#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hwf n TYR 6 N 0.00 0.00 -0.37 3.10 4.02 -1.26 0.15 117.16 122.80 2hwf n TYR 6 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.82 2hwf n TYR 6 Cb 0.00 -0.08 -0.04 0.00 -0.02 0.00 0.00 39.34 39.20 2hwf n TYR 6 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2hwf h ILE 7 N 0.00 0.01 -0.55 -0.72 1.08 -2.01 2.18 117.51 117.50 2hwf h ILE 7 Ca 0.00 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.62 2hwf h ILE 7 Cb 0.00 0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 33.74 2hwf h ILE 7 CO 0.00 0.00 0.39 0.44 -0.69 0.00 0.00 178.15 178.29 2hwf h ASP 8 N -0.04 0.07 0.36 1.72 5.19 -1.81 2.05 116.42 123.95 2hwf h ASP 8 Ca 0.23 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2hwf h ASP 8 Cb 0.51 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.01 2hwf h ASP 8 CO -0.92 0.04 -1.43 1.21 -3.12 0.00 0.00 179.24 175.02 2hwf n GLU 9 N -4.40 0.50 -0.05 3.56 2.13 0.40 0.14 120.64 122.92 2hwf n GLU 9 Ca 0.10 -0.05 -0.03 0.00 0.66 0.00 0.00 57.16 57.84 2hwf n GLU 9 Cb 0.58 -1.61 -0.12 0.00 0.27 0.00 0.00 31.44 30.55 2hwf n GLU 9 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2hwf n VAL 10 N -2.24 0.72 0.46 6.31 0.31 0.67 -4.12 118.33 120.44 2hwf n VAL 10 Ca -0.01 -0.54 0.11 0.00 -0.01 0.00 0.00 64.34 63.89 2hwf n VAL 10 Cb 0.51 -0.40 -0.02 0.00 -0.91 0.00 0.00 33.84 33.03 2hwf n VAL 10 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2hwf n LEU 11 N -2.40 0.57 -2.94 7.52 7.99 0.69 -4.99 117.00 123.44 2hwf n LEU 11 Ca -0.18 -0.01 -0.11 0.00 -0.01 0.00 0.00 56.01 55.70 2hwf n LEU 11 Cb 0.81 -0.07 0.01 0.00 -0.11 0.00 0.00 43.42 44.06 2hwf n LEU 11 CO 0.31 0.03 -0.09 0.59 -1.51 0.00 0.00 177.39 176.72 2hwf n ASN 12 N -2.05 -7.56 -1.44 -1.43 4.13 -1.11 -4.99 115.26 100.81 2hwf n ASN 12 Ca 0.01 0.55 0.01 0.00 1.68 0.00 0.00 54.58 56.83 2hwf n ASN 12 Cb 0.46 -4.71 0.00 0.00 -1.54 0.00 0.00 39.78 33.99 2hwf n ASN 12 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2hwf n GLU 13 N -0.09 0.08 0.28 3.52 1.02 0.36 -4.76 120.64 121.05 2hwf n GLU 13 Ca 0.07 -1.80 -0.12 0.00 -0.02 0.00 0.00 57.16 55.29 2hwf n GLU 13 Cb 0.43 0.07 -0.06 0.00 -0.02 0.00 0.00 31.44 31.87 2hwf n GLU 13 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2hwf h VAL 14 N 6.42 0.00 -3.53 2.62 2.07 -1.81 -3.40 116.25 118.63 2hwf h VAL 14 Ca -0.31 -0.38 -0.77 0.00 0.82 0.00 0.00 66.70 66.05 2hwf h VAL 14 Cb 1.75 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 31.28 2hwf h VAL 14 CO 0.00 0.00 0.16 -0.76 0.02 0.00 0.00 177.57 176.99 2hwf s LEU 15 N -9.09 6.43 0.08 2.57 2.01 -1.26 -5.03 118.68 114.38 2hwf s LEU 15 Ca -0.11 -2.46 0.01 0.00 0.01 0.00 0.00 54.13 51.57 2hwf s LEU 15 Cb 0.01 -2.24 -0.04 0.00 0.01 0.00 0.00 46.19 43.93 2hwf s LEU 15 CO 0.34 -0.69 0.23 0.54 1.01 0.00 0.00 176.35 177.78 2hwf s VAL 16 N 0.75 5.37 0.10 -1.59 0.11 -1.26 0.11 120.40 123.99 2hwf s VAL 16 Ca 0.18 -0.48 -0.13 0.00 -2.93 0.00 0.00 61.98 58.62 2hwf s VAL 16 Cb -0.12 -3.66 -0.06 0.00 -1.53 0.00 0.00 36.38 31.01 2hwf s VAL 16 CO -0.07 0.08 0.49 0.68 -3.33 0.00 0.00 175.10 172.94 2hwf s VAL 17 N -1.57 4.94 1.17 2.04 -7.23 -1.00 -4.93 120.40 113.82 2hwf s VAL 17 Ca 0.35 0.74 -0.13 0.00 -1.81 0.00 0.00 61.98 61.13 2hwf s VAL 17 Cb -0.12 -3.72 0.28 0.00 0.56 0.00 0.00 36.38 33.38 2hwf s VAL 17 CO 0.28 0.32 0.98 -0.81 -0.31 0.00 0.00 175.10 175.56 2hwf n PRO 18 N 1.02 -2.41 -3.57 4.82 -0.04 -1.26 -4.61 135.00 128.95 2hwf n PRO 18 Ca -0.08 -0.67 -0.22 0.00 -0.04 0.00 0.00 63.50 62.50 2hwf n PRO 18 Cb 0.52 -2.15 -0.02 0.00 -0.04 0.00 0.00 33.50 31.81 2hwf n PRO 18 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2hwf s ASN 19 N -2.38 4.99 -0.45 3.54 0.02 -1.26 -4.62 114.94 114.77 2hwf s ASN 19 Ca 0.68 -0.83 -0.15 0.00 -1.02 0.00 0.00 52.86 51.53 2hwf s ASN 19 Cb -0.25 -0.34 0.05 0.00 0.02 0.00 0.00 41.25 40.73 2hwf s ASN 19 CO 0.65 -0.78 0.37 -0.63 0.02 0.00 0.00 177.10 176.73 2hwf s ILE 20 N -2.54 5.24 0.79 0.60 -1.09 -0.90 -4.98 121.20 118.32 2hwf s ILE 20 Ca 0.47 -0.91 -0.13 0.00 -2.23 0.00 0.00 60.65 57.84 2hwf s ILE 20 Cb -0.03 -4.06 0.20 0.00 -1.58 0.00 0.00 42.46 36.98 2hwf s ILE 20 CO 0.28 -0.49 0.67 0.29 -1.23 0.00 0.00 174.94 174.45 2hwf n LYS 21 N 5.21 -2.54 -3.84 2.79 5.02 -1.26 0.00 118.16 123.54 2hwf n LYS 21 Ca -0.12 -1.07 -0.33 0.00 -2.02 0.00 0.00 58.31 54.77 2hwf n LYS 21 Cb 0.45 -1.05 -0.05 0.00 -0.02 0.00 0.00 35.03 34.36 2hwf n LYS 21 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2hwf s GLU 22 N -4.52 3.50 0.33 1.97 2.12 0.02 -3.63 118.70 118.49 2hwf s GLU 22 Ca 0.44 -0.24 0.04 0.00 0.36 0.00 0.00 54.97 55.57 2hwf s GLU 22 Cb -0.05 -3.05 -0.06 0.00 0.26 0.00 0.00 34.13 31.23 2hwf s GLU 22 CO 0.34 0.63 0.05 -1.54 -0.54 0.00 0.00 175.26 174.20 2hwf s SER 23 N -2.03 2.47 0.34 -1.70 1.04 -1.18 -4.94 113.70 107.70 2hwf s SER 23 Ca 0.30 -1.37 0.04 0.00 0.48 0.00 0.00 55.95 55.41 2hwf s SER 23 Cb -0.13 -0.11 -0.03 0.00 0.10 0.00 0.00 66.02 65.85 2hwf s SER 23 CO 0.20 -0.58 0.15 -1.00 0.98 0.00 0.00 173.24 172.99 2hwf s HIS 24 N -3.25 1.70 0.62 5.02 3.76 -1.26 -4.56 115.29 117.31 2hwf s HIS 24 Ca 0.36 -1.34 -0.12 0.00 -0.15 0.00 0.00 55.06 53.82 2hwf s HIS 24 Cb 0.09 -0.97 -0.04 0.00 1.11 0.00 0.00 32.58 32.76 2hwf s HIS 24 CO 0.15 -0.44 1.03 -3.38 -0.85 0.00 0.00 174.74 171.25 2hwf s HIS 25 N -3.44 3.54 -0.06 1.40 -3.43 -1.26 -4.80 115.29 107.24 2hwf s HIS 25 Ca 0.32 1.33 -0.03 0.00 -0.80 0.00 0.00 55.06 55.88 2hwf s HIS 25 Cb 0.04 -2.75 0.04 0.00 -1.43 0.00 0.00 32.58 28.48 2hwf s HIS 25 CO 0.17 -0.72 0.09 0.95 -2.00 0.00 0.00 174.74 173.23 2hwf s THR 26 N -3.10 -0.15 -0.56 -5.38 -4.23 -1.26 -4.99 115.64 95.98 2hwf s THR 26 Ca 0.56 0.36 0.03 0.00 -1.18 0.00 0.00 61.69 61.45 2hwf s THR 26 Cb -0.11 -0.22 0.40 0.00 1.34 0.00 0.00 72.50 73.91 2hwf s THR 26 CO 0.51 0.13 1.46 0.41 -0.54 0.00 0.00 174.62 176.59 2hwf n THR 27 N 5.30 2.84 -4.85 3.99 -1.04 -1.26 -5.02 114.28 114.25 2hwf n THR 27 Ca -0.04 -4.55 -0.28 0.00 -2.04 0.00 0.00 64.05 57.15 2hwf n THR 27 Cb 0.50 -1.24 -0.15 0.00 -1.82 0.00 0.00 70.33 67.62 2hwf n THR 27 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2hwf s SER 28 N -2.69 2.80 0.00 8.00 0.01 -1.26 -5.10 113.70 115.46 2hwf s SER 28 Ca 0.51 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.24 2hwf s SER 28 Cb 0.42 -0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.39 2hwf s SER 28 CO -0.22 0.22 0.17 -3.20 0.41 0.00 0.00 173.24 170.62 2hwf n ASN 29 N 1.95 0.00 -4.65 2.44 5.15 -1.26 -4.45 115.26 114.44 2hwf n ASN 29 Ca -0.17 0.17 -0.42 0.00 -0.60 0.00 0.00 54.58 53.56 2hwf n ASN 29 Cb 0.52 -0.02 -0.03 0.00 -0.53 0.00 0.00 39.78 39.72 2hwf n ASN 29 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2hwf n SER 30 N -0.90 3.99 -4.27 1.20 2.88 -1.26 -4.93 113.62 110.33 2hwf n SER 30 Ca 0.00 0.78 -0.44 0.00 -1.33 0.00 0.00 58.87 57.88 2hwf n SER 30 Cb 0.00 -1.53 -0.05 0.00 -0.75 0.00 0.00 64.21 61.88 2hwf n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hwf s ALA 31 N 5.15 3.73 0.22 -1.46 0.00 -1.26 -4.92 121.76 123.22 2hwf s ALA 31 Ca 0.91 -2.87 0.26 0.00 0.00 0.00 0.00 51.96 50.26 2hwf s ALA 31 Cb -0.43 -3.20 1.15 0.00 0.00 0.00 0.00 23.12 20.65 2hwf s ALA 31 CO 0.41 -2.09 1.92 -1.00 0.00 0.00 0.00 175.76 175.01 2hwf h PRO 32 N 8.24 0.00 0.00 0.00 0.13 -1.95 -2.87 132.00 135.55 2hwf h PRO 32 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2hwf h PRO 32 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2hwf h PRO 32 CO 0.87 0.17 0.00 1.28 -0.23 0.00 0.00 178.00 180.09 2hwf n LEU 33 N -3.42 0.00 -4.35 1.56 4.32 -1.26 -4.58 117.00 109.27 2hwf n LEU 33 Ca -0.00 0.42 -0.41 0.00 -0.02 0.00 0.00 56.01 55.99 2hwf n LEU 33 Cb 0.36 -0.42 -0.10 0.00 -1.62 0.00 0.00 43.42 41.64 2hwf n LEU 33 CO 0.31 -0.12 -0.11 -0.76 -1.22 0.00 0.00 177.39 175.49 2hwf s LEU 34 N -2.83 5.01 0.15 2.23 1.43 -1.08 -5.08 118.68 118.51 2hwf s LEU 34 Ca 0.14 -1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 52.02 2hwf s LEU 34 Cb 0.14 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2hwf s LEU 34 CO 0.35 -0.48 0.08 -0.62 0.23 0.00 0.00 176.35 175.91 2hwf s ASP 35 N 1.89 0.27 -0.56 2.29 -1.08 -1.26 -4.98 116.67 113.23 2hwf s ASP 35 Ca 0.03 -1.24 0.00 0.00 -0.52 0.00 0.00 52.55 50.82 2hwf s ASP 35 Cb -0.21 0.32 0.14 0.00 -1.46 0.00 0.00 42.92 41.71 2hwf s ASP 35 CO 0.05 -0.76 0.34 0.00 0.52 0.00 0.00 175.17 175.33 2hwf s ALA 36 N -4.07 3.43 -0.51 3.66 0.00 -1.26 -4.96 121.76 118.04 2hwf s