19 -0.00 0.12 0.00 -1.23 0.00 0.00 61.79 60.86 1xtz h SER 82 Cb 0.48 0.13 -0.09 0.00 -0.44 0.00 0.00 62.40 62.48 1xtz h SER 82 CO 0.02 -0.32 0.19 -0.09 -0.53 0.00 0.00 176.83 176.10 1xtz h ARG 83 N -0.61 0.32 -0.57 2.24 2.43 -0.57 -1.63 114.38 115.98 1xtz h ARG 83 Ca -0.06 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1xtz h ARG 83 Cb 0.46 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1xtz h ARG 83 CO 0.10 0.21 0.37 -0.97 -1.51 0.00 0.00 179.97 178.17 1xtz h ASN 84 N 0.33 0.62 -0.63 -3.80 -0.73 -0.95 -2.17 115.58 108.25 1xtz h ASN 84 Ca 0.34 -0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.50 1xtz h ASN 84 Cb 0.50 -0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 1xtz h ASN 84 CO -0.39 0.45 0.37 0.25 -0.37 0.00 0.00 177.43 177.74 1xtz h LEU 85 N 0.74 0.78 0.24 0.34 5.85 0.30 -0.32 115.31 123.24 1xtz h LEU 85 Ca 0.22 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1xtz h LEU 85 Cb -0.05 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.78 1xtz h LEU 85 CO -0.06 0.61 -0.11 0.40 -0.34 0.00 0.00 178.44 178.94 1xtz h ILE 86 N 0.89 0.83 -0.32 4.05 2.04 -1.17 -2.51 117.51 121.33 1xtz h ILE 86 Ca 0.23 -0.48 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 1xtz h ILE 86 Cb -0.01 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1xtz h ILE 86 CO -0.04 0.10 -0.15 -0.07 0.00 0.00 0.00 178.15 178.00 1xtz h LEU 87 N -0.56 0.68 -1.86 1.44 3.38 -1.19 -1.70 115.31 115.50 1xtz h LEU 87 Ca -0.03 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 1xtz h LEU 87 Cb 0.41 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1xtz h LEU 87 CO 0.05 0.93 -0.07 -0.78 0.09 0.00 0.00 178.44 178.66 1xtz h ASP 88 N 0.43 0.00 -0.32 -0.43 1.82 -1.14 0.74 116.42 117.52 1xtz h ASP 88 Ca 0.07 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.71 1xtz h ASP 88 Cb 0.67 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.68 1xtz h ASP 88 CO 0.05 0.07 0.00 0.59 -1.61 0.00 0.00 179.24 178.34 1xtz n ASN 89 N -3.32 2.27 -1.75 2.28 3.02 -0.85 -4.93 115.26 111.98 1xtz n ASN 89 Ca -0.01 -1.87 -0.16 0.00 -0.03 0.00 0.00 54.58 52.51 1xtz n ASN 89 Cb 0.26 -0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 1xtz n ASN 89 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1xtz n LYS 90 N 0.72 -1.25 -3.45 3.52 4.76 0.25 -4.63 118.16 118.08 1xtz n LYS 90 Ca 0.16 0.80 -0.28 0.00 -2.87 0.00 0.00 58.31 56.12 1xtz n LYS 90 Cb 0.40 -5.17 -0.03 0.00 -1.84 0.00 0.00 35.03 28.39 1xtz n LYS 90 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1xtz s LEU 91 N -4.48 4.11 0.25 -0.35 1.43 -0.70 -5.02 118.68 113.92 1xtz s LEU 91 Ca 0.00 0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 53.42 1xtz s LEU 91 Cb 0.00 -3.42 -0.09 0.00 0.03 0.00 0.00 46.19 42.71 1xtz s LEU 91 CO 0.00 -0.15 1.30 -1.10 0.23 0.00 0.00 176.35 176.63 1xtz s GLN 92 N -3.47 4.39 -0.23 1.70 -0.21 -1.26 -4.48 119.66 116.11 1xtz s GLN 92 Ca 0.42 2.10 -0.08 0.00 0.02 0.00 0.00 55.36 57.83 1xtz s GLN 92 Cb -0.11 -3.15 -0.04 0.00 1.00 0.00 0.00 33.01 30.72 1xtz s GLN 92 CO 0.29 -0.20 0.08 -1.17 -2.12 0.00 0.00 175.29 172.18 1xtz s LEU 93 N -0.81 3.63 0.48 2.90 2.96 -1.26 -0.93 118.68 125.65 1xtz s LEU 93 Ca 0.53 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 54.38 1xtz s LEU 93 Cb -0.38 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 1xtz s LEU 93 CO 0.44 0.03 0.04 -0.83 -1.32 0.00 0.00 176.35 174.71 1xtz s GLY 94 N 1.22 2.84 0.07 7.98 0.00 0.33 -4.86 107.32 114.90 1xtz s GLY 94 Ca 0.05 -0.96 0.08 0.00 0.00 0.00 0.00 44.72 43.89 1xtz s GLY 94 CO 0.04 -2.15 -0.17 -1.35 0.00 0.00 0.00 173.10 169.47 1xtz s SER 95 N -3.86 3.92 0.58 1.64 1.04 -1.26 -4.25 113.70 111.51 1xtz s SER 95 Ca 0.16 -0.46 0.27 0.00 0.48 0.00 0.00 55.95 56.40 1xtz s SER 95 Cb 0.03 -0.63 1.68 0.00 0.10 0.00 0.00 66.02 67.21 1xtz s SER 95 CO 0.08 0.22 2.18 -0.29 0.98 0.00 0.00 173.24 176.41 1xtz h ILE 96 N 3.72 0.57 -0.29 -1.02 2.10 -1.91 0.49 117.51 121.18 1xtz h ILE 96 Ca -0.49 0.00 -0.16 0.00 1.08 0.00 0.00 64.86 65.30 1xtz h ILE 96 Cb 1.16 0.93 -0.01 0.00 -1.09 0.00 0.00 36.82 37.81 1xtz h ILE 96 CO 0.48 0.00 -0.45 -0.33 -1.08 0.00 0.00 178.15 176.77 1xtz h GLU 97 N 0.00 0.75 0.13 2.19 3.07 -1.97 -2.38 114.58 116.37 1xtz h GLU 97 Ca 0.04 -0.42 -0.31 0.00 -0.50 0.00 0.00 59.36 58.17 1xtz h GLU 97 Cb 0.22 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1xtz h GLU 97 CO -0.00 1.04 -1.51 0.37 -1.40 0.00 0.00 179.01 177.52 1xtz h GLN 98 N 0.60 0.28 -2.40 2.33 4.15 -1.77 -3.39 115.11 114.92 1xtz h GLN 98 Ca 0.04 -0.48 -0.66 0.00 0.77 0.00 0.00 58.65 58.32 1xtz h GLN 98 Cb 1.01 0.18 -0.38 0.00 0.21 0.00 0.00 27.48 28.50 1xtz h GLN 98 CO 0.10 1.16 -0.21 0.66 -1.93 0.00 0.00 178.83 178.61 1xtz n TYR 99 N -3.49 3.27 0.28 3.99 4.02 0.09 -4.93 117.16 120.39 1xtz n TYR 99 Ca -0.16 -3.72 0.15 0.00 -0.01 0.00 0.00 57.90 54.17 1xtz n TYR 99 Cb 1.05 -0.75 0.53 0.00 -0.02 0.00 0.00 39.34 40.14 1xtz n TYR 99 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1xtz h PRO 100 N 4.53 0.00 -4.28 -0.72 0.13 -1.63 -3.40 132.00 126.64 1xtz h PRO 100 Ca 0.20 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.59 1xtz h PRO 100 Cb 0.65 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.54 1xtz h PRO 100 CO 0.98 0.00 -0.33 1.03 -0.23 0.00 0.00 178.00 179.45 1xtz s ARG 101 N -3.51 2.88 -0.03 0.86 3.00 -1.26 -4.85 118.95 116.04 1xtz s ARG 101 Ca 0.03 -1.48 -0.15 0.00 0.00 0.00 0.00 55.73 54.13 1xtz s ARG 101 Cb 0.08 -4.10 -0.05 0.00 0.00 0.00 0.00 34.95 30.88 1xtz s ARG 101 CO 0.57 -1.10 0.39 0.42 0.00 0.00 0.00 175.30 175.58 1xtz s ILE 102 N 1.58 5.10 -0.09 1.52 1.01 -0.55 -4.87 121.20 124.89 1xtz s ILE 102 Ca 0.04 0.80 -0.27 0.00 0.00 0.00 0.00 60.65 61.21 1xtz s ILE 102 Cb -0.26 -3.70 -0.24 0.00 0.01 0.00 0.00 42.46 38.27 1xtz s ILE 102 CO 0.04 0.53 0.94 0.44 0.00 0.00 0.00 174.94 176.90 1xtz h ASP 103 N 5.14 0.04 -3.89 3.58 3.32 -1.17 -1.32 116.42 122.11 1xtz h ASP 103 Ca -0.50 -0.83 -0.15 0.00 0.02 0.00 0.00 57.03 55.58 1xtz h ASP 103 Cb 1.21 -0.01 -0.25 0.00 0.22 0.00 0.00 39.33 40.50 1xtz h ASP 103 CO 0.64 0.86 -0.36 -0.51 -1.72 0.00 0.00 179.24 178.16 1xtz s ILE 104 N -2.90 0.00 0.01 0.35 2.07 -1.08 -2.76 121.20 116.89 1xtz s ILE 104 Ca -0.18 -0.02 0.06 0.00 -1.41 0.00 0.00 60.65 59.10 1xtz s ILE 104 Cb -0.01 -0.44 -0.02 0.00 0.13 0.00 0.00 