ALA 36 Ca 0.27 -3.22 0.00 0.00 0.00 0.00 0.00 51.96 49.01 2hwf s ALA 36 Cb 0.07 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2hwf s ALA 36 CO 0.04 -2.04 0.51 0.00 0.00 0.00 0.00 175.76 174.26 2hwf n ALA 37 N 3.37 0.44 0.22 0.00 0.00 -1.26 -1.44 120.51 121.84 2hwf n ALA 37 Ca 0.06 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.60 2hwf n ALA 37 Cb 0.36 -0.38 0.35 0.00 0.00 0.00 0.00 19.45 19.78 2hwf n ALA 37 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2hwf h GLU 38 N 0.00 0.00 0.00 0.00 5.08 -1.93 -2.83 114.58 114.90 2hwf h GLU 38 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2hwf h GLU 38 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2hwf h GLU 38 CO 0.00 0.19 0.00 0.25 -1.00 0.00 0.00 179.01 178.45 2hwf n THR 39 N -3.24 1.19 0.00 1.13 -2.24 -0.52 -4.79 114.28 105.80 2hwf n THR 39 Ca 0.01 0.30 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 2hwf n THR 39 Cb 0.49 -1.14 0.00 0.00 -2.10 0.00 0.00 70.33 67.58 2hwf n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hwf n GLY 40 N -0.51 2.42 3.70 3.38 0.00 -1.07 -4.98 105.19 108.14 2hwf n GLY 40 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2hwf n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hwf s HIS 41 N -2.07 0.78 0.03 1.61 3.76 -1.26 -5.04 115.29 113.10 2hwf s HIS 41 Ca 0.00 0.42 0.04 0.00 -0.15 0.00 0.00 55.06 55.37 2hwf s HIS 41 Cb 0.00 -3.68 -0.04 0.00 1.11 0.00 0.00 32.58 29.98 2hwf s HIS 41 CO 0.00 -3.52 -0.06 0.99 -0.85 0.00 0.00 174.74 171.30 2hwf s THR 42 N -3.29 3.66 0.90 1.30 2.01 -1.26 -4.78 115.64 114.17 2hwf s THR 42 Ca 0.72 -0.88 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 2hwf s THR 42 Cb -0.07 -2.63 0.14 0.00 0.01 0.00 0.00 72.50 69.94 2hwf s THR 42 CO 0.55 0.31 1.14 -0.55 -0.69 0.00 0.00 174.62 175.38 2hwf s SER 43 N -1.67 3.07 -0.51 3.53 0.15 -1.26 -4.99 113.70 112.02 2hwf s SER 43 Ca 0.19 2.16 0.07 0.00 0.70 0.00 0.00 55.95 59.07 2hwf s SER 43 Cb -0.11 -2.56 0.24 0.00 -1.71 0.00 0.00 66.02 61.87 2hwf s SER 43 CO 0.10 -3.01 0.60 -3.20 1.20 0.00 0.00 173.24 168.93 2hwf n ASN 44 N -4.16 1.70 -4.35 5.45 4.05 -1.26 -5.10 115.26 111.59 2hwf n ASN 44 Ca 0.12 -3.00 -0.22 0.00 0.45 0.00 0.00 54.58 51.93 2hwf n ASN 44 Cb 0.52 -0.65 -0.11 0.00 1.23 0.00 0.00 39.78 40.77 2hwf n ASN 44 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2hwf s VAL 45 N -1.63 1.89 0.33 3.44 1.01 -1.26 -5.05 120.40 119.14 2hwf s VAL 45 Ca 0.36 -1.95 0.05 0.00 0.00 0.00 0.00 61.98 60.44 2hwf s VAL 45 Cb 0.14 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2hwf s VAL 45 CO -0.08 -0.31 0.22 -1.10 0.00 0.00 0.00 175.10 173.84 2hwf s GLN 46 N -2.83 1.72 0.11 2.72 -1.52 -1.26 -5.02 119.66 113.57 2hwf s GLN 46 Ca 0.17 -2.00 -0.30 0.00 -1.95 0.00 0.00 55.36 51.27 2hwf s GLN 46 Cb -0.06 0.09 -0.11 0.00 -0.22 0.00 0.00 33.01 32.72 2hwf s GLN 46 CO 0.07 -0.57 1.60 -1.00 -0.25 0.00 0.00 175.29 175.14 2hwf h PRO 47 N 2.12 -0.64 -0.99 2.91 0.13 -2.00 -1.17 132.00 132.36 2hwf h PRO 47 Ca -0.29 0.04 0.28 0.00 -0.87 0.00 0.00 66.00 65.16 2hwf h PRO 47 Cb 1.24 0.15 -0.05 0.00 0.13 0.00 0.00 31.00 32.47 2hwf h PRO 47 CO 0.44 -0.43 0.70 0.93 -0.23 0.00 0.00 178.00 179.41 2hwf h GLU 48 N -0.67 0.08 -0.03 0.86 3.07 -1.90 -0.88 114.58 115.11 2hwf h GLU 48 Ca 0.01 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2hwf h GLU 48 Cb 0.66 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.55 2hwf h GLU 48 CO -0.16 0.05 -0.05 -0.44 -1.40 0.00 0.00 179.01 177.01 2hwf h ASP 49 N 0.08 0.10 0.85 1.42 3.32 -1.62 -3.37 116.42 117.20 2hwf h ASP 49 Ca 0.49 -0.54 -0.22 0.00 0.02 0.00 0.00 57.03 56.78 2hwf h ASP 49 Cb 1.79 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 41.29 2hwf h ASP 49 CO -0.05 0.62 -1.02 0.00 -1.72 0.00 0.00 179.24 177.07 2hwf h ALA 50 N 0.48 0.35 -4.71 3.45 0.00 -1.20 -3.48 119.26 114.15 2hwf h ALA 50 Ca 0.00 -0.86 -0.47 0.00 0.00 0.00 0.00 54.91 53.58 2hwf h ALA 50 Cb 0.60 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.18 2hwf h ALA 50 CO 0.01 1.12 -0.40 0.44 0.00 0.00 0.00 179.25 180.43 2hwf n ILE 51 N -3.45 0.00 -3.52 0.00 -5.35 -0.40 -5.07 119.36 101.56 2hwf n ILE 51 Ca -0.02 -2.04 -0.41 0.00 -0.27 0.00 0.00 62.75 60.01 2hwf n ILE 51 Cb 0.92 0.77 -0.05 0.00 -1.74 0.00 0.00 39.64 39.54 2hwf n ILE 51 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2hwf s GLU 52 N -3.31 3.37 1.18 6.28 2.02 -1.26 -4.59 118.70 122.40 2hwf s GLU 52 Ca 0.20 -2.89 -0.17 0.00 0.02 0.00 0.00 54.97 52.13 2hwf s GLU 52 Cb 0.01 -4.14 0.28 0.00 0.10 0.00 0.00 34.13 30.38 2hwf s GLU 52 CO 0.14 -1.24 1.06 -0.08 0.02 0.00 0.00 175.26 175.15 2hwf s THR 53 N -0.66 1.71 0.00 3.63 -1.32 -1.26 -4.86 115.64 112.88 2hwf s THR 53 Ca 0.23 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.71 2hwf s THR 53 Cb -0.12 -2.35 0.00 0.00 -1.51 0.00 0.00 72.50 68.52 2hwf s THR 53 CO -0.08 0.00 0.00 -2.11 -2.21 0.00 0.00 174.62 170.22 2hwf n ARG 54 N -4.79 0.00 -3.15 7.08 1.85 -1.24 -3.13 116.66 113.28 2hwf n ARG 54 Ca 0.09 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 57.00 2hwf n ARG 54 Cb 0.58 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.98 2hwf n ARG 54 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 177.63 177.15 2hwf s TYR 55 N 0.90 -0.30 -0.10 2.89 5.04 -1.24 -0.80 117.35 123.75 2hwf s TYR 55 Ca 0.00 0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.87 2hwf s TYR 55 Cb 0.00 0.08 0.02 0.00 0.35 0.00 0.00 41.96 42.41 2hwf s TYR 55 CO 0.00 -0.17 -0.08 0.08 -1.34 0.00 0.00 175.55 174.04 2hwf s VAL 56 N 2.97 0.99 -0.25 3.14 1.01 0.10 -5.02 120.40 123.34 2hwf s VAL 56 Ca 0.11 -0.29 -0.24 0.00 0.00 0.00 0.00 61.98 61.56 2hwf s VAL 56 Cb -0.05 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.32 2hwf s VAL 56 CO -0.15 0.35 0.79 -0.63 0.00 0.00 0.00 175.10 175.47 2hwf s ILE 57 N 1.51 4.85 0.00 2.22 1.01 -1.26 -2.12 121.20 127.41 2hwf s ILE 57 Ca 0.01 1.45 0.00 0.00 0.00 0.00 0.00 60.65 62.11 2hwf s ILE 57 Cb -0.13 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2hwf s ILE 57 CO -0.06 -0.08 0.00 0.35 0.00 0.00 0.00 174.94 175.15 2hwf n THR 58 N 5.29 0.00 0.00 2.92 -2.24 -1.26 -5.03 114.28 113.96 2hwf n THR 58 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2hwf n THR 58 Cb 0.48 -1.85 0.00 0.00 -2.10 0.00 0.00 70.33 66.86 2hwf n THR 58 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2hwf n SER 59 N -2.37 0.00 -4.24 3.42 3.41 -1.26 -5.04 113.62 107.53 2hwf n SER 59 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 2hwf n SER 59 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 2hwf n SER 59 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2hwf s GLN 60 N 0.00 2.53 0.11 4.33 -0.21 -1.26 -5.07 119.66 120.08 2hwf s GLN 60 Ca 0.00 -0.86 0.03 0.00 0.02 0.00 0.00 55.36 54.55 2hwf s GLN 60 Cb 0.00 -2.10 -0.04 0.00 1.00 0.00 0.00 33.01 31.87 2hwf s GLN 60 CO 0.00 0.33 0.13 0.99 -2.12 0.00 0.00 175.29 174.62 2hwf s THR 61 N -0.05 4.70 -0.42 -0.19 2.01 -1.26 -2.39 115.64 118.04 2hwf s THR 61 Ca -0.06 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.19 2hwf s THR 61 Cb -0.14 -3.32 0.57 0.00 0.01 0.00 0.00 72.50 69.62 2hwf s THR 61 CO 0.04 0.04 1.74 0.54 -0.69 0.00 0.00 174.62 176.30 2hwf n ARG 62 N 0.12 2.27 0.27 4.92 1.74 0.31 -4.59 116.66 121.70 2hwf n ARG 62 Ca -0.08 -3.20 -0.11 0.00 -0.77 0.00 0.00 57.85 53.69 2hwf n ARG 62 Cb 0.53 -2.08 -0.05 0.00 -1.02 0.00 0.00 32.46 29.83 2hwf n ARG 62 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2hwf h ASP 63 N 1.24 -0.63 0.00 0.55 5.19 -1.94 -2.95 116.42 117.89 2hwf h ASP 63 Ca 0.48 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.91 2hwf h ASP 63 Cb 2.04 0.16 0.00 0.00 0.18 0.00 0.00 39.33 41.72 2hwf h ASP 63 CO 0.93 -0.26 0.00 1.21 -3.12 0.00 0.00 179.24 177.99 2hwf n GLU 64 N -5.02 0.00 -1.70 3.56 2.13 -1.26 -2.61 120.64 115.74 2hwf n GLU 64 Ca -0.09 0.19 -0.34 0.00 0.66 0.00 0.00 57.16 57.57 2hwf n GLU 64 Cb 0.29 -1.50 0.05 0.00 0.27 0.00 0.00 31.44 30.55 2hwf n GLU 64 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2hwf n MET 65 N -1.19 2.90 -5.14 5.31 2.81 -1.11 -4.49 117.12 116.21 2hwf n MET 65 Ca 0.00 -3.59 -0.32 0.00 -1.81 0.00 0.00 57.70 51.98 2hwf n MET 65 Cb 0.00 -2.28 -0.16 0.00 -0.71 0.00 0.00 33.22 30.08 2hwf n MET 65 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2hwf s SER 66 N -2.00 3.34 0.05 7.83 0.01 -1.07 -4.95 113.70 116.91 2hwf s SER 66 Ca 0.58 -0.45 0.01 0.00 1.31 0.00 0.00 55.95 57.40 2hwf s SER 66 Cb 0.47 -1.01 0.05 0.00 0.21 0.00 