42.46 42.12 1xtz s ILE 104 CO 0.69 -0.01 -0.18 0.00 -1.91 0.00 0.00 174.94 173.54 1xtz s ALA 105 N 0.10 1.48 -0.05 1.50 0.00 -0.21 0.08 121.76 124.66 1xtz s ALA 105 Ca -0.01 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.18 1xtz s ALA 105 Cb -0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 1xtz s ALA 105 CO 0.01 0.35 -0.23 -0.06 0.00 0.00 0.00 175.76 175.82 1xtz s PHE 106 N -0.55 2.48 0.23 0.00 0.40 -0.35 -0.51 117.98 119.67 1xtz s PHE 106 Ca 0.06 -0.57 -0.19 0.00 -0.60 0.00 0.00 56.93 55.63 1xtz s PHE 106 Cb -0.07 -1.60 0.03 0.00 0.51 0.00 0.00 43.02 41.89 1xtz s PHE 106 CO 0.00 -0.11 0.62 0.34 0.70 0.00 0.00 175.22 176.76 1xtz s ASP 107 N -0.32 -0.29 0.76 1.36 3.68 -0.77 -0.85 116.67 120.24 1xtz s ASP 107 Ca 0.01 -0.51 -0.04 0.00 2.13 0.00 0.00 52.55 54.14 1xtz s ASP 107 Cb -0.13 0.65 0.09 0.00 -1.45 0.00 0.00 42.92 42.09 1xtz s ASP 107 CO 0.02 -1.18 0.60 0.61 0.13 0.00 0.00 175.17 175.36 1xtz n GLY 108 N -0.40 -0.19 3.40 2.66 0.00 -1.26 -0.72 105.19 108.68 1xtz n GLY 108 Ca -0.08 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 43.93 1xtz n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xtz s ALA 109 N -3.42 -1.34 0.01 4.61 0.00 -1.26 -4.81 121.76 115.55 1xtz s ALA 109 Ca 0.37 0.92 0.11 0.00 0.00 0.00 0.00 51.96 53.36 1xtz s ALA 109 Cb -0.02 -0.01 -0.15 0.00 0.00 0.00 0.00 23.12 22.94 1xtz s ALA 109 CO 0.25 -0.32 1.16 -0.44 0.00 0.00 0.00 175.76 176.41 1xtz h ASP 110 N 3.46 0.00 -4.96 0.00 3.32 -0.94 -3.48 116.42 113.83 1xtz h ASP 110 Ca -0.28 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.72 1xtz h ASP 110 Cb 1.16 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.52 1xtz h ASP 110 CO 0.38 0.86 0.21 -0.70 -1.72 0.00 0.00 179.24 178.27 1xtz s GLU 111 N -2.76 1.05 -0.04 3.56 2.12 -0.99 -4.78 118.70 116.86 1xtz s GLU 111 Ca 0.00 0.23 0.02 0.00 0.36 0.00 0.00 54.97 55.59 1xtz s GLU 111 Cb 0.09 0.49 0.01 0.00 0.26 0.00 0.00 34.13 34.98 1xtz s GLU 111 CO 0.81 -0.33 -0.10 0.08 -0.54 0.00 0.00 175.26 175.17 1xtz s VAL 112 N -1.26 0.90 0.48 3.70 1.01 0.27 -1.23 120.40 124.27 1xtz s VAL 112 Ca -0.10 -0.40 0.07 0.00 0.00 0.00 0.00 61.98 61.55 1xtz s VAL 112 Cb -0.00 -0.82 0.08 0.00 0.00 0.00 0.00 36.38 35.64 1xtz s VAL 112 CO 0.09 0.29 0.66 -0.90 0.00 0.00 0.00 175.10 175.24 1xtz n ASP 113 N 3.47 1.65 0.23 3.32 3.85 -0.13 -1.23 116.55 127.71 1xtz n ASP 113 Ca -0.20 -2.22 0.16 0.00 -0.71 0.00 0.00 54.79 51.82 1xtz n ASP 113 Cb 0.53 -0.36 0.61 0.00 -1.35 0.00 0.00 41.12 40.55 1xtz n ASP 113 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1xtz h GLU 114 N 0.00 0.00 -0.58 0.11 4.11 -1.72 -0.60 114.58 115.90 1xtz h GLU 114 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.21 1xtz h GLU 114 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1xtz h GLU 114 CO 0.31 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.48 1xtz n ASN 115 N -2.82 4.53 -2.81 3.06 5.03 -1.26 -4.33 115.26 116.65 1xtz n ASN 115 Ca 0.01 -2.48 -0.21 0.00 0.87 0.00 0.00 54.58 52.77 1xtz n ASN 115 Cb 0.29 -0.54 0.02 0.00 -1.02 0.00 0.00 39.78 38.52 1xtz n ASN 115 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1xtz n LEU 116 N 0.88 -2.30 -4.83 3.41 4.77 -0.23 -4.87 117.00 113.82 1xtz n LEU 116 Ca 0.24 -0.18 -0.35 0.00 -0.03 0.00 0.00 56.01 55.69 1xtz n LEU 116 Cb 0.86 -2.88 -0.06 0.00 -2.33 0.00 0.00 43.42 39.01 1xtz n LEU 116 CO 0.22 0.06 0.35 -1.10 -1.33 0.00 0.00 177.39 175.59 1xtz s GLN 117 N -5.47 4.10 0.07 3.23 -1.52 -1.26 -4.32 119.66 114.49 1xtz s GLN 117 Ca 0.19 0.68 0.08 0.00 -1.95 0.00 0.00 55.36 54.37 1xtz s GLN 117 Cb -0.09 -2.81 -0.03 0.00 -0.22 0.00 0.00 33.01 29.86 1xtz s GLN 117 CO 0.24 0.38 -0.23 -0.51 -0.25 0.00 0.00 175.29 174.92 1xtz s LEU 118 N -2.17 2.23 -0.20 2.90 1.43 -0.87 -0.96 118.68 121.03 1xtz s LEU 118 Ca 0.43 -0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 1xtz s LEU 118 Cb -0.15 -1.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.98 1xtz s LEU 118 CO 0.20 0.15 0.18 -0.63 0.23 0.00 0.00 176.35 176.48 1xtz s ILE 119 N -0.94 5.37 0.18 -0.59 1.01 -0.37 -1.83 121.20 124.03 1xtz s ILE 119 Ca 0.09 0.28 0.02 0.00 0.00 0.00 0.00 60.65 61.04 1xtz s ILE 119 Cb -0.10 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.81 1xtz s ILE 119 CO 0.03 0.40 -0.01 -0.54 0.00 0.00 0.00 174.94 174.82 1xtz s LYS 120 N 0.58 1.13 0.00 2.79 1.02 0.79 -0.18 119.74 125.87 1xtz s LYS 120 Ca 0.10 -1.54 0.00 0.00 0.02 0.00 0.00 55.97 54.55 1xtz s LYS 120 Cb -0.12 -0.34 0.00 0.00 -0.52 0.00 0.00 37.83 36.85 1xtz s LYS 120 CO 0.01 -0.11 0.00 0.41 -0.92 0.00 0.00 175.35 174.74 1xtz n GLY 121 N -0.25 1.05 0.40 -3.33 0.00 -1.26 -4.29 105.19 97.51 1xtz n GLY 121 Ca -0.07 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.14 1xtz n GLY 121 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xtz h GLY 122 N 0.00 0.76 -1.55 -0.02 0.00 -1.96 0.15 103.07 100.46 1xtz h GLY 122 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1xtz h GLY 122 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1xtz n GLY 123 N -1.53 0.99 2.45 4.60 0.00 -1.26 -4.95 105.19 105.49 1xtz n GLY 123 Ca 0.18 -0.44 -0.07 0.00 0.00 0.00 0.00 46.02 45.69 1xtz n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xtz n ALA 124 N 0.64 -0.11 -1.13 4.61 0.00 0.54 -4.89 120.51 120.17 1xtz n ALA 124 Ca 0.13 0.12 0.02 0.00 0.00 0.00 0.00 53.44 53.71 1xtz n ALA 124 Cb 0.37 -1.20 0.26 0.00 0.00 0.00 0.00 19.45 18.88 1xtz n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xtz h LEU 126 N 1.79 0.09 0.42 0.00 8.10 -1.90 -2.26 115.31 121.55 1xtz h LEU 126 Ca 0.12 -0.01 -0.02 0.00 0.11 0.00 0.00 57.88 58.08 1xtz h LEU 126 Cb 1.71 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 41.91 1xtz h LEU 126 CO 0.39 0.11 -0.20 0.15 -4.11 0.00 0.00 178.44 174.78 1xtz h PHE 127 N 0.10 -0.52 0.00 0.17 3.04 -1.91 -0.87 116.94 116.94 1xtz h PHE 127 Ca 0.02 -0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.86 1xtz h PHE 127 Cb 0.08 0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.74 1xtz h PHE 127 CO 0.00 -0.20 -0.49 1.96 -2.02 0.00 0.00 178.31 177.56 1xtz h GLN 128 N -0.85 0.00 -0.50 1.11 4.20 -1.80 -0.43 115.11 116.84 1xtz h GLN 128 Ca -0.06 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.69 1xtz h GLN 128 Cb 0.55 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 1xtz h GLN 128 CO 0.09 0.49 0.26 0.93 -0.67 0.00 0.00 178.83 179.93 1xtz h GLU 129 N 0.00 0.49 -0.08 1.46 5.08 -1.38 -2.06 114.58 118.09 1xtz h GLU 129 Ca -0.00 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.11 1xtz h GLU 129 Cb 0.91 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1xtz h GLU 129 CO 0.06 0.32 -0.83 -0.22 -1.00 0.00 0.00 179.01 177.35 1xtz h LYS 130 N 0.50 0.57 -0.40 2.33 3.64 -0.67 0.02 116.57 122.57 1xtz h LYS 130 Ca 0.22 -0.51 0.03 0.00 -1.27 0.00 0.00 60.65 59.11 1xtz h LYS 130 Cb 0.11 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 1xtz h LYS 130 CO -0.15 1.13 0.21 1.25 -2.27 0.00 0.00 179.45 179.63 1xtz h LEU 131 N 0.37 0.31 0.28 5.20 5.85 -1.02 -0.71 115.31 125.60 1xtz h LEU 131 Ca -0.06 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1xtz h LEU 131 Cb 1.44 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.43 1xtz h LEU 131 CO 0.15 0.22 -0.14 0.58 -0.34 0.00 0.00 178.44 178.92 1xtz h VAL 132 N 0.42 0.73 -0.58 1.05 2.07 -1.38 -2.79 116.25 115.77 1xtz h VAL 132 Ca 0.17 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 1xtz h VAL 132 Cb 0.06 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1xtz h VAL 132 CO -0.11 0.12 0.21 0.77 0.02 0.00 0.00 177.57 178.58 1xtz h SER 133 N -0.74 0.79 0.36 0.57 4.64 -0.87 -0.68 113.55 117.62 1xtz h SER 133 Ca -0.04 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1xtz h SER 133 Cb 0.50 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1xtz h SER 133 CO 0.06 0.73 -0.05 0.35 -0.87 0.00 0.00 176.83 177.05 1xtz n THR 134 N -4.31 0.00 1.26 2.95 -2.24 -0.28 -2.81 114.28 108.85 1xtz n THR 134 Ca 0.05 -0.03 0.13 0.00 -2.27 0.00 0.00 64.05 61.92 1xtz n THR 134 Cb 0.18 -0.29 0.36 0.00 -2.10 0.00 0.00 70.33 68.48 1xtz n THR 134 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xtz n SER 135 N -1.05 2.10 -4.88 3.42 7.64 -0.28 -4.95 113.62 115.62 1xtz n SER 135 Ca 0.16 -1.70 -0.35 0.00 1.01 0.00 0.00 58.87 57.98 1xtz n SER 135 Cb 0.24 -0.02 -0.06 0.00 -1.01 0.00 0.00 64.21 63.36 1xtz n SER 135 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xtz s ALA 136 N -1.96 3.88 0.22 -0.43 0.00 -1.12 -1.48 121.76 120.86 1xtz s ALA 136 Ca 0.34 -0.71 -0.07 0.00 0.00 0.00 0.00 51.96 51.53 1xtz s ALA 136 Cb 0.20 -1.90 0.17 0.00 0.00 0.00 0.00 23.12 21.60 1xtz s ALA 136 CO 0.32 0.67 1.75 0.87 0.00 0.00 0.00 175.76 179.37 1xtz h LYS 137 N 4.48 1.10 -4.85 0.00 1.57 -1.21 -3.43 116.57 114.23 1xtz h LYS 137 Ca -0.52 -0.25 -0.49 0.00 -1.87 0.00 0.00 60.65 57.52 1xtz h LYS 137 Cb 1.21 -0.15 -0.31 0.00 0.08 0.00 0.00 32.23 33.05 1xtz h LYS 137 CO 0.62 0.96 -0.81 0.99 -0.57 0.00 0.00 179.45 180.64 1xtz s THR 138 N -5.33 1.08 -0.14 -0.16 2.01 -1.11 -5.04 115.64 106.94 1xtz s THR 138 Ca -0.12 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.39 1xtz s THR 138 Cb 0.15 -0.95 0.02 0.00 0.01 0.00 0.00 72.50 71.73 1xtz s THR 138 CO 0.84 0.33 -0.17 0.12 -0.69 0.00 0.00 174.62 175.05 1xtz s PHE 139 N 0.21 2.27 -0.11 4.92 5.36 -1.26 -1.04 117.98 128.33 1xtz s PHE 139 Ca -0.05 -1.19 0.04 0.00 -0.96 0.00 0.00 56.93 54.77 1xtz s PHE 139 Cb -0.11 -1.62 0.00 0.00 -0.34 0.00 0.00 43.02 40.96 1xtz s PHE 139 CO 0.02 -0.60 -0.23 0.42 -1.46 0.00 0.00 175.22 173.36 1xtz s ILE 140 N 1.14 2.11 -0.05 3.12 -1.09 0.33 -1.42 121.20 125.35 1xtz s ILE 140 Ca -0.02 -1.00 -0.09 0.00 -2.23 0.00 0.00 60.65 57.32 1xtz s ILE 140 Cb -0.14 -1.81 -0.05 0.00 -1.58 0.00 0.00 42.46 38.88 1xtz s ILE 140 CO -0.06 0.56 0.25 -0.69 -1.23 0.00 0.00 174.94 173.77 1xtz s VAL 141 N 0.42 5.32 -0.06 2.92 1.01 -0.46 -1.86 120.40 127.70 1xtz s VAL 141 Ca -0.17 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.19 1xtz s VAL 141 Cb -0.17 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1xtz s VAL 141 CO 0.07 0.52 -0.10 -0.69 0.00 0.00 0.00 175.10 174.90 1xtz s VAL 142 N -1.13 0.96 0.23 2.92 1.01 0.10 -0.27 120.40 124.22 1xtz s VAL 142 Ca 0.21 -0.39 -0.19 0.00 0.00 0.00 0.00 61.98 61.62 1xtz s VAL 142 Cb -0.14 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.37 1xtz s VAL 142 CO 0.10 0.31 0.59 0.00 0.00 0.00 0.00 175.10 176.11 1xtz s ALA 143 N 0.67 -0.99 0.50 5.51 0.00 0.80 -4.10 121.76 124.14 1xtz s ALA 143 Ca -0.13 -0.29 -0.05 0.00 0.00 0.00 0.00 51.96 51.49 1xtz s ALA 143 Cb -0.15 0.89 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 1xtz s ALA 143 CO 0.03 -0.89 0.80 0.16 0.00 0.00 0.00 175.76 175.85 1xtz s ASP 144 N -2.90 6.13 0.63 0.00 -4.77 -1.26 -0.38 116.67 114.12 1xtz s ASP 144 Ca 0.11 0.86 0.37 0.00 -3.30 0.00 0.00 52.55 50.59 1xtz s ASP 144 Cb -0.03 -2.12 2.13 0.00 -1.09 0.00 0.00 42.92 41.81 1xtz s ASP 144 CO 0.02 -0.66 2.32 0.77 0.70 0.00 0.00 175.17 178.31 1xtz h SER 145 N 0.17 0.00 0.21 2.11 4.64 -1.14 -0.99 113.55 118.55 1xtz h SER 145 Ca -0.47 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1xtz h SER 145 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1xtz h SER 145 CO 0.61 0.00 -0.05 0.03 -0.87 0.00 0.00 176.83 176.55 1xtz h ARG 146 N 0.00 0.00 0.00 4.77 3.08 -1.94 -2.30 114.38 117.99 1xtz h ARG 146 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xtz h ARG 146 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1xtz h ARG 146 CO -0.00 0.05 0.00 1.63 -1.07 0.00 0.00 179.97 180.58 1xtz n LYS 147 N -3.62 0.22 -2.90 0.04 4.01 -0.37 -4.66 118.16 110.87 1xtz n LYS 147 Ca -0.02 0.40 -0.43 0.00 -0.51 0.00 0.00 58.31 57.75 1xtz n LYS 147 Cb 0.16 -1.88 -0.04 0.00 -0.51 0.00 0.00 35.03 32.75 1xtz n LYS 147 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1xtz s LYS 148 N -3.30 3.26 0.31 1.97 2.20 -0.87 -0.56 119.74 122.75 1xtz s LYS 148 Ca 0.05 -0.46 -0.29 0.00 -0.36 0.00 0.00 55.97 54.91 1xtz s LYS 148 Cb 0.10 -4.09 -0.10 0.00 -1.51 0.00 0.00 37.83 32.23 1xtz s LYS 148 CO 0.43 -1.49 1.31 0.45 -0.36 0.00 0.00 175.35 175.70 1xtz s SER 149 N 2.93 6.79 0.37 1.43 0.15 -0.36 -4.93 113.70 120.09 1xtz s SER 149 Ca 0.26 2.64 0.18 0.00 0.70 0.00 0.00 55.95 59.74 1xtz s SER 149 Cb -0.14 -2.64 1.16 0.00 -1.71 0.00 0.00 66.02 62.69 1xtz s SER 149 CO 0.17 -0.53 1.67 -0.65 1.20 0.00 0.00 173.24 175.09 1xtz h PRO 150 N 3.77 0.27 0.00 5.44 0.11 -1.95 -3.43 132.00 136.21 1xtz h PRO 150 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xtz h PRO 150 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1xtz h PRO 150 CO 0.68 0.18 0.00 1.17 -0.21 0.00 0.00 178.00 179.82 1xtz n LYS 151 N -4.93 0.00 -4.21 1.05 4.81 -1.26 -4.90 118.16 108.73 1xtz n LYS 151 Ca 0.32 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.45 1xtz n LYS 151 Cb 1.07 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 36.03 1xtz n LYS 151 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1xtz s HIS 152 N -2.00 2.96 0.48 5.64 3.76 -1.26 -2.27 115.29 122.59 1xtz s HIS 152 Ca 0.00 -0.03 -0.24 0.00 -0.15 0.00 0.00 55.06 54.64 1xtz s HIS 152 Cb 0.00 -1.55 -0.08 0.00 1.11 0.00 0.00 32.58 32.06 1xtz s HIS 152 CO 0.00 0.46 1.29 1.28 -0.85 0.00 0.00 174.74 176.91 1xtz n LEU 153 N 0.83 4.54 0.00 0.89 4.77 -1.26 -3.07 117.00 123.70 1xtz n LEU 153 Ca -0.12 1.