0.00 66.02 65.74 2hwf s SER 66 CO -0.14 0.24 0.69 -0.38 0.41 0.00 0.00 173.24 174.06 2hwf n ILE 67 N 3.00 0.49 0.00 1.44 5.41 -1.26 0.21 119.36 128.65 2hwf n ILE 67 Ca -0.18 0.54 0.05 0.00 1.00 0.00 0.00 62.75 64.17 2hwf n ILE 67 Cb 0.52 -1.54 -0.12 0.00 -0.71 0.00 0.00 39.64 37.79 2hwf n ILE 67 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2hwf n GLU 68 N -1.26 0.65 0.00 0.38 4.07 -1.26 -2.11 120.64 121.11 2hwf n GLU 68 Ca -0.00 -0.02 0.11 0.00 -0.06 0.00 0.00 57.16 57.19 2hwf n GLU 68 Cb 0.40 -1.63 0.02 0.00 -0.06 0.00 0.00 31.44 30.17 2hwf n GLU 68 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 2hwf n SER 69 N -2.55 1.99 -0.08 4.31 3.41 0.13 -0.29 113.62 120.55 2hwf n SER 69 Ca -0.09 -1.49 -0.22 0.00 -0.26 0.00 0.00 58.87 56.80 2hwf n SER 69 Cb 0.72 0.45 -0.12 0.00 -0.26 0.00 0.00 64.21 65.00 2hwf n SER 69 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2hwf n PHE 70 N -0.03 0.68 -0.07 7.33 7.35 -0.34 -4.62 117.46 127.76 2hwf n PHE 70 Ca 0.10 0.19 -0.07 0.00 -0.76 0.00 0.00 57.45 56.91 2hwf n PHE 70 Cb 0.47 -1.08 -0.03 0.00 0.35 0.00 0.00 39.48 39.19 2hwf n PHE 70 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2hwf n LEU 71 N -3.74 1.82 -3.62 -2.13 4.77 -0.90 -4.77 117.00 108.44 2hwf n LEU 71 Ca -0.39 0.60 -0.08 0.00 -0.03 0.00 0.00 56.01 56.10 2hwf n LEU 71 Cb 0.93 -0.87 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 2hwf n LEU 71 CO 0.27 -0.39 0.61 0.61 -1.33 0.00 0.00 177.39 177.16 2hwf n GLY 72 N 1.59 0.34 3.05 -0.72 0.00 0.60 -4.61 105.19 105.44 2hwf n GLY 72 Ca -0.10 -0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2hwf n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hwf s ARG 73 N 3.45 0.19 0.25 1.61 0.52 -1.26 -4.83 118.95 118.87 2hwf s ARG 73 Ca 0.13 0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 55.73 2hwf s ARG 73 Cb 0.03 -0.04 -0.11 0.00 0.52 0.00 0.00 34.95 35.35 2hwf s ARG 73 CO 0.07 -0.23 1.53 -1.12 0.02 0.00 0.00 175.30 175.56 2hwf s SER 74 N 1.97 6.53 -0.07 0.23 0.01 -1.24 -4.53 113.70 116.60 2hwf s SER 74 Ca -0.03 2.77 -0.04 0.00 1.31 0.00 0.00 55.95 59.95 2hwf s SER 74 Cb -0.11 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.53 2hwf s SER 74 CO -0.09 -0.81 0.17 -0.83 0.41 0.00 0.00 173.24 172.10 2hwf s GLY 75 N 0.55 -0.09 0.09 3.44 0.00 -0.40 -4.77 107.32 106.15 2hwf s GLY 75 Ca 0.63 0.66 -0.34 0.00 0.00 0.00 0.00 44.72 45.67 2hwf s GLY 75 CO 0.43 0.80 1.69 0.00 0.00 0.00 0.00 173.10 176.02 2hwf n VAL 77 N 4.01 0.00 -3.65 0.00 0.24 -0.38 -4.86 118.33 113.70 2hwf n VAL 77 Ca 0.18 -0.23 -0.03 0.00 -2.04 0.00 0.00 64.34 62.23 2hwf n VAL 77 Cb 0.30 1.38 -0.06 0.00 -1.47 0.00 0.00 33.84 33.99 2hwf n VAL 77 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2hwf s HIS 78 N -0.13 -0.04 -0.64 6.34 5.65 -1.25 -4.31 115.29 120.89 2hwf s HIS 78 Ca 0.00 0.10 0.05 0.00 0.25 0.00 0.00 55.06 55.46 2hwf s HIS 78 Cb 0.00 0.49 0.17 0.00 -1.18 0.00 0.00 32.58 32.06 2hwf s HIS 78 CO 0.00 -0.02 0.46 0.42 -0.65 0.00 0.00 174.74 174.95 2hwf s ILE 79 N -0.18 2.36 0.28 0.89 1.01 -1.26 -0.72 121.20 123.57 2hwf s ILE 79 Ca 0.08 -3.94 -0.30 0.00 0.00 0.00 0.00 60.65 56.48 2hwf s ILE 79 Cb -0.04 -2.55 -0.12 0.00 0.01 0.00 0.00 42.46 39.76 2hwf s ILE 79 CO -0.14 -1.06 1.62 -0.24 0.00 0.00 0.00 174.94 175.12 2hwf n SER 80 N 2.15 3.91 -4.11 3.58 2.88 -1.11 -4.88 113.62 116.04 2hwf n SER 80 Ca 0.22 1.14 -0.21 0.00 -1.33 0.00 0.00 58.87 58.69 2hwf n SER 80 Cb 0.38 -1.60 -0.14 0.00 -0.75 0.00 0.00 64.21 62.10 2hwf n SER 80 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2hwf s ARG 81 N -0.32 1.00 -0.27 -1.46 3.52 -1.26 -1.13 118.95 119.04 2hwf s ARG 81 Ca 0.65 -0.56 -0.03 0.00 -0.13 0.00 0.00 55.73 55.67 2hwf s ARG 81 Cb -0.49 -0.98 0.11 0.00 -1.56 0.00 0.00 34.95 32.02 2hwf s ARG 81 CO 0.47 0.26 0.20 0.42 -0.81 0.00 0.00 175.30 175.84 2hwf s ILE 82 N -0.49 -0.23 -0.67 4.11 1.01 -0.06 -4.83 121.20 120.03 2hwf s ILE 82 Ca 0.04 -0.51 -0.21 0.00 0.00 0.00 0.00 60.65 59.97 2hwf s ILE 82 Cb -0.06 -0.90 0.09 0.00 0.01 0.00 0.00 42.46 41.60 2hwf s ILE 82 CO 0.00 -0.52 0.90 -1.59 0.00 0.00 0.00 174.94 173.74 2hwf s LYS 83 N 2.23 3.16 1.04 2.79 -2.85 -1.26 -1.29 119.74 123.56 2hwf s LYS 83 Ca 0.08 -1.12 -0.11 0.00 -1.00 0.00 0.00 55.97 53.82 2hwf s LYS 83 Cb -0.15 -4.33 0.22 0.00 -2.06 0.00 0.00 37.83 31.51 2hwf s LYS 83 CO -0.29 -1.72 1.08 0.08 0.10 0.00 0.00 175.35 174.60 2hwf s VAL 84 N 3.43 2.09 0.00 1.79 1.01 -1.10 -4.85 120.40 122.78 2hwf s VAL 84 Ca 0.20 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.22 2hwf s VAL 84 Cb -0.18 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 2hwf s VAL 84 CO 0.06 -0.04 -0.04 -0.62 0.00 0.00 0.00 175.10 174.46 2hwf s ASP 85 N -2.63 0.49 0.00 3.32 -1.08 -1.26 -4.87 116.67 110.63 2hwf s ASP 85 Ca 0.67 -0.15 0.00 0.00 -0.52 0.00 0.00 52.55 52.56 2hwf s ASP 85 Cb -0.24 -0.03 0.00 0.00 -1.46 0.00 0.00 42.92 41.19 2hwf s ASP 85 CO 0.61 0.00 0.00 -1.22 0.52 0.00 0.00 175.17 175.08 2hwf n TYR 86 N 2.74 0.00 0.35 -5.34 4.01 -1.26 -4.65 117.16 113.00 2hwf n TYR 86 Ca -0.14 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.41 2hwf n TYR 86 Cb 0.58 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.51 2hwf n TYR 86 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2hwf h THR 87 N 0.00 0.03 -3.16 -0.72 1.35 -1.97 -3.38 112.91 105.06 2hwf h THR 87 Ca 0.00 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 65.23 2hwf h THR 87 Cb 0.00 0.03 -0.36 0.00 -1.73 0.00 0.00 68.15 66.10 2hwf h THR 87 CO 0.00 0.00 -0.84 -0.62 -0.25 0.00 0.00 175.52 173.81 2hwf s ASP 88 N -4.30 3.00 -0.08 5.36 2.15 -1.26 -5.09 116.67 116.45 2hwf s ASP 88 Ca -0.18 -0.63 -0.00 0.00 0.43 0.00 0.00 52.55 52.16 2hwf s ASP 88 Cb 0.04 -1.31 -0.03 0.00 -0.30 0.00 0.00 42.92 41.32 2hwf s ASP 88 CO 0.61 -0.05 -0.05 -0.47 -0.17 0.00 0.00 175.17 175.04 2hwf s TYR 89 N 1.39 3.00 0.00 -5.34 5.04 -1.26 -4.74 117.35 115.43 2hwf s TYR 89 Ca 0.04 0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.68 2hwf s TYR 89 Cb -0.14 -1.76 0.00 0.00 0.35 0.00 0.00 41.96 40.41 2hwf s TYR 89 CO -0.11 0.31 0.00 0.09 -1.34 0.00 0.00 175.55 174.50 2hwf n ASN 90 N 2.38 0.00 -1.18 4.32 5.03 -1.26 -5.01 115.26 119.54 2hwf n ASN 90 Ca -0.18 0.00 0.15 0.00 0.87 0.00 0.00 54.58 55.42 2hwf n ASN 90 Cb 0.53 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.24 2hwf n ASN 90 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2hwf n GLY 91 N 0.00 -2.32 3.55 7.41 0.00 -1.26 -4.21 105.19 108.37 2hwf n GLY 91 Ca 0.00 -1.19 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 2hwf n GLY 91 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2hwf s GLN 92 N -2.75 3.87 -0.15 1.61 0.74 -1.26 -4.17 119.66 117.55 2hwf s GLN 92 Ca 0.00 -0.37 -0.00 0.00 0.05 0.00 0.00 55.36 55.04 2hwf s GLN 92 Cb 0.00 -3.50 0.00 0.00 1.10 0.00 0.00 33.01 30.61 2hwf s GLN 92 CO 0.00 -0.12 0.13 -0.25 -0.55 0.00 0.00 175.29 174.50 2hwf n ASP 93 N 4.80 -2.16 -3.86 6.67 8.00 -0.21 -5.00 116.55 124.78 2hwf n ASP 93 Ca -0.15 -0.07 -0.11 0.00 0.71 0.00 0.00 54.79 55.16 2hwf n ASP 93 Cb 0.52 -1.07 -0.11 0.00 -0.02 0.00 0.00 41.12 40.43 2hwf n ASP 93 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2hwf s ILE 94 N -3.04 0.04 -0.06 0.53 1.09 -1.26 -4.86 121.20 113.64 2hwf s ILE 94 Ca 0.02 -0.37 0.00 0.00 -1.10 0.00 0.00 60.65 59.21 2hwf s ILE 94 Cb -0.01 -0.29 0.00 0.00 -1.06 0.00 0.00 42.46 41.10 2hwf s ILE 94 CO 0.09 -0.20 0.00 0.59 -0.10 0.00 0.00 174.94 175.32 2hwf n ASN 95 N 2.26 -5.49 -3.77 3.58 5.03 -1.26 -3.95 115.26 111.66 2hwf n ASN 95 Ca -0.18 0.01 -0.14 0.00 0.87 0.00 0.00 54.58 55.14 2hwf n ASN 95 Cb 0.57 -3.04 -0.15 0.00 -1.02 0.00 0.00 39.78 36.14 2hwf n ASN 95 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 2hwf s PHE 96 N -1.21 -0.03 0.30 3.10 -0.12 -1.26 -4.02 117.98 114.73 2hwf s PHE 96 Ca 0.00 0.23 0.05 0.00 -0.05 0.00 0.00 56.93 57.16 2hwf s PHE 96 Cb 0.00 -0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.20 2hwf s PHE 96 CO 0.00 -0.11 0.44 -0.08 -0.05 0.00 0.00 175.22 175.42 2hwf s THR 97 N 1.03 4.59 -0.29 -4.49 -1.32 -1.26 -4.92 115.64 108.98 2hwf s THR 97 Ca -0.08 -0.95 0.05 0.00 -1.21 0.00 0.00 61.69 59.50 2hwf s THR 97 Cb -0.12 -3.61 0.20 0.00 -1.51 0.00 0.00 72.50 67.46 2hwf s THR 97 CO -0.04 -0.25 0.61 -1.59 -2.21 0.00 0.00 174.62 171.14 2hwf s LYS 98 N -4.12 0.55 0.09 7.08 -2.85 -1.26 -0.51 119.74 118.71 2hwf s LYS 98 Ca 0.41 0.55 0.05 0.00 -1.00 0.00 0.00 55.97 55.98 2hwf s LYS 98 Cb -0.09 0.26 -0.04 