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 1xtz n LEU 153 Cb 0.52 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 1xtz n LEU 153 CO 0.37 -0.69 0.00 0.61 -1.33 0.00 0.00 177.39 176.35 1xtz n GLY 154 N 0.81 0.75 0.05 -0.72 0.00 -1.26 -0.41 105.19 104.41 1xtz n GLY 154 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 1xtz n GLY 154 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1xtz h LYS 155 N 2.61 0.00 0.00 1.61 1.63 -1.82 -3.36 116.57 117.23 1xtz h LYS 155 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1xtz h LYS 155 Cb 0.00 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1xtz h LYS 155 CO 0.00 0.00 -1.92 0.09 -3.45 0.00 0.00 179.45 174.17 1xtz n ASN 156 N -4.61 0.39 -4.52 4.20 3.02 -1.26 -4.77 115.26 107.70 1xtz n ASN 156 Ca -0.01 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.11 1xtz n ASN 156 Cb 0.03 1.92 -0.07 0.00 -0.61 0.00 0.00 39.78 41.06 1xtz n ASN 156 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1xtz s TRP 157 N -3.40 3.06 -1.42 3.10 -0.11 -1.26 -4.89 118.94 114.03 1xtz s TRP 157 Ca -0.07 -0.02 0.13 0.00 1.22 0.00 0.00 56.10 57.36 1xtz s TRP 157 Cb 0.13 -3.36 0.06 0.00 -1.50 0.00 0.00 33.47 28.80 1xtz s TRP 157 CO 0.84 -0.86 0.83 0.54 -4.62 0.00 0.00 176.95 173.67 1xtz n ARG 158 N 6.28 1.25 0.02 5.86 5.12 -1.26 -4.26 116.66 129.68 1xtz n ARG 158 Ca -0.01 -1.03 0.13 0.00 -1.93 0.00 0.00 57.85 55.00 1xtz n ARG 158 Cb 0.48 -1.21 0.40 0.00 -1.16 0.00 0.00 32.46 30.97 1xtz n ARG 158 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xtz n GLN 159 N 0.35 0.07 0.00 5.56 0.00 -1.26 -4.92 117.38 117.19 1xtz n GLN 159 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 57.00 57.10 1xtz n GLN 159 Cb 0.30 -1.56 0.00 0.00 0.00 0.00 0.00 30.24 28.98 1xtz n GLN 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1xtz n GLY 160 N 1.45 2.75 3.67 2.61 0.00 -1.26 -4.48 105.19 109.94 1xtz n GLY 160 Ca 0.06 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 1xtz n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xtz s VAL 161 N -2.80 4.40 0.30 1.61 1.01 0.17 -4.65 120.40 120.44 1xtz s VAL 161 Ca 0.00 1.70 -0.29 0.00 0.00 0.00 0.00 61.98 63.38 1xtz s VAL 161 Cb 0.00 -4.09 -0.10 0.00 0.00 0.00 0.00 36.38 32.19 1xtz s VAL 161 CO 0.00 -0.08 1.19 -2.84 0.00 0.00 0.00 175.10 173.37 1xtz s PRO 162 N 2.82 4.51 -0.05 2.72 0.02 -1.26 -0.43 135.00 143.33 1xtz s PRO 162 Ca 0.53 1.98 -0.00 0.00 0.02 0.00 0.00 61.00 63.52 1xtz s PRO 162 Cb -0.21 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.19 1xtz s PRO 162 CO 0.16 0.03 -0.01 0.42 -0.33 0.00 0.00 177.00 177.27 1xtz s ILE 163 N -1.09 0.35 -0.05 2.83 1.01 0.15 0.44 121.20 124.84 1xtz s ILE 163 Ca 0.47 0.07 -0.20 0.00 0.00 0.00 0.00 60.65 60.98 1xtz s ILE 163 Cb -0.35 -0.47 -0.05 0.00 0.01 0.00 0.00 42.46 41.60 1xtz s ILE 163 CO 0.46 0.22 0.58 -0.70 0.00 0.00 0.00 174.94 175.50 1xtz s GLU 164 N 1.51 4.34 0.08 2.79 2.12 0.14 -0.32 118.70 129.37 1xtz s GLU 164 Ca -0.02 0.68 0.04 0.00 0.36 0.00 0.00 54.97 56.02 1xtz s GLU 164 Cb -0.13 -3.39 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 1xtz s GLU 164 CO -0.03 0.24 -0.11 0.96 -0.54 0.00 0.00 175.26 175.78 1xtz s ILE 165 N 0.28 0.92 0.23 -3.70 -4.36 -0.22 0.26 121.20 114.61 1xtz s ILE 165 Ca 0.31 -1.47 -0.30 0.00 -0.26 0.00 0.00 60.65 58.92 1xtz s ILE 165 Cb -0.17 -1.17 -0.10 0.00 1.25 0.00 0.00 42.46 42.26 1xtz s ILE 165 CO 0.15 -0.45 1.49 -0.69 0.24 0.00 0.00 174.94 175.68 1xtz s VAL 166 N -2.00 2.60 0.33 8.37 1.01 0.53 -1.48 120.40 129.76 1xtz s VAL 166 Ca 0.01 0.48 0.04 0.00 0.00 0.00 0.00 61.98 62.51 1xtz s VAL 166 Cb -0.06 -3.31 0.29 0.00 0.00 0.00 0.00 36.38 33.31 1xtz s VAL 166 CO 0.01 0.06 1.92 -0.65 0.00 0.00 0.00 175.10 176.44 1xtz h PRO 167 N 5.55 0.86 0.00 2.72 0.11 -1.91 -1.76 132.00 137.58 1xtz h PRO 167 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xtz h PRO 167 Cb 1.21 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1xtz h PRO 167 CO 0.82 0.57 0.00 -1.13 -0.21 0.00 0.00 178.00 178.05 1xtz n SER 168 N -4.50 0.20 -1.14 -2.05 3.41 -1.26 -3.29 113.62 105.00 1xtz n SER 168 Ca 0.13 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.42 1xtz n SER 168 Cb 0.25 -0.60 0.27 0.00 -0.26 0.00 0.00 64.21 63.86 1xtz n SER 168 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xtz n SER 169 N -1.74 3.35 0.08 4.04 3.41 -0.66 -4.62 113.62 117.48 1xtz n SER 169 Ca 0.02 -1.97 0.01 0.00 -0.26 0.00 0.00 58.87 56.67 1xtz n SER 169 Cb 0.13 -0.33 0.33 0.00 -0.26 0.00 0.00 64.21 64.09 1xtz n SER 169 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1xtz h TYR 170 N 4.01 0.33 -0.04 7.33 -0.00 -1.69 0.11 116.97 127.02 1xtz h TYR 170 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 58.73 58.67 1xtz h TYR 170 Cb 0.90 -0.09 -0.00 0.00 0.00 0.00 0.00 36.73 37.54 1xtz h TYR 170 CO 0.33 0.46 -0.02 0.28 -0.00 0.00 0.00 178.16 179.21 1xtz h VAL 171 N 0.29 1.32 -0.31 -0.90 2.07 -1.89 -2.13 116.25 114.71 1xtz h VAL 171 Ca 0.06 -1.00 0.04 0.00 0.82 0.00 0.00 66.70 66.62 1xtz h VAL 171 Cb 0.45 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 1xtz h VAL 171 CO 0.03 0.27 0.09 -0.09 0.02 0.00 0.00 177.57 177.89 1xtz h ARG 172 N -0.31 0.21 -0.34 1.57 9.65 -1.77 0.21 114.38 123.61 1xtz h ARG 172 Ca 0.01 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.80 1xtz h ARG 172 Cb 0.44 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1xtz h ARG 172 CO 0.01 0.14 -0.07 0.28 2.80 0.00 0.00 179.97 183.13 1xtz h VAL 173 N 0.22 1.28 -0.43 0.20 2.07 -0.81 0.82 116.25 119.60 1xtz h VAL 173 Ca 0.14 -1.11 0.04 0.00 0.82 0.00 0.00 66.70 66.59 1xtz h VAL 173 Cb 0.12 