0.00 -2.06 0.00 0.00 37.83 35.89 2hwf s LYS 98 CO 0.31 -1.00 -0.02 -0.46 0.10 0.00 0.00 175.35 174.27 2hwf s TRP 99 N 2.84 2.94 -0.32 1.78 -0.00 -1.12 -4.98 118.94 120.08 2hwf s TRP 99 Ca 0.11 -0.05 -0.26 0.00 -0.00 0.00 0.00 56.10 55.90 2hwf s TRP 99 Cb -0.10 -1.52 0.01 0.00 -0.00 0.00 0.00 33.47 31.86 2hwf s TRP 99 CO -0.26 0.46 0.92 0.21 -0.00 0.00 0.00 176.95 178.29 2hwf s LYS 100 N -2.22 3.99 0.35 5.86 2.47 -1.26 -2.89 119.74 126.04 2hwf s LYS 100 Ca 0.24 0.79 -0.28 0.00 -1.56 0.00 0.00 55.97 55.16 2hwf s LYS 100 Cb -0.12 -3.74 -0.10 0.00 -1.46 0.00 0.00 37.83 32.41 2hwf s LYS 100 CO 0.17 -0.79 1.36 0.96 0.16 0.00 0.00 175.35 177.21 2hwf s ILE 101 N 3.28 2.50 0.00 5.43 -4.36 -1.25 -4.84 121.20 121.97 2hwf s ILE 101 Ca 0.38 0.51 0.00 0.00 -0.26 0.00 0.00 60.65 61.28 2hwf s ILE 101 Cb -0.13 -3.32 0.00 0.00 1.25 0.00 0.00 42.46 40.26 2hwf s ILE 101 CO 0.14 0.12 0.00 1.07 0.24 0.00 0.00 174.94 176.51 2hwf n THR 102 N 0.66 0.00 0.00 8.37 5.66 -1.26 -4.73 114.28 122.98 2hwf n THR 102 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2hwf n THR 102 Cb 0.41 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.19 2hwf n THR 102 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2hwf n LEU 103 N 0.00 0.00 0.00 1.09 4.77 -1.26 -4.48 117.00 117.12 2hwf n LEU 103 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2hwf n LEU 103 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2hwf n LEU 103 CO 0.00 -0.24 0.00 0.00 -1.33 0.00 0.00 177.39 175.82 2hwf n GLN 104 N 0.00 0.00 0.00 3.23 1.13 -1.26 -4.71 117.38 115.77 2hwf n GLN 104 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2hwf n GLN 104 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2hwf n GLN 104 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2hwf n GLU 105 N 0.00 0.00 -3.69 -1.09 4.71 -1.26 -4.23 120.64 115.08 2hwf n GLU 105 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.03 2hwf n GLU 105 Cb 0.00 -1.36 -0.09 0.00 -1.01 0.00 0.00 31.44 28.98 2hwf n GLU 105 CO 0.00 0.00 0.00 1.41 0.09 0.00 0.00 177.13 178.63 2hwf s MET 106 N -1.73 0.57 0.00 3.49 1.75 -1.26 -4.82 119.30 117.29 2hwf s MET 106 Ca 0.00 0.80 0.00 0.00 -1.25 0.00 0.00 55.69 55.24 2hwf s MET 106 Cb 0.00 0.20 0.00 0.00 2.84 0.00 0.00 34.83 37.87 2hwf s MET 106 CO 0.00 -0.10 0.00 0.00 -0.65 0.00 0.00 175.02 174.27 2hwf n ALA 107 N 3.35 0.00 -0.45 4.11 0.00 -1.26 -3.82 120.51 122.44 2hwf n ALA 107 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2hwf n ALA 107 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2hwf n ALA 107 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2hwf n GLN 108 N 0.00 0.00 -0.06 0.00 7.27 -1.26 -2.47 117.38 120.86 2hwf n GLN 108 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 56.99 2hwf n GLN 108 Cb 0.00 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.63 2hwf n GLN 108 CO 0.00 0.00 0.00 0.97 0.07 0.00 0.00 177.06 178.10 2hwf h ILE 109 N 0.00 0.92 -0.63 1.69 2.10 -1.90 -2.41 117.51 117.27 2hwf h ILE 109 Ca 0.00 -0.06 0.13 0.00 1.08 0.00 0.00 64.86 66.01 2hwf h ILE 109 Cb 0.00 0.73 -0.10 0.00 -1.09 0.00 0.00 36.82 36.37 2hwf h ILE 109 CO 0.00 0.03 0.10 -0.09 -1.08 0.00 0.00 178.15 177.11 2hwf h ARG 110 N 0.17 0.21 -0.81 2.19 2.43 -1.58 -0.81 114.38 116.17 2hwf h ARG 110 Ca 0.11 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2hwf h ARG 110 Cb 0.09 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 2hwf h ARG 110 CO -0.13 0.14 0.50 -0.09 -1.51 0.00 0.00 179.97 178.88 2hwf h ARG 111 N 0.22 1.09 0.24 0.20 9.65 -1.72 -2.94 114.38 121.12 2hwf h ARG 111 Ca 0.34 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 2hwf h ARG 111 Cb 0.53 -0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 28.85 2hwf h ARG 111 CO -0.46 0.76 -0.45 -0.22 2.80 0.00 0.00 179.97 182.39 2hwf h LYS 112 N 1.11 -0.72 0.00 0.20 1.63 -0.67 -3.28 116.57 114.83 2hwf h LYS 112 Ca 0.29 0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.14 2hwf h LYS 112 Cb -0.06 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2hwf h LYS 112 CO -0.06 -0.48 0.00 1.19 -3.45 0.00 0.00 179.45 176.65 2hwf n PHE 113 N -5.08 0.00 0.01 1.91 3.01 -1.09 -2.43 117.46 113.79 2hwf n PHE 113 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2hwf n PHE 113 Cb 0.38 -0.41 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 2hwf n PHE 113 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2hwf n GLU 114 N -2.06 0.00 0.11 -1.08 1.02 -1.12 0.10 120.64 117.62 2hwf n GLU 114 Ca 0.00 0.04 0.10 0.00 -0.02 0.00 0.00 57.16 57.28 2hwf n GLU 114 Cb 0.00 -0.22 0.46 0.00 -0.02 0.00 0.00 31.44 31.66 2hwf n GLU 114 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2hwf n LEU 115 N -0.36 0.52 -4.11 -4.62 7.94 -1.02 -4.69 117.00 110.65 2hwf n LEU 115 Ca 0.00 0.66 -0.16 0.00 -1.11 0.00 0.00 56.01 55.40 2hwf n LEU 115 Cb 0.07 -0.62 -0.12 0.00 0.53 0.00 0.00 43.42 43.28 2hwf n LEU 115 CO 0.00 -0.60 -0.43 -0.36 -1.11 0.00 0.00 177.39 174.89 2hwf s PHE 116 N -3.31 0.94 -0.03 1.96 0.08 0.29 0.11 117.98 118.03 2hwf s PHE 116 Ca 0.03 -0.46 -0.19 0.00 0.12 0.00 0.00 56.93 56.43 2hwf s PHE 116 Cb 0.08 -0.55 -0.12 0.00 -0.57 0.00 0.00 43.02 41.87 2hwf s PHE 116 CO 0.31 -0.01 0.80 1.15 -0.10 0.00 0.00 175.22 177.37 2hwf h THR 117 N 4.42 0.30 -4.12 0.64 2.02 -1.27 -3.45 112.91 111.45 2hwf h THR 117 Ca -0.38 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.03 2hwf h THR 117 Cb 1.20 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 2hwf h THR 117 CO 0.41 0.07 -0.03 -1.22 0.37 0.00 0.00 175.52 175.12 2hwf n TYR 118 N -5.10 -0.55 0.00 3.16 4.01 -1.21 -1.26 117.16 116.21 2hwf n TYR 118 Ca -0.08 -0.20 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 2hwf n TYR 118 Cb 0.25 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 2hwf n TYR 118 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 2hwf n VAL 119 N -0.32 0.00 -3.63 -0.72 3.14 -1.24 -4.19 118.33 111.36 2hwf n VAL 119 Ca -0.01 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.32 2hwf n VAL 119 Cb 0.05 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.77 2hwf n VAL 119 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 2hwf s ARG 120 N -2.00 0.22 0.00 1.45 3.52 -1.25 -0.92 118.95 119.97 2hwf s ARG 120 Ca 0.00 0.16 0.00 0.00 -0.13 0.00 0.00 55.73 55.76 2hwf s ARG 120 Cb 0.00 0.11 0.00 0.00 -1.56 0.00 0.00 34.95 33.50 2hwf s ARG 120 CO 0.00 -0.05 0.00 1.97 -0.81 0.00 0.00 175.30 176.41 2hwf n PHE 121 N 1.28 0.00 -2.72 5.12 -1.74 -1.26 -1.94 117.46 116.20 2hwf n PHE 121 Ca -0.08 0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.40 2hwf n PHE 121 Cb 0.57 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.54 2hwf n PHE 121 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2hwf s ASP 122 N 0.00 7.43 -0.20 5.98 1.11 -1.00 -3.94 116.67 126.05 2hwf s ASP 122 Ca 0.00 1.72 -0.06 0.00 0.18 0.00 0.00 52.55 54.39 2hwf s ASP 122 Cb 0.00 -2.58 -0.03 0.00 1.07 0.00 0.00 42.92 41.38 2hwf s ASP 122 CO 0.00 -0.17 0.04 -0.44 1.18 0.00 0.00 175.17 175.78 2hwf s SER 123 N 0.55 5.27 -0.14 0.27 0.01 0.51 -1.20 113.70 118.97 2hwf s SER 123 Ca 0.50 -0.06 -0.09 0.00 1.31 0.00 0.00 55.95 57.61 2hwf s SER 123 Cb -0.22 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.06 2hwf s SER 123 CO 0.29 0.11 0.17 -1.83 0.41 0.00 0.00 173.24 172.39 2hwf s GLU 124 N 0.77 3.77 0.34 12.44 4.04 0.55 0.72 118.70 141.33 2hwf s GLU 124 Ca 0.02 -0.09 0.09 0.00 0.04 0.00 0.00 54.97 55.03 2hwf s GLU 124 Cb -0.14 -3.28 -0.06 0.00 0.02 0.00 0.00 34.13 30.67 2hwf s GLU 124 CO 0.02 0.59 -0.07 0.42 -1.84 0.00 0.00 175.26 174.38 2hwf s ILE 125 N -0.50 2.33 -0.28 1.83 1.09 -0.08 -1.20 121.20 124.38 2hwf s ILE 125 Ca 0.14 -2.15 -0.16 0.00 -1.10 0.00 0.00 60.65 57.38 2hwf s ILE 125 Cb -0.12 -2.69 0.10 0.00 -1.06 0.00 0.00 42.46 38.69 2hwf s ILE 125 CO 0.03 -0.20 0.75 -0.89 -0.10 0.00 0.00 174.94 174.53 2hwf s THR 126 N -2.59 -0.08 0.21 2.92 2.01 -1.20 -2.70 115.64 114.21 2hwf s THR 126 Ca 0.33 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.39 2hwf s THR 126 Cb 0.02 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.49 2hwf s THR 126 CO 0.17 0.00 0.22 -0.76 -0.69 0.00 0.00 174.62 173.56 2hwf s LEU 127 N 1.69 3.98 -0.43 4.42 2.01 0.30 -2.65 118.68 127.99 2hwf s LEU 127 Ca -0.09 -0.10 0.08 0.00 0.01 0.00 0.00 54.13 54.03 2hwf s LEU 127 Cb -0.05 -2.54 0.28 0.00 0.01 0.00 0.00 46.19 43.90 2hwf s LEU 127 CO -0.19 -0.00 0.79 0.52 1.01 0.00 0.00 176.35 178.48 2hwf n VAL 128 N -0.90 -0.25 -1.78 -1.59 