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1xtz h VAL 173 CO -0.15 0.36 0.20 0.50 0.02 0.00 0.00 177.57 178.50 1xtz h LYS 174 N 0.43 0.39 -0.58 1.57 3.64 -1.23 0.74 116.57 121.53 1xtz h LYS 174 Ca 0.09 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1xtz h LYS 174 Cb 0.56 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.24 1xtz h LYS 174 CO 0.03 0.26 0.30 -0.91 -2.27 0.00 0.00 179.45 176.86 1xtz h ASN 175 N 0.40 0.44 -0.49 4.20 2.35 -0.36 -1.79 115.58 120.32 1xtz h ASN 175 Ca 0.19 0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 1xtz h ASN 175 Cb 0.12 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1xtz h ASN 175 CO -0.15 0.29 -0.15 0.44 -1.65 0.00 0.00 177.43 176.21 1xtz h ASP 176 N 0.57 0.98 -0.54 5.81 3.45 -0.39 0.17 116.42 126.48 1xtz h ASP 176 Ca 0.26 -0.37 -0.03 0.00 0.43 0.00 0.00 57.03 57.32 1xtz h ASP 176 Cb 0.17 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.64 1xtz h ASP 176 CO -0.18 1.13 0.24 -0.07 -1.57 0.00 0.00 179.24 178.79 1xtz h LEU 177 N 0.83 0.73 -0.02 1.55 3.38 -0.66 0.40 115.31 121.51 1xtz h LEU 177 Ca 0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1xtz h LEU 177 Cb 0.72 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1xtz h LEU 177 CO 0.05 0.68 -0.02 -0.07 0.09 0.00 0.00 178.44 179.17 1xtz h LEU 178 N 0.73 0.06 0.16 1.67 3.38 -1.25 -0.28 115.31 119.78 1xtz h LEU 178 Ca 0.18 -0.51 -0.29 0.00 0.09 0.00 0.00 57.88 57.36 1xtz h LEU 178 Cb 0.16 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1xtz h LEU 178 CO -0.02 0.55 -1.39 -0.33 0.09 0.00 0.00 178.44 177.34 1xtz h GLU 179 N -0.44 0.33 0.09 1.13 5.08 -0.60 -2.94 114.58 117.24 1xtz h GLU 179 Ca 0.00 -0.57 -0.35 0.00 -1.00 0.00 0.00 59.36 57.45 1xtz h GLU 179 Cb 0.54 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1xtz h GLU 179 CO 0.01 1.27 -1.93 1.04 -1.00 0.00 0.00 179.01 178.40 1xtz n GLN 180 N -3.86 0.73 0.00 2.33 1.13 0.14 -4.49 117.38 113.36 1xtz n GLN 180 Ca -0.22 0.27 0.07 0.00 -1.94 0.00 0.00 57.00 55.18 1xtz n GLN 180 Cb 0.96 -1.73 -0.00 0.00 0.11 0.00 0.00 30.24 29.58 1xtz n GLN 180 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1xtz n LEU 181 N -3.36 1.49 -2.74 1.08 4.77 -0.89 -5.00 117.00 112.35 1xtz n LEU 181 Ca -0.28 -0.77 -0.18 0.00 -0.03 0.00 0.00 56.01 54.75 1xtz n LEU 181 Cb 1.05 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.19 1xtz n LEU 181 CO 0.43 0.29 0.15 1.41 -1.33 0.00 0.00 177.39 178.34 1xtz n HIS 182 N -0.15 -2.05 -1.74 -1.77 8.25 -0.36 -4.95 115.22 112.46 1xtz n HIS 182 Ca 0.06 0.69 -0.38 0.00 -0.26 0.00 0.00 57.72 57.83 1xtz n HIS 182 Cb 0.29 -3.99 0.05 0.00 1.12 0.00 0.00 29.99 27.47 1xtz n HIS 182 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xtz n ALA 183 N -4.13 1.44 0.08 -1.41 0.00 -0.26 -4.93 120.51 111.30 1xtz n ALA 183 Ca -0.01 0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.50 1xtz n ALA 183 Cb 0.56 -2.34 -0.05 0.00 0.00 0.00 0.00 19.45 17.62 1xtz n ALA 183 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xtz h GLU 184 N 1.16 0.00 -1.92 0.00 5.08 -0.39 -3.44 114.58 115.07 1xtz h GLU 184 Ca -0.51 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1xtz h GLU 184 Cb 1.32 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.35 1xtz h GLU 184 CO 0.56 0.58 0.17 0.21 -1.00 0.00 0.00 179.01 179.53 1xtz s LYS 185 N -2.86 0.74 -0.05 2.33 2.20 -1.11 -4.96 119.74 116.03 1xtz s LYS 185 Ca 0.01 0.97 -0.02 0.00 -0.36 0.00 0.00 55.97 56.58 1xtz s LYS 185 Cb 0.08 0.32 0.03 0.00 -1.51 0.00 0.00 37.83 36.75 1xtz s LYS 185 CO 0.78 -0.10 0.05 0.08 -0.36 0.00 0.00 175.35 175.80 1xtz s VAL 186 N 0.66 -0.06 0.01 4.02 1.01 -1.26 0.08 120.40 124.86 1xtz s VAL 186 Ca -0.02 0.39 0.03 0.00 0.00 0.00 0.00 61.98 62.38 1xtz s VAL 186 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 1xtz s VAL 186 CO -0.05 0.18 -0.11 -1.81 0.00 0.00 0.00 175.10 173.31 1xtz s ASP 187 N 2.15 1.27 -0.16 3.32 1.11 -0.94 -5.01 116.67 118.40 1xtz s ASP 187 Ca 0.05 -0.27 -0.28 0.00 0.18 0.00 0.00 52.55 52.22 1xtz s ASP 187 Cb -0.12 -0.11 -0.00 0.00 1.07 0.00 0.00 42.92 43.75 1xtz s ASP 187 CO -0.03 0.08 0.98 -0.63 1.18 0.00 0.00 175.17 176.75 1xtz s ILE 188 N -0.46 4.77 0.17 0.77 1.09 -1.26 -0.56 121.20 125.72 1xtz s ILE 188 Ca 0.02 1.95 -0.31 0.00 -1.10 0.00 0.00 60.65 61.21 1xtz s ILE 188 Cb -0.05 -4.27 -0.09 0.00 -1.06 0.00 0.00 42.46 36.98 1xtz s ILE 188 CO 0.00 -0.06 1.48 -0.60 -0.10 0.00 0.00 174.94 175.66 1xtz s ARG 189 N 2.47 4.26 0.28 2.79 3.52 0.58 -4.94 118.95 127.91 1xtz s ARG 189 Ca 0.45 2.25 0.02 0.00 -0.13 0.00 0.00 55.73 58.32 1xtz s ARG 189 Cb -0.17 -3.17 -0.03 0.00 -1.56 0.00 0.00 34.95 30.02 1xtz s ARG 189 CO 0.12 -0.50 0.45 -0.65 -0.81 0.00 0.00 175.30 173.92 1xtz s GLN 190 N 0.76 3.47 0.00 5.12 -1.52 -1.26 -1.02 119.66 125.21 1xtz s GLN 190 Ca 0.66 -0.50 0.24 0.00 -1.95 0.00 0.00 55.36 53.81 1xtz s GLN 190 Cb -0.41 -2.78 0.98 0.00 -0.22 0.00 0.00 33.01 30.58 1xtz s GLN 190 CO 0.34 0.29 1.69 0.41 -0.25 0.00 0.00 175.29 177.77 1xtz n GLY 191 N -1.48 -0.02 7.00 3.09 0.00 0.93 -4.49 105.19 110.23 1xtz n GLY 191 Ca -0.06 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1xtz n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xtz n GLY 192 N 1.11 0.53 0.17 -0.02 0.00 -1.19 -3.07 105.19 102.72 1xtz n GLY 192 Ca 0.18 -0.85 0.03 0.00 0.00 0.00 0.00 46.02 45.37 1xtz n GLY 192 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xtz h SER 193 N 8.69 0.00 0.25 1.61 4.64 -2.01 -3.18 113.55 123.55 1xtz h SER 193 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1xtz h SER 193 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1xtz h SER 193 CO 0.00 0.45 -0.29 0.00 -0.87 0.00 0.00 176.83 176.12 1xtz h ALA 194 N 1.55 1.45 -2.37 5.18 0.00 -2.00 -3.43 119.26 119.65 1xtz h ALA 194 Ca -0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1xtz h ALA 194 Cb 0.87 -0.06 -0.25 0.00 0.00 0.00 0.00 17.79 18.35 1xtz h ALA 194 CO 0.06 0.40 -0.28 0.21 0.00 0.00 0.00 179.25 179.64 1xtz s LYS 195 N -4.39 0.42 0.19 0.00 2.20 -1.18 -5.11 119.74 111.88 1xtz s LYS 195 Ca -0.04 1.13 -0.30 0.00 -0.36 0.00 0.00 55.97 56.40 1xtz s LYS 195 Cb 0.15 0.43 -0.08 0.00 -1.51 0.00 0.00 37.83 36.81 1xtz s LYS 195 CO 0.72 -0.22 1.23 0.00 -0.36 0.00 0.00 175.35 176.72 1xtz s ALA 196 N 2.51 3.46 0.00 3.13 0.00 -1.26 -3.02 121.76 126.58 1xtz s ALA 196 