0.31 -1.15 -4.29 118.33 108.68 2hwf n VAL 128 Ca -0.08 -2.98 -0.41 0.00 -0.01 0.00 0.00 64.34 60.87 2hwf n VAL 128 Cb 0.56 0.04 0.01 0.00 -0.91 0.00 0.00 33.84 33.54 2hwf n VAL 128 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2hwf s PRO 129 N -0.68 3.90 -0.23 5.55 0.01 -1.26 -2.58 135.00 139.71 2hwf s PRO 129 Ca 0.33 2.53 -0.03 0.00 0.01 0.00 0.00 61.00 63.85 2hwf s PRO 129 Cb 0.25 -2.82 0.07 0.00 0.01 0.00 0.00 34.50 32.01 2hwf s PRO 129 CO -0.13 -0.69 0.06 0.00 0.01 0.00 0.00 177.00 176.25 2hwf s ILE 131 N 1.83 4.79 -0.20 0.00 1.01 -1.26 -2.51 121.20 124.86 2hwf s ILE 131 Ca 0.02 -0.13 -0.18 0.00 0.00 0.00 0.00 60.65 60.36 2hwf s ILE 131 Cb -0.17 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 37.98 2hwf s ILE 131 CO -0.15 -0.75 0.52 0.00 0.00 0.00 0.00 174.94 174.56 2hwf s ALA 132 N 2.88 3.55 -0.40 9.38 0.00 -0.60 -4.99 121.76 131.57 2hwf s ALA 132 Ca 0.20 -0.41 -0.25 0.00 0.00 0.00 0.00 51.96 51.50 2hwf s ALA 132 Cb -0.16 -2.81 0.02 0.00 0.00 0.00 0.00 23.12 20.16 2hwf s ALA 132 CO 0.16 -0.45 0.87 0.20 0.00 0.00 0.00 175.76 176.54 2hwf s GLY 133 N 1.16 1.57 0.00 0.00 0.00 -1.26 -2.22 107.32 106.58 2hwf s GLY 133 Ca 0.24 -0.65 0.07 0.00 0.00 0.00 0.00 44.72 44.38 2hwf s GLY 133 CO 0.10 1.92 0.76 -2.13 0.00 0.00 0.00 173.10 173.75 2hwf n ARG 134 N 6.77 0.25 -4.51 2.90 3.00 -1.22 -4.97 116.66 118.88 2hwf n ARG 134 Ca 0.05 -1.00 -0.30 0.00 -0.00 0.00 0.00 57.85 56.60 2hwf n ARG 134 Cb 0.48 -1.14 -0.07 0.00 0.00 0.00 0.00 32.46 31.73 2hwf n ARG 134 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2hwf s GLY 135 N -0.62 2.72 -0.04 5.14 0.00 -1.16 -4.68 107.32 108.68 2hwf s GLY 135 Ca 0.09 -1.20 0.07 0.00 0.00 0.00 0.00 44.72 43.68 2hwf s GLY 135 CO 0.09 -2.10 1.08 1.22 0.00 0.00 0.00 173.10 173.39 2hwf n ASP 136 N -1.27 2.01 0.00 1.64 8.00 -1.26 -4.83 116.55 120.84 2hwf n ASP 136 Ca -0.11 -2.15 0.00 0.00 0.71 0.00 0.00 54.79 53.24 2hwf n ASP 136 Cb 0.66 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2hwf n ASP 136 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2hwf n ASP 137 N 0.26 0.00 -0.10 -2.24 2.03 -1.26 -5.09 116.55 110.15 2hwf n ASP 137 Ca 0.09 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.29 2hwf n ASP 137 Cb 0.39 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.75 2hwf n ASP 137 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2hwf n ILE 138 N 0.00 1.50 0.00 5.18 -5.35 -1.26 -4.36 119.36 115.07 2hwf n ILE 138 Ca 0.00 0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 2hwf n ILE 138 Cb 0.00 -2.29 0.00 0.00 -1.74 0.00 0.00 39.64 35.61 2hwf n ILE 138 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2hwf n GLY 139 N 1.43 1.95 3.52 3.28 0.00 -1.26 -4.73 105.19 109.38 2hwf n GLY 139 Ca -0.19 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 2hwf n GLY 139 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2hwf s HIS 140 N 0.00 3.15 -0.29 1.61 2.46 -1.26 -4.89 115.29 116.07 2hwf s HIS 140 Ca 0.00 -0.16 -0.02 0.00 0.47 0.00 0.00 55.06 55.35 2hwf s HIS 140 Cb 0.00 -2.31 0.09 0.00 -0.13 0.00 0.00 32.58 30.24 2hwf s HIS 140 CO 0.00 -0.26 0.10 -1.50 -2.47 0.00 0.00 174.74 170.61 2hwf s ILE 141 N 1.69 0.46 0.59 0.89 2.07 -1.26 -4.98 121.20 120.66 2hwf s ILE 141 Ca 0.07 -1.03 -0.15 0.00 -1.41 0.00 0.00 60.65 58.12 2hwf s ILE 141 Cb -0.16 -1.31 -0.04 0.00 0.13 0.00 0.00 42.46 41.08 2hwf s ILE 141 CO 0.07 -0.63 1.04 -0.69 -1.91 0.00 0.00 174.94 172.82 2hwf s VAL 142 N 1.84 3.98 0.03 4.00 1.01 -1.26 -3.71 120.40 126.28 2hwf s VAL 142 Ca 0.08 0.89 0.01 0.00 0.00 0.00 0.00 61.98 62.97 2hwf s VAL 142 Cb -0.17 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 2hwf s VAL 142 CO -0.27 -0.60 -0.05 -0.32 0.00 0.00 0.00 175.10 173.86 2hwf s MET 143 N -4.23 0.41 -0.21 2.72 1.75 -0.37 -2.93 119.30 116.44 2hwf s MET 143 Ca 0.62 -0.61 -0.03 0.00 -1.25 0.00 0.00 55.69 54.42 2hwf s MET 143 Cb -0.15 -0.14 0.07 0.00 2.84 0.00 0.00 34.83 37.46 2hwf s MET 143 CO 0.39 0.02 0.05 -1.14 -0.65 0.00 0.00 175.02 173.68 2hwf s GLN 144 N -1.33 0.61 -0.41 4.11 0.74 0.36 -2.08 119.66 121.68 2hwf s GLN 144 Ca -0.11 -0.49 -0.12 0.00 0.05 0.00 0.00 55.36 54.70 2hwf s GLN 144 Cb -0.09 -2.04 0.05 0.00 1.10 0.00 0.00 33.01 32.03 2hwf s GLN 144 CO -0.00 -0.70 0.26 0.71 -0.55 0.00 0.00 175.29 175.01 2hwf s TYR 145 N 1.86 3.27 -0.18 1.67 1.51 -0.36 -2.36 117.35 122.76 2hwf s TYR 145 Ca 0.01 -1.09 0.01 0.00 -1.01 0.00 0.00 57.07 54.99 2hwf s TYR 145 Cb -0.17 -2.72 0.02 0.00 -0.11 0.00 0.00 41.96 38.98 2hwf s TYR 145 CO -0.11 -0.73 -0.20 0.00 -1.11 0.00 0.00 175.55 173.40 2hwf s MET 146 N 1.54 2.93 0.63 -0.62 0.23 -0.13 -0.23 119.30 123.66 2hwf s MET 146 Ca 0.03 -0.81 -0.14 0.00 -1.03 0.00 0.00 55.69 53.74 2hwf s MET 146 Cb -0.21 -2.53 -0.02 0.00 -1.53 0.00 0.00 34.83 30.55 2hwf s MET 146 CO 0.06 -0.21 1.07 -0.47 -2.03 0.00 0.00 175.02 173.44 2hwf s TYR 147 N 1.29 2.93 -0.28 3.16 5.04 0.54 -0.87 117.35 129.17 2hwf s TYR 147 Ca 0.05 1.50 -0.01 0.00 -2.44 0.00 0.00 57.07 56.17 2hwf s TYR 147 Cb -0.13 -3.01 0.17 0.00 0.35 0.00 0.00 41.96 39.34 2hwf s TYR 147 CO -0.13 -1.26 0.51 0.08 -1.34 0.00 0.00 175.55 173.42 2hwf s VAL 148 N -2.58 -0.85 0.00 3.14 1.01 0.12 -4.26 120.40 116.98 2hwf s VAL 148 Ca 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.57 2hwf s VAL 148 Cb -0.16 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.28 2hwf s VAL 148 CO 0.42 -0.05 0.00 -0.81 0.00 0.00 0.00 175.10 174.66 2hwf n PRO 149 N 5.40 -0.98 0.00 2.72 -0.04 -1.26 0.69 135.00 141.53 2hwf n PRO 149 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 2hwf n PRO 149 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 2hwf n PRO 149 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2hwf n PRO 150 N -1.35 1.91 0.00 0.54 -0.02 -1.26 -4.18 135.00 130.64 2hwf n PRO 150 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2hwf n PRO 150 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2hwf n PRO 150 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hwf n GLY 151 N 0.08 0.00 3.43 -1.23 0.00 -1.26 -4.80 105.19 101.41 2hwf n GLY 151 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2hwf n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hwf s ALA 152 N 0.00 -1.36 -0.31 4.61 0.00 -1.26 -5.11 121.76 118.33 2hwf s ALA 152 Ca 0.00 1.29 -0.28 0.00 0.00 0.00 0.00 51.96 52.97 2hwf s ALA 152 Cb 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2hwf s ALA 152 CO 0.00 -0.29 2.09 -1.25 0.00 0.00 0.00 175.76 176.31 2hwf s PRO 153 N -0.34 3.03 -0.15 0.00 0.04 -1.26 -4.95 135.00 131.37 2hwf s PRO 153 Ca -0.05 1.67 -0.20 0.00 0.04 0.00 0.00 61.00 62.46 2hwf s PRO 153 Cb -0.03 -4.35 -0.03 0.00 0.04 0.00 0.00 34.50 30.13 2hwf s PRO 153 CO 0.04 -2.22 0.58 0.42 0.04 0.00 0.00 177.00 175.85 2hwf s ILE 154 N 8.43 5.09 -0.04 0.56 1.09 -1.26 -4.85 121.20 130.21 2hwf s ILE 154 Ca 0.91 1.13 -0.32 0.00 -1.10 0.00 0.00 60.65 61.27 2hwf s ILE 154 Cb -0.26 -3.91 -0.10 0.00 -1.06 0.00 0.00 42.46 37.13 2hwf s ILE 154 CO 0.33 0.21 1.97 -2.65 -0.10 0.00 0.00 174.94 174.69 2hwf n PRO 155 N 4.39 2.49 -0.25 2.79 -0.02 -1.26 -4.82 135.00 138.32 2hwf n PRO 155 Ca -0.04 0.89 0.02 0.00 -2.02 0.00 0.00 63.50 62.36 2hwf n PRO 155 Cb 0.51 -2.88 0.15 0.00 -0.02 0.00 0.00 33.50 31.26 2hwf n PRO 155 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2hwf h SER 156 N 10.54 0.44 -3.67 2.55 0.02 -1.98 -3.45 113.55 118.00 2hwf h SER 156 Ca -0.48 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.55 2hwf h SER 156 Cb 1.25 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.56 2hwf h SER 156 CO 0.95 0.24 0.30 -1.59 -1.14 0.00 0.00 176.83 175.58 2hwf s LYS 157 N -6.05 0.68 0.00 3.45 0.00 -1.26 -1.05 119.74 115.51 2hwf s LYS 157 Ca -0.13 0.75 0.00 0.00 0.00 0.00 0.00 55.97 56.60 2hwf s LYS 157 Cb 0.19 0.33 0.00 0.00 0.00 0.00 0.00 37.83 38.35 2hwf s LYS 157 CO 0.76 -0.09 0.00 -2.13 0.00 0.00 0.00 175.35 173.89 2hwf n ARG 158 N 2.33 0.00 -2.13 1.78 0.63 -1.25 -2.25 116.66 115.77 2hwf n ARG 158 Ca -0.13 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.37 2hwf n ARG 158 Cb 0.56 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.47 2hwf n ARG 158 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2hwf n ASN 159 N 0.00 4.41 0.00 6.15 0.23 -1.26 -4.82 115.26 119.97 2hwf n ASN 159 Ca 0.00 -2.90 0.00 0.00 -0.53 0.00 0.00 54.58 51.15 2hwf n ASN 159 Cb 0.00 -1.66 0.00 0.00 -2.08 0.00 0.00 39.78 36.04 2hwf n ASN 159 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2hwf n ASP 160 N 6.48 0.00 0.00 0.53 9.92 -0.95 -4.99 116.55 127.54 2hwf n ASP 160 Ca 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.75 2hwf n ASP 160 Cb 0.41 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.89 2hwf n ASP 160 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 2hwf n PHE 161 N 0.00 0.00 1.26 1.24 1.16 -1.26 -4.83 117.46 115.02 2hwf n PHE 161 Ca 0.00 0.00 0.14 0.00 -1.87 0.00 0.00 57.45 55.72 2hwf n PHE 161 Cb 0.00 0.02 0.62 0.00 -1.61 0.00 0.00 39.48 38.51 2hwf n PHE 161 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2hwf n SER 162 N 0.00 0.19 -1.61 5.98 3.41 -1.26 -3.12 113.62 117.21 2hwf n SER 162 Ca 0.00 -0.10 0.06 0.00 -0.26 0.00 0.00 58.87 58.57 2hwf n SER 162 Cb 0.10 -0.23 0.33 0.00 -0.26 0.00 0.00 64.21 64.16 2hwf n SER 162 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2hwf n TRP 163 N -1.27 1.65 -0.00 7.33 7.02 -1.26 -3.54 117.44 127.36 2hwf n TRP 163 Ca 0.11 -0.58 -0.03 0.00 -1.02 0.00 0.00 57.50 55.98 2hwf n TRP 163 Cb 0.29 -0.41 -0.11 0.00 -2.42 0.00 0.00 31.31 28.66 2hwf n TRP 163 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2hwf n GLN 164 N 0.58 0.64 -4.08 -0.99 6.02 -1.18 -4.98 117.38 113.39 2hwf n GLN 164 Ca 0.23 0.18 -0.32 0.00 -0.01 0.00 0.00 57.00 57.07 2hwf n GLN 164 Cb 0.99 -1.74 -0.01 0.00 1.02 0.00 0.00 30.24 30.50 2hwf n GLN 164 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2hwf n SER 165 N -2.86 -3.20 0.23 1.08 7.64 -1.23 -4.80 113.62 110.48 2hwf n SER 165 Ca -0.15 -0.94 0.18 0.00 1.01 0.00 0.00 58.87 58.97 2hwf n SER 165 Cb 0.92 -3.16 0.84 0.00 -1.01 0.00 0.00 64.21 61.80 2hwf n SER 165 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2hwf h GLY 166 N -1.73 0.00 -3.03 0.23 0.00 -1.92 -2.77 103.07 93.84 2hwf h GLY 166 Ca -0.59 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.57 2hwf h GLY 166 CO 0.72 0.00 -0.61 -0.37 0.00 0.00 0.00 176.54 176.28 2hwf n THR 167 N -3.40 0.12 -4.32 4.70 5.66 -1.26 -5.13 114.28 110.65 2hwf n THR 167 Ca 0.01 -0.73 -0.16 0.00 -3.05 0.00 0.00 64.05 60.12 2hwf n THR 167 Cb 0.40 0.80 -0.10 0.00 -1.55 0.00 0.00 70.33 69.88 2hwf n THR 167 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2hwf s ASN 168 N -1.61 1.26 -0.16 1.09 -0.87 -1.05 -5.13 114.94 108.48 2hwf s ASN 168 Ca 0.15 -1.36 -0.04 0.00 -1.57 0.00 0.00 52.86 50.04 2hwf s ASN 168 Cb 0.22 0.14 -0.03 0.00 -0.02 0.00 0.00 41.25 41.56 2hwf s ASN 168 CO -0.08 -0.70 -0.02 -0.32 -2.57 0.00 0.00 177.10 173.41 2hwf s MET 169 N -4.01 3.71 -0.07 -0.60 -2.45 -1.26 -4.85 119.30 109.78 2hwf s MET 169 Ca 0.36 -0.48 -0.01 0.00 -1.25 0.00 0.00 55.69 54.30 2hwf s MET 169 Cb 0.08 -2.96 0.03 0.00 1.25 0.00 0.00 34.83 33.22 2hwf s MET 169 CO 0.13 0.26 -0.00 -1.12 1.05 0.00 0.00 175.02 175.33 2hwf s SER 170 N 0.33 1.55 -0.08 1.11 0.01 -1.26 -0.34 113.70 115.01 2hwf s SER 170 Ca -0.03 -0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.10 2hwf s SER 170 Cb -0.14 -0.45 -0.04 0.00 0.21 0.00 0.00 66.02 65.61 2hwf s SER 170 CO 0.02 -0.18 0.10 -0.51 0.41 0.00 0.00 173.24 173.08 2hwf s ILE 171 N 1.89 5.06 -0.09 1.44 2.07 0.69 -4.92 121.20 127.34 2hwf s ILE 171 Ca 0.04 -0.05 0.03 0.00 -1.41 0.00 0.00 60.65 59.26 2hwf s ILE 171 Cb -0.12 -3.22 -0.01 0.00 0.13 0.00 0.00 42.46 39.23 2hwf s ILE 171 CO -0.05 0.54 -0.20 -0.36 -1.91 0.00 0.00 174.94 172.96 2hwf s PHE 172 N -1.05 2.62 -0.03 3.50 0.40 -1.26 -1.22 117.98 120.93 2hwf s PHE 172 Ca 0.17 -0.72 0.01 0.00 -0.60 0.00 0.00 56.93 55.79 2hwf s PHE 172 Cb -0.12 -1.71 0.02 0.00 0.51 0.00 0.00 43.02 41.72 2hwf s PHE 172 CO 0.07 -0.22 -0.03 -0.46 0.70 0.00 0.00 175.22 175.28 2hwf s TRP 173 N 0.06 0.52 -0.11 0.36 -0.00 -0.88 -4.96 118.94 113.92 2hwf s TRP 173 Ca -0.08 -0.10 0.02 0.00 -0.00 0.00 0.00 56.10 55.94 2hwf s TRP 173 Cb -0.15 -0.50 -0.01 0.00 -0.00 0.00 0.00 33.47 32.82 2hwf s TRP 173 CO 0.05 -0.13 -0.20 1.14 -0.00 0.00 0.00 176.95 177.81 2hwf s GLN 174 N 0.78 3.17 -0.47 5.86 -2.07 -1.26 -1.24 119.66 124.43 2hwf s GLN 174 Ca -0.09 -0.81 -0.43 0.00 -1.82 0.00 0.00 55.36 52.21 2hwf s GLN 174 Cb -0.12 -2.43 -0.19 0.00 -1.09 0.00 0.00 33.01 29.18 2hwf s GLN 174 CO -0.01 0.18 1.69 1.58 -1.32 0.00 0.00 175.29 177.42 2hwf n HIS 175 N 3.55 1.46 0.00 9.60 -0.00 -1.24 -1.78 115.22 126.80 2hwf n HIS 175 Ca -0.19 0.96 0.00 0.00 -0.00 0.00 0.00 57.72 58.49 2hwf n HIS 175 Cb 0.53 -2.13 0.00 0.00 -0.00 0.00 0.00 29.99 28.39 2hwf n HIS 175 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2hwf n GLY 176 N 4.95 2.32 3.49 1.57 0.00 -1.26 -4.94 105.19 111.32 2hwf n GLY 176 Ca 0.37 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 2hwf n GLY 176 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hwf n GLN 177 N 0.00 0.73 -0.34 1.61 1.13 -0.73 -4.92 117.38 114.85 2hwf n GLN 177 Ca 0.00 0.26 -0.28 0.00 -1.94 0.00 0.00 57.00 55.04 2hwf n GLN 177 Cb 0.00 -1.57 0.26 0.00 0.11 0.00 0.00 30.24 29.05 2hwf n GLN 177 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 2hwf n PRO 178 N 0.62 -3.90 -2.06 -1.09 -0.02 -1.26 -4.81 135.00 122.48 2hwf n PRO 178 Ca 0.12 -1.15 -0.42 0.00 -2.02 0.00 0.00 63.50 60.03 2hwf n PRO 178 Cb 0.37 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 2hwf n PRO 178 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2hwf s PHE 179 N -2.17 2.10 0.57 6.00 0.40 -1.26 -4.93 117.98 118.68 2hwf s PHE 179 Ca 0.63 0.30 -0.21 0.00 -0.60 0.00 0.00 56.93 57.05 2hwf s PHE 179 Cb -0.14 -3.86 -0.04 0.00 0.51 0.00 0.00 43.02 39.48 2hwf s PHE 179 CO 0.56 -3.58 1.32 -1.25 0.70 0.00 0.00 175.22 172.97 2hwf s PRO 180 N 3.93 3.04 -0.30 0.24 0.05 -1.26 -4.82 135.00 135.89 2hwf s PRO 180 Ca 0.71 2.13 -0.01 0.00 0.05 0.00 0.00 61.00 63.88 2hwf s PRO 180 Cb -0.32 -2.14 0.19 0.00 0.05 0.00 0.00 34.50 32.28 2hwf s PRO 180 CO 0.28 -1.24 0.63 0.50 0.05 0.00 0.00 177.00 177.22 2hwf s ARG 181 N -3.04 0.54 0.21 4.56 3.52 -1.26 -0.54 118.95 122.95 2hwf s ARG 181 Ca 0.74 0.90 0.00 0.00 -0.13 0.00 0.00 55.73 57.24 2hwf s ARG 181 Cb -0.38 0.49 0.00 0.00 -1.56 0.00 0.00 34.95 33.50 2hwf s ARG 181 CO 0.44 -0.66 0.02 1.97 -0.81 0.00 0.00 175.30 176.26 2hwf n PHE 182 N 5.43 0.30 -3.54 5.12 1.16 -1.10 -4.89 117.46 119.94 2hwf n PHE 182 Ca -0.00 -1.03 0.00 0.00 -1.87 0.00 0.00 57.45 54.54 2hwf n PHE 182 Cb 0.52 -0.15 0.00 0.00 -1.61 0.00 0.00 39.48 38.24 2hwf n PHE 182 CO 0.00 0.00 0.00 0.43 -1.87 0.00 0.00 176.76 175.32 2hwf n SER 183 N -1.22 0.43 0.00 5.98 7.64 -1.26 -0.91 113.62 124.28 2hwf n SER 183 Ca -0.08 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.26 2hwf n SER 183 Cb 0.27 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 2hwf n SER 183 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2hwf n ILE 184 N 0.00 0.00 -0.58 0.44 5.41 0.22 -4.89 119.36 119.96 2hwf n ILE 184 Ca 0.00 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.61 2hwf n ILE 184 Cb 0.00 0.00 0.13 0.00 -0.71 0.00 0.00 39.64 39.06 2hwf n ILE 184 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2hwf n PRO 185 N -0.05 -2.42 -2.32 0.38 -0.05 -1.26 0.19 135.00 129.47 2hwf n PRO 185 Ca 0.00 -0.80 -0.43 0.00 -0.05 0.00 0.00 63.50 62.23 2hwf n PRO 185 Cb 0.00 -0.82 -0.02 0.00 -0.05 0.00 0.00 33.50 32.61 2hwf n PRO 185 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 175.50 175.57 2hwf s PHE 186 N -1.83 2.59 0.00 0.54 2.19 -1.25 -4.01 117.98 116.21 2hwf s PHE 186 Ca 0.33 0.80 0.00 0.00 0.33 0.00 0.00 56.93 58.39 2hwf s PHE 186 Cb -0.04 -3.70 0.00 0.00 -1.31 0.00 0.00 43.02 37.97 2hwf s PHE 186 CO 0.26 -2.19 0.00 1.28 1.83 0.00 0.00 175.22 176.41 2hwf n LEU 187 N 7.12 0.00 0.00 6.12 4.77 -1.26 -4.97 117.00 128.78 2hwf n LEU 187 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2hwf n LEU 187 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2hwf n LEU 187 CO 0.59 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.45 2hwf n SER 188 N 0.00 0.00 0.00 -1.43 7.64 -1.26 -4.83 113.62 113.74 2hwf n SER 188 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2hwf n SER 188 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2hwf n SER 188 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hwf n ILE 189 N 0.00 0.00 -2.69 0.44 3.06 -1.26 -5.05 119.36 113.86 2hwf n ILE 189 Ca 0.00 0.00 -0.36 0.00 -2.50 0.00 0.00 62.75 59.89 2hwf n ILE 189 Cb 0.00 0.00 -0.05 0.00 0.54 0.00 0.00 39.64 40.13 2hwf n ILE 189 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2hwf s ALA 190 N -1.00 3.10 0.00 1.51 0.00 -1.26 -4.80 121.76 119.32 2hwf s ALA 190 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.53 