Ca -0.04 1.00 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1xtz s ALA 196 Cb -0.11 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1xtz s ALA 196 CO -0.15 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1xtz n GLY 197 N 2.20 -1.69 3.77 0.00 0.00 -1.26 -4.86 105.19 103.34 1xtz n GLY 197 Ca 0.05 -1.47 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1xtz n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xtz s PRO 198 N 0.00 4.36 0.25 1.61 0.04 -1.26 -0.05 135.00 139.95 1xtz s PRO 198 Ca 0.00 2.17 -0.31 0.00 0.04 0.00 0.00 61.00 62.90 1xtz s PRO 198 Cb 0.00 -3.06 -0.13 0.00 0.04 0.00 0.00 34.50 31.35 1xtz s PRO 198 CO 0.00 -0.16 1.42 0.28 0.04 0.00 0.00 177.00 178.58 1xtz n VAL 199 N 0.79 0.97 -4.52 -0.36 0.31 -0.18 -4.56 118.33 110.77 1xtz n VAL 199 Ca 0.00 -0.24 -0.33 0.00 -0.01 0.00 0.00 64.34 63.75 1xtz n VAL 199 Cb 0.42 -1.52 -0.13 0.00 -0.91 0.00 0.00 33.84 31.71 1xtz n VAL 199 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1xtz s VAL 200 N -0.07 3.67 0.91 2.52 1.01 -1.26 -4.13 120.40 123.05 1xtz s VAL 200 Ca 0.68 -0.45 -0.14 0.00 0.00 0.00 0.00 61.98 62.07 1xtz s VAL 200 Cb -0.63 -2.58 0.17 0.00 0.00 0.00 0.00 36.38 33.33 1xtz s VAL 200 CO 0.50 0.51 1.27 0.42 0.00 0.00 0.00 175.10 177.80 1xtz s THR 201 N 0.21 2.01 0.55 3.92 -4.23 0.48 -4.87 115.64 113.71 1xtz s THR 201 Ca -0.04 -0.04 0.37 0.00 -1.18 0.00 0.00 61.69 60.80 1xtz s THR 201 Cb -0.14 -2.98 0.39 0.00 1.34 0.00 0.00 72.50 71.11 1xtz s THR 201 CO 0.03 0.00 2.26 0.44 -0.54 0.00 0.00 174.62 176.81 1xtz h ASP 202 N -1.44 0.00 -0.59 3.99 3.32 -1.90 -0.59 116.42 119.21 1xtz h ASP 202 Ca -0.44 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 1xtz h ASP 202 Cb 1.26 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 1xtz h ASP 202 CO 0.44 0.02 0.03 0.59 -1.72 0.00 0.00 179.24 178.60 1xtz n ASN 203 N -3.39 5.58 -1.37 6.45 3.02 -1.26 -4.94 115.26 119.35 1xtz n ASN 203 Ca -0.02 -2.95 -0.13 0.00 -0.03 0.00 0.00 54.58 51.44 1xtz n ASN 203 Cb 0.12 -0.69 -0.02 0.00 -0.61 0.00 0.00 39.78 38.58 1xtz n ASN 203 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1xtz n ASN 204 N 0.53 -4.31 -4.77 6.41 3.02 -0.23 -5.01 115.26 110.91 1xtz n ASN 204 Ca 0.29 0.10 -0.23 0.00 -0.03 0.00 0.00 54.58 54.70 1xtz n ASN 204 Cb 1.21 -3.33 -0.06 0.00 -0.61 0.00 0.00 39.78 36.99 1xtz n ASN 204 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1xtz s ASN 205 N -2.54 4.68 0.56 6.41 0.01 -1.26 -4.71 114.94 118.08 1xtz s ASN 205 Ca 0.00 -0.88 -0.01 0.00 -0.71 0.00 0.00 52.86 51.26 1xtz s ASN 205 Cb 0.00 -0.60 0.03 0.00 0.41 0.00 0.00 41.25 41.09 1xtz s ASN 205 CO 0.00 -0.48 0.80 -0.36 -1.51 0.00 0.00 177.10 175.55 1xtz s PHE 206 N -2.50 2.99 -0.11 2.20 0.08 -0.55 -0.39 117.98 119.70 1xtz s PHE 206 Ca 0.41 0.17 0.03 0.00 0.12 0.00 0.00 56.93 57.67 1xtz s PHE 206 Cb -0.00 -2.72 0.01 0.00 -0.57 0.00 0.00 43.02 39.74 1xtz s PHE 206 CO 0.24 -0.83 -0.20 0.42 -0.10 0.00 0.00 175.22 174.74 1xtz s ILE 207 N -2.81 1.83 -0.13 0.64 -1.09 -1.26 -1.05 121.20 117.33 1xtz s ILE 207 Ca 0.55 -0.87 -0.05 0.00 -2.23 0.00 0.00 60.65 58.06 1xtz s ILE 207 Cb -0.10 -1.62 -0.04 0.00 -1.58 0.00 0.00 42.46 39.12 1xtz s ILE 207 CO 0.40 0.51 0.06 -0.63 -1.23 0.00 0.00 174.94 174.04 1xtz s ILE 208 N 0.65 4.77 -0.33 2.92 1.01 0.57 -0.31 121.20 130.48 1xtz s ILE 208 Ca -0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 1xtz s ILE 208 Cb -0.16 -3.08 -0.01 0.00 0.01 0.00 0.00 42.46 39.21 1xtz s ILE 208 CO 0.03 0.55 0.19 -1.81 0.00 0.00 0.00 174.94 173.90 1xtz s ASP 209 N -0.40 5.73 -0.28 3.58 1.01 0.28 0.30 116.67 126.91 1xtz s ASP 209 Ca 0.09 -0.53 -0.02 0.00 0.71 0.00 0.00 52.55 52.81 1xtz s ASP 209 Cb -0.12 -2.05 0.04 0.00 1.01 0.00 0.00 42.92 41.80 1xtz s ASP 209 CO 0.02 -0.22 -0.03 0.00 0.21 0.00 0.00 175.17 175.15 1xtz s ALA 210 N 1.65 2.76 -0.28 5.23 0.00 0.43 -2.22 121.76 129.33 1xtz s ALA 210 Ca 0.05 -1.62 -0.29 0.00 0.00 0.00 0.00 51.96 50.10 1xtz s ALA 210 Cb -0.17 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.13 1xtz s ALA 210 CO 0.08 -1.06 1.17 0.34 0.00 0.00 0.00 175.76 176.29 1xtz s ASP 211 N 1.29 6.87 -0.14 0.00 3.68 0.11 -0.66 116.67 127.82 1xtz s ASP 211 Ca -0.03 1.23 0.15 0.00 2.13 0.00 0.00 52.55 56.04 1xtz s ASP 211 Cb -0.18 -2.54 0.54 0.00 -1.45 0.00 0.00 42.92 39.28 1xtz s ASP 211 CO -0.03 -0.90 1.44 0.49 0.13 0.00 0.00 175.17 176.31 1xtz n PHE 212 N 7.00 1.02 -4.73 -5.34 3.01 -1.26 0.41 117.46 117.56 1xtz n PHE 212 Ca 0.13 -0.77 0.00 0.00 1.01 0.00 0.00 57.45 57.83 1xtz n PHE 212 Cb 0.46 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 1xtz n PHE 212 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xtz n GLY 213 N -0.05 0.59 3.71 1.37 0.00 -1.26 -4.59 105.19 104.96 1xtz n GLY 213 Ca 0.21 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1xtz n GLY 213 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xtz s GLU 214 N 0.00 4.54 -0.40 1.61 2.02 -1.26 -4.41 118.70 120.81 1xtz s GLU 214 Ca 0.00 1.52 -0.14 0.00 0.02 0.00 0.00 54.97 56.37 1xtz s GLU 214 Cb 0.00 -3.42 0.02 0.00 0.10 0.00 0.00 34.13 30.83 1xtz s GLU 214 CO 0.00 -0.08 0.27 0.42 0.02 0.00 0.00 175.26 175.89 1xtz s ILE 215 N 0.92 5.10 -0.03 -1.63 1.01 0.46 -4.95 121.20 122.08 1xtz s ILE 215 Ca 0.53 -0.67 0.12 0.00 0.00 0.00 0.00 60.65 60.63 1xtz s ILE 215 Cb -0.24 -3.83 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1xtz s ILE 215 CO 0.29 -0.27 1.25 0.77 0.00 0.00 0.00 174.94 176.97 1xtz h SER 216 N 8.58 0.00 -2.46 3.58 4.64 -1.95 -3.38 113.55 122.57 1xtz h SER 216 Ca -0.27 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.46 1xtz h SER 216 Cb 1.12 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.81 1xtz h SER 216 CO 0.71 0.76 -0.81 -0.67 -0.87 0.00 0.00 176.83 175.95 1xtz n ASP 217 N -3.23 1.51 -0.02 4.97 -0.08 -1.26 -4.97 116.55 113.48 1xtz n ASP 217 Ca -0.02 -2.90 0.03 0.00 -1.51 0.00 0.00 54.79 50.40 1xtz n ASP 217 Cb 0.86 -0.65 0.39 0.00 2.34 0.00 0.00 41.12 44.06 1xtz n ASP 217 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1xtz h PRO 218 N 4.92 0.57 -0.37 -0.67 0.13 -2.00 -1.52 132.00 133.06 1xtz h PRO 218 Ca 0.18 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.32 1xtz h PRO 218 Cb 0.81 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.77 1xtz h PRO 218 CO 0.58 0.41 0.09 -0.09 -0.23 0.00 0.00 178.00 178.76 1xtz h ARG 219 N 0.58 0.21 -0.17 0.86 2.43 -1.98 0.22 114.38 116.54 1xtz h ARG 219 Ca 0.15 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1xtz h ARG 219 Cb -0.01 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1xtz h ARG 219 CO -0.03 0.14 -0.03 -0.22 -1.51 0.00 0.00 179.97 178.33 1xtz h LYS 220 N 0.22 0.31 -0.26 0.20 3.64 -1.89 -2.77 116.57 116.02 1xtz h LYS 220 Ca 0.18 -0.11 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1xtz h LYS 220 Cb 0.20 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 1xtz h LYS 220 CO -0.22 0.57 0.02 1.25 -2.27 0.00 0.00 179.45 178.80 1xtz h LEU 221 N 0.03 -0.05 -0.41 5.20 5.85 -1.15 -2.01 115.31 122.76 1xtz h LEU 221 Ca 0.04 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1xtz h LEU 221 Cb 0.44 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 1xtz h LEU 221 CO 0.01 0.01 0.09 -0.74 -0.34 0.00 0.00 178.44 177.48 1xtz h HIS 222 N 0.11 0.16 -0.76 1.25 2.76 -0.51 -1.53 115.15 116.63 1xtz h HIS 222 Ca 0.12 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.28 1xtz h HIS 222 Cb 0.15 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 1xtz h HIS 222 CO -0.18 0.03 0.34 0.00 -1.30 0.00 0.00 177.93 176.81 1xtz h ARG 223 N 0.23 1.11 -0.52 5.26 3.08 -1.16 -0.38 114.38 122.00 1xtz h ARG 223 Ca 0.20 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1xtz h ARG 223 Cb 0.24 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1xtz h ARG 223 CO -0.25 0.89 0.24 0.93 -1.07 0.00 0.00 179.97 180.70 1xtz h GLU 224 N 1.08 0.76 -0.33 0.04 5.08 -0.77 -2.09 114.58 118.34 1xtz h GLU 224 Ca 0.26 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 1xtz h GLU 224 Cb 0.16 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1xtz h GLU 224 CO -0.03 0.64 -0.10 0.82 -1.00 0.00 0.00 179.01 179.34 1xtz h ILE 225 N 0.70 1.28 -0.09 3.13 2.04 -1.06 -3.17 117.51 120.33 1xtz h ILE 225 Ca 0.18 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.84 1xtz h ILE 225 Cb 0.14 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1xtz h ILE 225 CO -0.02 0.38 -0.06 0.50 0.00 0.00 0.00 178.15 178.95 1xtz h LYS 226 N 0.43 0.13 0.00 2.37 1.63 -0.92 -1.18 116.57 119.03 1xtz h LYS 226 Ca 0.08 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1xtz h LYS 226 Cb 0.61 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.22 1xtz h LYS 226 CO 0.04 0.20 0.00 1.28 -3.45 0.00 0.00 179.45 177.52 1xtz n LEU 227 N -4.39 0.19 -4.77 5.20 4.77 -0.80 -4.84 117.00 112.36 1xtz n LEU 227 Ca -0.01 0.53 -0.39 0.00 -0.03 0.00 0.00 56.01 56.11 1xtz n LEU 227 Cb 0.18 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 40.78 1xtz n LEU 227 CO 0.36 -0.14 0.88 -0.76 -1.33 0.00 0.00 177.39 176.40 1xtz s LEU 228 N -3.38 4.18 -0.12 2.23 1.43 -0.45 -4.96 118.68 117.61 1xtz s LEU 228 Ca 0.11 2.45 -0.29 0.00 -1.03 0.00 0.00 54.13 55.37 1xtz s LEU 228 Cb 0.15 -4.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.32 1xtz s LEU 228 CO 0.47 -0.77 1.75 -0.69 0.23 0.00 0.00 176.35 177.34 1xtz s VAL 229 N -1.36 3.48 0.00 -1.59 1.01 -1.26 -2.45 120.40 118.23 1xtz s VAL 229 Ca 0.58 0.56 0.00 0.00 0.00 0.00 0.00 61.98 63.12 1xtz s VAL 229 Cb -0.33 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1xtz s VAL 229 CO 0.42 -0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1xtz n GLY 230 N 4.57 2.10 3.67 4.51 0.00 -1.26 -4.57 105.19 114.21 1xtz n GLY 230 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1xtz n GLY 230 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xtz s VAL 231 N -2.07 4.75 -0.17 1.61 1.01 -1.03 -0.35 120.40 124.15 1xtz s VAL 231 Ca 0.00 2.00 -0.19 0.00 0.00 0.00 0.00 61.98 63.79 1xtz s VAL 231 Cb 0.00 -4.30 -0.16 0.00 0.00 0.00 0.00 36.38 31.92 1xtz s VAL 231 CO 0.00 -0.07 0.26 0.58 0.00 0.00 0.00 175.10 175.87 1xtz h VAL 232 N 5.25 0.88 -2.75 2.92 2.07 -0.52 -3.47 116.25 120.63 1xtz h VAL 232 Ca -0.26 -1.90 -0.04 0.00 0.82 0.00 0.00 66.70 65.33 1xtz h VAL 232 Cb 1.11 1.90 -0.14 0.00 -1.52 0.00 0.00 31.29 32.64 1xtz h VAL 232 CO 0.90 0.30 0.16 -0.70 0.02 0.00 0.00 177.57 178.26 1xtz s GLU 233 N -2.23 1.18 0.17 1.57 2.56 -1.10 -5.01 118.70 115.85 1xtz s GLU 233 Ca -0.21 -0.28 0.05 0.00 0.00 0.00 0.00 54.97 54.53 1xtz s GLU 233 Cb 0.02 0.55 -0.04 0.00 2.00 0.00 0.00 34.13 36.66 1xtz s GLU 233 CO 0.49 -0.47 0.16 0.95 -0.56 0.00 0.00 175.26 175.83 1xtz s THR 234 N -2.96 4.57 -1.73 -1.70 -4.23 -1.26 -0.68 115.64 107.65 1xtz s THR 234 Ca -0.03 -1.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 1xtz s THR 234 Cb -0.01 -3.35 0.00 0.00 1.34 0.00 0.00 72.50 70.49 1xtz s THR 234 CO -0.06 -0.13 0.72 0.61 -0.54 0.00 0.00 174.62 175.22 1xtz n GLY 235 N -0.44 -0.27 3.53 3.99 0.00 0.17 -4.76 105.19 107.41 1xtz n GLY 235 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1xtz n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xtz s LEU 236 N -0.73 4.53 -0.33 0.99 1.43 -1.26 -0.15 118.68 123.17 1xtz s LEU 236 Ca 0.00 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 52.69 1xtz s LEU 236 Cb 0.00 -2.47 -0.00 0.00 0.03 0.00 0.00 46.19 43.75 1xtz s LEU 236 CO 0.00 -0.49 0.18 -0.36 0.23 0.00 0.00 176.35 175.91 1xtz s PHE 237 N 2.24 3.20 -0.13 0.29 0.40 -0.76 -4.97 117.98 118.25 1xtz s PHE 237 Ca 0.15 -0.54 0.03 0.00 -0.60 0.00 0.00 56.93 55.97 1xtz s PHE 237 Cb -0.16 -2.40 0.00 0.00 0.51 0.00 0.00 43.02 40.98 1xtz s PHE 237 CO 0.13 -0.46 -0.22 0.42 0.70 0.00 0.00 175.22 175.80 1xtz s ILE 238 N 1.63 2.16 -1.40 0.64 -1.09 -1.26 -2.04 121.20 119.83 1xtz s ILE 238 Ca 0.05 -0.96 -0.05 0.00 -2.23 0.00 0.00 60.65 57.45 1xtz s ILE 238 Cb -0.17 -1.85 0.03 0.00 -1.58 0.00 0.00 42.46 38.89 1xtz s ILE 238 CO 0.07 0.55 0.78 0.47 -1.23 0.00 0.00 174.94 175.58 1xtz n ASP 239 N 3.83 -2.40 0.04 3.58 8.00 -1.26 -4.86 116.55 123.48 1xtz n ASP 239 Ca -0.19 -0.82 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1xtz n ASP 239 Cb 0.52 -3.90 0.00 0.00 -0.02 0.00 0.00 41.12 37.72 1xtz n ASP 239 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1xtz n ASN 240 N -2.97 0.48 -4.71 -2.24 4.05 -1.26 -5.03 115.26 103.58 1xtz n ASN 240 Ca -0.18 0.13 -0.42 0.00 0.45 0.00 0.00 54.58 54.56 1xtz n ASN 240 Cb 0.62 -0.10 -0.03 0.00 1.23 0.00 0.00 39.78 41.50 1xtz n ASN 240 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1xtz s ALA 241 N -2.00 3.61 -0.13 5.20 0.00 -1.26 -4.39 121.76 122.79 