2hwf s ALA 190 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.91 2hwf s ALA 190 CO 0.00 -0.01 0.00 -1.13 0.00 0.00 0.00 175.76 174.62 2hwf n SER 191 N -0.04 0.00 -3.67 0.00 3.41 -1.26 -4.55 113.62 107.51 2hwf n SER 191 Ca 0.05 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.56 2hwf n SER 191 Cb 0.51 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 2hwf n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hwf s ALA 192 N 0.00 -1.15 -0.11 7.33 0.00 -1.26 -4.90 121.76 121.66 2hwf s ALA 192 Ca 0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 2hwf s ALA 192 Cb 0.00 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 2hwf s ALA 192 CO 0.00 -0.82 1.13 0.71 0.00 0.00 0.00 175.76 176.78 2hwf s TYR 193 N -3.84 3.25 -0.44 0.00 2.02 -0.09 -4.93 117.35 113.31 2hwf s TYR 193 Ca 0.07 1.33 -0.28 0.00 -0.37 0.00 0.00 57.07 57.82 2hwf s TYR 193 Cb -0.02 -3.35 -0.02 0.00 -0.40 0.00 0.00 41.96 38.18 2hwf s TYR 193 CO -0.05 -0.94 1.80 0.71 -1.57 0.00 0.00 175.55 175.50 2hwf s TYR 194 N 2.50 1.80 -1.67 2.71 2.02 -1.26 -3.67 117.35 119.78 2hwf s TYR 194 Ca 0.52 0.71 0.26 0.00 -0.37 0.00 0.00 57.07 58.19 2hwf s TYR 194 Cb -0.21 -4.12 1.44 0.00 -0.40 0.00 0.00 41.96 38.67 2hwf s TYR 194 CO 0.17 -2.61 1.92 -1.33 -1.57 0.00 0.00 175.55 172.13 2hwf n MET 195 N 8.68 0.57 -3.57 -0.62 2.81 -0.39 -4.82 117.12 119.78 2hwf n MET 195 Ca 0.22 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.13 2hwf n MET 195 Cb 0.49 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.51 2hwf n MET 195 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2hwf n PHE 196 N -1.17 -0.69 -3.62 2.03 3.72 -1.23 -4.89 117.46 111.62 2hwf n PHE 196 Ca 0.16 -0.78 -0.07 0.00 -0.05 0.00 0.00 57.45 56.70 2hwf n PHE 196 Cb 0.16 0.37 -0.06 0.00 -0.94 0.00 0.00 39.48 39.01 2hwf n PHE 196 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2hwf s TYR 197 N -2.42 -0.28 -0.32 1.38 6.14 -1.26 -4.77 117.35 115.82 2hwf s TYR 197 Ca 0.23 0.59 0.11 0.00 0.64 0.00 0.00 57.07 58.64 2hwf s TYR 197 Cb -0.01 0.44 0.46 0.00 0.42 0.00 0.00 41.96 43.27 2hwf s TYR 197 CO 0.02 -0.20 1.13 -3.47 0.64 0.00 0.00 175.55 173.66 2hwf n ASP 198 N 1.24 3.80 -4.35 4.32 2.03 -1.26 -4.52 116.55 117.81 2hwf n ASP 198 Ca -0.09 -3.27 -0.22 0.00 0.52 0.00 0.00 54.79 51.74 2hwf n ASP 198 Cb 0.57 -0.42 -0.10 0.00 -0.72 0.00 0.00 41.12 40.46 2hwf n ASP 198 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2hwf s GLY 199 N -3.58 2.15 0.27 0.27 0.00 -1.26 -5.06 107.32 100.11 2hwf s GLY 199 Ca 0.43 -1.82 0.02 0.00 0.00 0.00 0.00 44.72 43.35 2hwf s GLY 199 CO -0.03 -1.78 0.08 -0.19 0.00 0.00 0.00 173.10 171.18 2hwf s TYR 200 N -3.36 1.65 0.18 1.90 1.51 -1.26 -3.02 117.35 114.95 2hwf s TYR 200 Ca 0.34 -1.11 -0.10 0.00 -1.01 0.00 0.00 57.07 55.19 2hwf s TYR 200 Cb 0.07 -1.00 0.07 0.00 -0.11 0.00 0.00 41.96 41.00 2hwf s TYR 200 CO 0.15 -0.23 1.67 -0.44 -1.11 0.00 0.00 175.55 175.59 2hwf h ASP 201 N 2.32 1.00 -0.12 2.29 5.19 -0.63 -3.48 116.42 122.99 2hwf h ASP 201 Ca -0.39 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 55.75 2hwf h ASP 201 Cb 1.24 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.49 2hwf h ASP 201 CO 0.63 1.01 0.00 0.61 -3.12 0.00 0.00 179.24 178.38 2hwf n GLY 202 N -0.54 0.67 0.04 2.75 0.00 -1.26 -4.98 105.19 101.86 2hwf n GLY 202 Ca 0.03 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.36 2hwf n GLY 202 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2hwf n ASP 203 N -0.12 0.22 -4.66 1.61 9.92 -1.26 -4.65 116.55 117.61 2hwf n ASP 203 Ca 0.00 0.54 -0.42 0.00 -0.53 0.00 0.00 54.79 54.37 2hwf n ASP 203 Cb 0.00 -0.59 -0.03 0.00 -0.64 0.00 0.00 41.12 39.86 2hwf n ASP 203 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2hwf s ASN 204 N -3.42 6.61 0.00 -2.24 3.04 -1.26 -4.78 114.94 112.89 2hwf s ASN 204 Ca 0.09 2.37 0.00 0.00 0.04 0.00 0.00 52.86 55.36 2hwf s ASN 204 Cb 0.13 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.31 2hwf s ASN 204 CO 0.42 -0.96 0.44 1.07 -3.04 0.00 0.00 177.10 175.04 2hwf n THR 205 N 5.46 0.33 -1.90 -5.21 5.66 -1.26 0.15 114.28 117.51 2hwf n THR 205 Ca 0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.18 2hwf n THR 205 Cb 0.42 -0.58 0.00 0.00 -1.55 0.00 0.00 70.33 68.62 2hwf n THR 205 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2hwf n SER 206 N 0.53 0.00 -4.90 1.09 7.64 -1.26 -5.10 113.62 111.62 2hwf n SER 206 Ca 0.00 -1.45 -0.28 0.00 1.01 0.00 0.00 58.87 58.14 2hwf n SER 206 Cb 0.22 -0.09 0.02 0.00 -1.01 0.00 0.00 64.21 63.35 2hwf n SER 206 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2hwf s SER 207 N -0.45 5.92 0.42 6.43 0.01 0.39 -5.06 113.70 121.35 2hwf s SER 207 Ca 0.00 1.01 -0.22 0.00 1.31 0.00 0.00 55.95 58.05 2hwf s SER 207 Cb 0.00 -2.08 -0.11 0.00 0.21 0.00 0.00 66.02 64.04 2hwf s SER 207 CO 0.00 -0.92 0.95 -0.54 0.41 0.00 0.00 173.24 173.15 2hwf s LYS 208 N -5.02 4.27 -0.25 12.44 1.02 -1.26 -4.81 119.74 126.13 2hwf s LYS 208 Ca 0.53 1.16 -0.02 0.00 0.02 0.00 0.00 55.97 57.66 2hwf s LYS 208 Cb -0.11 -2.27 0.14 0.00 -0.52 0.00 0.00 37.83 35.07 2hwf s LYS 208 CO 0.48 0.00 0.39 -0.47 -0.92 0.00 0.00 175.35 174.83 2hwf s TYR 209 N -2.09 -0.88 0.00 3.18 5.04 -1.26 0.13 117.35 121.47 2hwf s TYR 209 Ca 0.60 0.78 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 2hwf s TYR 209 Cb -0.11 0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.21 2hwf s TYR 209 CO 0.15 -0.77 0.00 0.41 -1.34 0.00 0.00 175.55 174.00 2hwf n GLY 210 N 5.37 1.02 2.67 8.97 0.00 -1.17 -4.97 105.19 117.07 2hwf n GLY 210 Ca -0.03 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 2hwf n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hwf n SER 211 N 0.00 5.11 0.00 1.61 3.41 -1.26 -1.97 113.62 120.52 2hwf n SER 211 Ca 0.00 -2.52 0.00 0.00 -0.26 0.00 0.00 58.87 56.09 2hwf n SER 211 Cb 0.00 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 62.67 2hwf n SER 211 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2hwf n VAL 212 N 4.57 0.00 -0.07 -3.33 0.24 -1.26 -4.81 118.33 113.66 2hwf n VAL 212 Ca 0.54 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.70 2hwf n VAL 212 Cb 0.25 0.64 -0.14 0.00 -1.47 0.00 0.00 33.84 33.11 2hwf n VAL 212 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2hwf n VAL 213 N 0.00 1.54 0.64 3.34 0.31 -0.83 -4.34 118.33 118.99 2hwf n VAL 213 Ca 0.00 -0.72 0.12 0.00 -0.01 0.00 0.00 64.34 63.73 2hwf n VAL 213 Cb 0.27 -1.12 0.15 0.00 -0.91 0.00 0.00 33.84 32.24 2hwf n VAL 213 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2hwf n THR 214 N -3.11 0.25 -3.57 2.52 -2.24 -1.26 -4.81 114.28 102.06 2hwf n THR 214 Ca -0.34 -0.63 -0.28 0.00 -2.27 0.00 0.00 64.05 60.54 2hwf n THR 214 Cb 1.06 1.24 -0.16 0.00 -2.10 0.00 0.00 70.33 70.38 2hwf n THR 214 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2hwf s ASN 215 N -1.72 3.13 -0.41 3.42 0.02 -1.26 -4.79 114.94 113.32 2hwf s ASN 215 Ca 0.33 -1.06 0.09 0.00 -1.02 0.00 0.00 52.86 51.20 2hwf s ASN 215 Cb 0.21 -0.33 0.31 0.00 0.02 0.00 0.00 41.25 41.46 2hwf s ASN 215 CO 0.30 -0.41 0.83 -0.67 0.02 0.00 0.00 177.10 177.18 2hwf n ASP 216 N 5.25 -0.64 -1.87 -1.22 2.03 -1.26 -4.70 116.55 114.14 2hwf n ASP 216 Ca -0.06 -3.20 -0.07 0.00 0.52 0.00 0.00 54.79 51.98 2hwf n ASP 216 Cb 0.45 0.41 -0.09 0.00 -0.72 0.00 0.00 41.12 41.16 2hwf n ASP 216 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2hwf n MET 217 N 0.65 1.43 -0.19 -0.67 2.81 -1.26 -4.56 117.12 115.33 2hwf n MET 217 Ca 0.17 -0.55 0.03 0.00 -1.81 0.00 0.00 57.70 55.54 2hwf n MET 217 Cb 0.65 -1.61 -0.01 0.00 -0.71 0.00 0.00 33.22 31.54 2hwf n MET 217 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hwf n GLY 218 N 2.18 -0.88 3.51 3.03 0.00 -1.26 -4.64 105.19 107.12 2hwf n GLY 218 Ca 0.24 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 2hwf n GLY 218 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hwf s THR 219 N -0.31 2.10 -0.14 2.61 -4.23 0.22 -3.78 115.64 112.10 2hwf s THR 219 Ca 0.00 -2.20 0.02 0.00 -1.18 0.00 0.00 61.69 58.33 2hwf s THR 219 Cb 0.00 -2.56 0.01 0.00 1.34 0.00 0.00 72.50 71.29 2hwf s THR 219 CO 0.00 -0.25 -0.21 0.27 -0.54 0.00 0.00 174.62 173.89 2hwf s ILE 220 N -2.71 1.98 -0.14 2.99 -4.36 -1.14 0.13 121.20 117.95 2hwf s ILE 220 Ca 0.31 -0.93 -0.03 0.00 -0.26 0.00 0.00 60.65 59.74 2hwf s ILE 220 Cb 0.02 -1.76 -0.03 0.00 1.25 0.00 0.00 42.46 41.94 2hwf s ILE 220 CO 0.15 0.53 -0.02 0.00 0.24 0.00 0.00 174.94 175.84 2hwf n SER 222 N 3.14 0.00 0.00 0.00 2.88 0.33 -0.96 113.62 119.02 