1xtz s ALA 241 Ca 0.00 1.13 0.17 0.00 0.00 0.00 0.00 51.96 53.26 1xtz s ALA 241 Cb 0.00 -3.56 -0.16 0.00 0.00 0.00 0.00 23.12 19.40 1xtz s ALA 241 CO 0.00 -0.68 0.73 -1.13 0.00 0.00 0.00 175.76 174.68 1xtz n SER 242 N 4.14 0.71 -3.70 0.00 3.41 -0.51 -4.94 113.62 112.74 1xtz n SER 242 Ca 0.12 0.31 -0.11 0.00 -0.26 0.00 0.00 58.87 58.93 1xtz n SER 242 Cb 0.42 0.39 -0.06 0.00 -0.26 0.00 0.00 64.21 64.70 1xtz n SER 242 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1xtz s LYS 243 N -2.94 0.95 -0.04 4.33 1.02 -1.24 -3.79 119.74 118.04 1xtz s LYS 243 Ca -0.04 -0.63 0.01 0.00 0.02 0.00 0.00 55.97 55.33 1xtz s LYS 243 Cb 0.09 0.41 0.02 0.00 -0.52 0.00 0.00 37.83 37.83 1xtz s LYS 243 CO 0.82 -0.34 -0.03 0.00 -0.92 0.00 0.00 175.35 174.88 1xtz s ALA 244 N -3.25 0.52 -0.16 5.17 0.00 -0.59 -1.35 121.76 122.09 1xtz s ALA 244 Ca -0.00 0.03 -0.06 0.00 0.00 0.00 0.00 51.96 51.93 1xtz s ALA 244 Cb 0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 1xtz s ALA 244 CO -0.08 -0.02 0.04 0.71 0.00 0.00 0.00 175.76 176.41 1xtz s TYR 245 N 0.88 3.21 -0.16 0.00 1.51 0.63 -0.74 117.35 122.68 1xtz s TYR 245 Ca -0.11 0.03 0.01 0.00 -1.01 0.00 0.00 57.07 55.99 1xtz s TYR 245 Cb -0.14 -2.01 0.02 0.00 -0.11 0.00 0.00 41.96 39.72 1xtz s TYR 245 CO -0.00 0.18 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.38 1xtz s PHE 246 N 0.16 2.50 0.11 2.71 0.40 0.77 -0.14 117.98 124.48 1xtz s PHE 246 Ca 0.03 -1.45 -0.28 0.00 -0.60 0.00 0.00 56.93 54.64 1xtz s PHE 246 Cb -0.13 -1.77 -0.06 0.00 0.51 0.00 0.00 43.02 41.57 1xtz s PHE 246 CO 0.01 -0.74 0.86 0.20 0.70 0.00 0.00 175.22 176.26 1xtz s GLY 247 N 1.35 2.93 0.08 4.36 0.00 0.49 -1.09 107.32 115.44 1xtz s GLY 247 Ca 0.04 0.44 0.01 0.00 0.00 0.00 0.00 44.72 45.22 1xtz s GLY 247 CO -0.11 1.22 0.17 -1.31 0.00 0.00 0.00 173.10 173.07 1xtz s ASN 248 N -0.28 6.05 0.25 1.64 0.01 -0.08 -0.62 114.94 121.90 1xtz s ASN 248 Ca 0.42 0.15 -0.03 0.00 -0.71 0.00 0.00 52.86 52.68 1xtz s ASN 248 Cb -0.22 -1.78 0.44 0.00 0.41 0.00 0.00 41.25 40.10 1xtz s ASN 248 CO 0.27 0.15 1.79 0.77 -1.51 0.00 0.00 177.10 178.57 1xtz h SER 249 N 3.01 0.60 0.00 -1.22 4.64 -1.92 -2.01 113.55 116.66 1xtz h SER 249 Ca -0.46 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1xtz h SER 249 Cb 1.17 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1xtz h SER 249 CO 0.71 0.32 0.00 -0.90 -0.87 0.00 0.00 176.83 176.09 1xtz n ASP 250 N -4.80 0.08 0.00 4.97 5.75 -1.26 -4.69 116.55 116.60 1xtz n ASP 250 Ca 0.15 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 1xtz n ASP 250 Cb 0.33 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1xtz n ASP 250 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xtz n GLY 251 N -0.04 2.91 3.73 6.12 0.00 -0.75 -5.01 105.19 112.14 1xtz n GLY 251 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1xtz n GLY 251 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xtz s SER 252 N -0.70 4.06 -0.05 1.61 1.04 -1.26 -4.80 113.70 113.60 1xtz s SER 252 Ca 0.00 2.01 -0.01 0.00 0.48 0.00 0.00 55.95 58.43 1xtz s SER 252 Cb 0.00 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.60 1xtz s SER 252 CO 0.00 -2.34 0.02 -0.69 0.98 0.00 0.00 173.24 171.21 1xtz s VAL 253 N -2.67 0.19 0.02 5.02 1.01 -1.26 -0.91 120.40 121.80 1xtz s VAL 253 Ca 0.65 0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.82 1xtz s VAL 253 Cb -0.20 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1xtz s VAL 253 CO 0.54 0.20 0.12 -1.61 0.00 0.00 0.00 175.10 174.35 1xtz s GLU 254 N 1.72 3.16 -0.07 2.72 2.02 -0.25 -4.47 118.70 123.52 1xtz s GLU 254 Ca 0.00 -0.48 0.03 0.00 0.02 0.00 0.00 54.97 54.54 1xtz s GLU 254 Cb -0.13 -2.91 0.01 0.00 0.10 0.00 0.00 34.13 31.20 1xtz s GLU 254 CO -0.03 0.63 -0.17 0.08 0.02 0.00 0.00 175.26 175.79 1xtz s VAL 255 N -1.30 1.49 -0.14 2.63 1.01 0.10 -0.16 120.40 124.03 1xtz s VAL 255 Ca 0.26 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 1xtz s VAL 255 Cb -0.12 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1xtz s VAL 255 CO 0.18 0.43 -0.01 -0.89 0.00 0.00 0.00 175.10 174.82 1xtz s THR 256 N 0.44 4.20 0.50 3.92 2.01 0.08 -1.45 115.64 125.34 1xtz s THR 256 Ca -0.14 -0.26 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1xtz s THR 256 Cb -0.16 -2.83 -0.01 0.00 0.01 0.00 0.00 72.50 69.51 1xtz s THR 256 CO 0.05 0.52 0.02 -1.61 -0.69 0.00 0.00 174.62 172.91 1xtz s GLU 257 N -0.00 2.16 0.85 4.92 2.02 0.78 -1.54 118.70 127.89 1xtz s GLU 257 Ca 0.02 -2.38 -0.12 0.00 0.02 0.00 0.00 54.97 52.52 1xtz s GLU 257 Cb -0.13 -1.37 0.11 0.00 0.10 0.00 0.00 34.13 32.84 1xtz s GLU 257 CO 0.02 -0.40 1.18 0.15 0.02 0.00 0.00 175.26 176.24 1xtz s LYS 258 N -3.85 1.37 -1.25 1.61 1.02 -1.25 -3.69 119.74 113.70 1xtz s LYS 258 Ca 0.08 1.67 -0.03 0.00 0.02 0.00 0.00 55.97 57.71 1xtz s LYS 258 Cb 0.01 -1.75 0.00 0.00 -0.52 0.00 0.00 37.83 35.57 1xtz s LYS 258 CO 0.04 -2.40 0.39 0.72 -0.92 0.00 0.00 175.35 173.19 1xtz n HIS 259 N -3.70 -1.41 -1.15 3.18 8.25 -1.26 -2.98 115.22 116.15 1xtz n HIS 259 Ca 0.13 0.34 -0.05 0.00 -0.26 0.00 0.00 57.72 57.88 1xtz n HIS 259 Cb 0.51 -3.68 -0.02 0.00 1.12 0.00 0.00 29.99 27.92 1xtz n HIS 259 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1xtz n HIS 260 N -4.20 0.00 -2.89 4.41 8.25 -1.25 -4.97 115.22 114.57 1xtz n HIS 260 Ca -0.11 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.94 1xtz n HIS 260 Cb 0.60 -1.79 -0.04 0.00 1.12 0.00 0.00 29.99 29.89 1xtz n HIS 260 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1xtz s HIS 261 N -1.74 3.47 0.01 4.41 3.76 -1.16 -4.96 115.29 119.09 1xtz s HIS 261 Ca 0.00 1.32 0.01 0.00 -0.15 0.00 0.00 55.06 56.24 1xtz s HIS 261 Cb 0.00 -3.00 -0.01 0.00 1.11 0.00 0.00 32.58 30.68 1xtz s HIS 261 CO 0.00 -0.17 -0.05 -3.38 -0.85 0.00 0.00 174.74 170.29 1xtz s HIS 262 N 1.82 0.44 0.26 1.40 -3.43 -1.26 -0.16 115.29 114.36 1xtz s HIS 262 Ca 0.40 -0.25 -0.16 0.00 -0.80 0.00 0.00 55.06 54.24 1xtz s HIS 262 Cb -0.17 -0.28 0.01 0.00 -1.43 0.00 0.00 32.58 30.71 1xtz s HIS 262 CO 0.15 -0.05 0.58 -3.38 -2.00 0.00 0.00 174.74 170.04 1xtz s HIS 263 N -0.65 0.12 -2.53 0.38 -3.43 -0.53 -5.00 115.29 103.64 1xtz s HIS 263 Ca -0.04 -0.52 0.28 0.00 -0.80 0.00 0.00 55.06 53.98 1xtz s HIS 263 Cb -0.05 0.41 0.99 0.00 -1.43 0.00 0.00 32.58 32.50 1xtz s HIS 263 CO -0.00 -1.09 1.71 0.72 -2.00 0.00 0.00 174.74 174.08