2hwf n SER 222 Ca -0.18 -0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.09 2hwf n SER 222 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 2hwf n SER 222 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2hwf n ARG 223 N -0.27 0.00 -3.33 -1.46 0.63 -0.99 -4.24 116.66 107.00 2hwf n ARG 223 Ca 0.00 0.00 -0.45 0.00 -0.92 0.00 0.00 57.85 56.48 2hwf n ARG 223 Cb 0.00 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 32.84 2hwf n ARG 223 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2hwf s ILE 224 N 0.00 5.17 0.00 5.15 2.07 -1.26 -0.49 121.20 131.85 2hwf s ILE 224 Ca 0.00 -1.11 0.00 0.00 -1.41 0.00 0.00 60.65 58.13 2hwf s ILE 224 Cb 0.00 -4.22 0.00 0.00 0.13 0.00 0.00 42.46 38.37 2hwf s ILE 224 CO 0.00 -0.71 0.00 0.52 -1.91 0.00 0.00 174.94 172.84 2hwf n VAL 225 N 5.28 0.00 0.00 4.00 0.31 -1.15 -4.22 118.33 122.55 2hwf n VAL 225 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2hwf n VAL 225 Cb 0.43 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 2hwf n VAL 225 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2hwf n THR 226 N 0.00 0.00 -3.65 2.52 -2.24 -1.26 -4.73 114.28 104.92 2hwf n THR 226 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2hwf n THR 226 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2hwf n THR 226 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2hwf n GLU 227 N 0.00 0.00 -2.44 -0.78 4.07 -1.26 -4.87 120.64 115.36 2hwf n GLU 227 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 2hwf n GLU 227 Cb 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.34 2hwf n GLU 227 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2hwf s LYS 228 N 0.00 4.45 0.27 5.31 2.20 -1.26 -5.06 119.74 125.64 2hwf s LYS 228 Ca 0.00 1.78 0.02 0.00 -0.36 0.00 0.00 55.97 57.40 2hwf s LYS 228 Cb 0.00 -2.98 -0.05 0.00 -1.51 0.00 0.00 37.83 33.28 2hwf s LYS 228 CO 0.00 0.04 0.09 -0.65 -0.36 0.00 0.00 175.35 174.48 2hwf s GLN 229 N -1.79 1.44 0.00 4.03 -0.21 -1.26 -5.13 119.66 116.74 2hwf s GLN 229 Ca 0.49 -1.79 0.00 0.00 0.02 0.00 0.00 55.36 54.09 2hwf s GLN 229 Cb -0.30 -0.32 0.00 0.00 1.00 0.00 0.00 33.01 33.39 2hwf s GLN 229 CO 0.39 -0.29 0.00 1.17 -2.12 0.00 0.00 175.29 174.44 2hwf n LYS 230 N -0.49 0.00 -2.05 2.91 4.81 -1.26 -4.88 118.16 117.19 2hwf n LYS 230 Ca -0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 2hwf n LYS 230 Cb 0.66 -0.32 -0.03 0.00 0.02 0.00 0.00 35.03 35.36 2hwf n LYS 230 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2hwf s LEU 231 N -1.24 4.35 1.19 3.14 2.01 -1.26 -4.98 118.68 121.90 2hwf s LEU 231 Ca 0.00 2.38 -0.16 0.00 0.01 0.00 0.00 54.13 56.36 2hwf s LEU 231 Cb 0.00 -3.57 0.28 0.00 0.01 0.00 0.00 46.19 42.91 2hwf s LEU 231 CO 0.00 -0.79 1.03 -0.55 1.01 0.00 0.00 176.35 177.05 2hwf s SER 232 N 1.85 0.88 0.29 2.29 0.15 -1.26 -4.79 113.70 113.11 2hwf s SER 232 Ca 0.69 1.14 -0.20 0.00 0.70 0.00 0.00 55.95 58.28 2hwf s SER 232 Cb -0.38 -1.74 0.02 0.00 -1.71 0.00 0.00 66.02 62.22 2hwf s SER 232 CO 0.30 -4.21 0.72 0.68 1.20 0.00 0.00 173.24 171.93 2hwf s VAL 233 N -2.63 0.00 -0.16 4.45 -7.23 -1.26 -3.00 120.40 110.56 2hwf s VAL 233 Ca 0.68 -1.02 -0.10 0.00 -1.81 0.00 0.00 61.98 59.73 2hwf s VAL 233 Cb -0.19 -2.15 0.05 0.00 0.56 0.00 0.00 36.38 34.66 2hwf s VAL 233 CO 0.60 0.00 0.40 0.54 -0.31 0.00 0.00 175.10 176.33 2hwf s VAL 234 N -3.68 -0.02 0.14 1.32 0.11 -0.94 -2.70 120.40 114.63 2hwf s VAL 234 Ca 0.12 0.07 0.11 0.00 -2.93 0.00 0.00 61.98 59.36 2hwf s VAL 234 Cb -0.06 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 2hwf s VAL 234 CO 0.08 0.03 -0.26 -0.63 -3.33 0.00 0.00 175.10 170.99 2hwf s ILE 235 N 1.10 2.25 -0.35 7.04 1.09 -0.41 -1.56 121.20 130.36 2hwf s ILE 235 Ca -0.07 -1.82 0.01 0.00 -1.10 0.00 0.00 60.65 57.68 2hwf s ILE 235 Cb -0.07 -2.00 0.15 0.00 -1.06 0.00 0.00 42.46 39.47 2hwf s ILE 235 CO -0.09 0.03 0.30 0.28 -0.10 0.00 0.00 174.94 175.36 2hwf s THR 236 N -1.22 -0.17 -0.70 2.92 -1.32 -1.04 -0.88 115.64 113.22 2hwf s THR 236 Ca 0.15 -1.18 -0.20 0.00 -1.21 0.00 0.00 61.69 59.26 2hwf s THR 236 Cb -0.09 -0.86 0.10 0.00 -1.51 0.00 0.00 72.50 70.14 2hwf s THR 236 CO 0.07 -0.72 0.89 0.28 -2.21 0.00 0.00 174.62 172.93 2hwf s THR 237 N 1.42 4.65 1.01 5.08 -1.32 -0.28 -2.19 115.64 124.02 2hwf s THR 237 Ca 0.16 -0.95 -0.12 0.00 -1.21 0.00 0.00 61.69 59.57 2hwf s THR 237 Cb -0.18 -4.62 0.20 0.00 -1.51 0.00 0.00 72.50 66.39 2hwf s THR 237 CO -0.06 -1.33 1.08 -1.00 -2.21 0.00 0.00 174.62 171.10 2hwf s HIS 238 N 3.08 1.76 -0.05 9.09 3.76 -1.07 -2.77 115.29 129.09 2hwf s HIS 238 Ca 0.20 1.34 -0.02 0.00 -0.15 0.00 0.00 55.06 56.43 2hwf s HIS 238 Cb -0.17 -3.18 0.03 0.00 1.11 0.00 0.00 32.58 30.37 2hwf s HIS 238 CO 0.04 -3.11 0.11 0.42 -0.85 0.00 0.00 174.74 171.35 2hwf s ILE 239 N -2.68 -0.05 0.10 0.60 1.01 0.10 -2.93 121.20 117.35 2hwf s ILE 239 Ca 0.66 0.17 0.08 0.00 0.00 0.00 0.00 60.65 61.56 2hwf s ILE 239 Cb -0.22 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.03 2hwf s ILE 239 CO 0.60 0.07 -0.21 -0.31 0.00 0.00 0.00 174.94 175.10 2hwf s TYR 240 N 1.02 1.78 -0.04 3.97 2.02 -1.08 -1.25 117.35 123.76 2hwf s TYR 240 Ca -0.08 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.17 2hwf s TYR 240 Cb -0.11 -0.97 0.02 0.00 -0.40 0.00 0.00 41.96 40.50 2hwf s TYR 240 CO -0.04 0.21 0.09 -1.58 -1.57 0.00 0.00 175.55 172.65 2hwf s HIS 241 N -1.19 -0.10 -0.00 2.71 5.65 -0.94 -3.25 115.29 118.16 2hwf s HIS 241 Ca 0.06 0.26 0.04 0.00 0.25 0.00 0.00 55.06 55.68 2hwf s HIS 241 Cb -0.10 -0.01 -0.01 0.00 -1.18 0.00 0.00 32.58 31.28 2hwf s HIS 241 CO 0.04 -0.07 -0.12 0.21 -0.65 0.00 0.00 174.74 174.15 2hwf s LYS 242 N 0.32 0.96 -0.37 2.88 2.20 -0.34 -1.27 119.74 124.12 2hwf s LYS 242 Ca -0.02 -0.47 -0.12 0.00 -0.36 0.00 0.00 55.97 55.00 2hwf s LYS 242 Cb -0.03 -0.93 0.02 0.00 -1.51 0.00 0.00 37.83 35.37 2hwf s LYS 242 CO -0.01 0.25 0.22 0.00 -0.36 0.00 0.00 175.35 175.45 2hwf s ALA 243 N -0.36 3.33 -0.10 3.13 0.00 -1.26 -0.33 121.76 126.17 2hwf s ALA 243 Ca 0.04 -1.65 0.03 0.00 0.00 0.00 0.00 51.96 50.37 2hwf s ALA 243 Cb -0.05 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 2hwf s ALA 243 CO -0.00 -1.31 -0.19 -1.59 0.00 0.00 0.00 175.76 172.67 2hwf s LYS 244 N 1.60 3.06 -0.27 0.00 -2.85 -0.34 -3.17 119.74 117.76 2hwf s LYS 244 Ca 0.03 -0.78 -0.01 0.00 -1.00 0.00 0.00 55.97 54.21 2hwf s LYS 244 Cb -0.19 -2.42 0.00 0.00 -2.06 0.00 0.00 37.83 33.16 2hwf s LYS 244 CO 0.07 0.27 0.23 0.72 0.10 0.00 0.00 175.35 176.75 2hwf n HIS 245 N 3.31 -0.52 -3.09 1.78 8.25 -1.26 -2.38 115.22 121.30 2hwf n HIS 245 Ca -0.18 0.21 -0.33 0.00 -0.26 0.00 0.00 57.72 57.15 2hwf n HIS 245 Cb 0.53 -2.36 -0.06 0.00 1.12 0.00 0.00 29.99 29.21 2hwf n HIS 245 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2hwf s THR 246 N -3.07 4.62 -0.20 1.59 -1.32 -1.26 -4.37 115.64 111.62 2hwf s THR 246 Ca 0.05 1.08 -0.02 0.00 -1.21 0.00 0.00 61.69 61.58 2hwf s THR 246 Cb -0.02 -3.66 -0.00 0.00 -1.51 0.00 0.00 72.50 67.31 2hwf s THR 246 CO 0.16 -0.13 -0.09 -0.54 -2.21 0.00 0.00 174.62 171.81 2hwf s LYS 247 N -2.83 3.29 -0.02 7.08 3.01 -0.82 -4.86 119.74 124.59 2hwf s LYS 247 Ca 0.53 -0.68 -0.04 0.00 -1.01 0.00 0.00 55.97 54.78 2hwf s LYS 247 Cb -0.11 -2.88 0.00 0.00 -1.01 0.00 0.00 37.83 33.83 2hwf s LYS 247 CO 0.18 -0.17 0.09 0.00 0.51 0.00 0.00 175.35 175.96 2hwf s ALA 248 N 1.35 -0.22 0.00 5.17 0.00 -1.26 -3.97 121.76 122.83 2hwf s ALA 248 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.10 2hwf s ALA 248 Cb -0.14 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2hwf s ALA 248 CO -0.05 -0.09 0.00 0.91 0.00 0.00 0.00 175.76 176.53 2hwf n TRP 249 N 2.55 0.00 -4.61 0.00 8.01 -1.26 -4.97 117.44 117.16 2hwf n TRP 249 Ca -0.16 0.00 -0.33 0.00 -1.31 0.00 0.00 57.50 55.70 2hwf n TRP 249 Cb 0.58 0.00 -0.13 0.00 -2.01 0.00 0.00 31.31 29.75 2hwf n TRP 249 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2hwf s PRO 251 N 0.24 -0.67 0.14 0.00 0.04 -1.26 -1.26 135.00 132.23 2hwf s PRO 251 Ca -0.06 0.91 -0.25 0.00 0.04 0.00 0.00 61.00 61.64 2hwf s PRO 251 Cb -0.15 -1.58 0.07 0.00 0.04 0.00 0.00 34.50 32.88 2hwf s PRO 251 CO 0.04 -3.58 0.84 0.50 0.04 0.00 0.00 177.00 174.85 2hwf s ARG 252 N -4.50 1.22 0.31 4.56 3.52 0.12 -4.72 118.95 119.46 2hwf s ARG 252 Ca 0.68 -0.60 -0.29 0.00 -0.13 0.00 0.00 55.73 55.39 2hwf s ARG 252 Cb -0.24 0.46 -0.12 0.00 -1.56 0.00 0.00 34.95 33.49 2hwf s ARG 252 CO 0.64 -0.55 1.53 -2.30 -0.81 0.00 0.00 175.30 173.81 2hwf n PRO 253 N -0.40 2.61 -0.65 5.12 -0.01 -1.26 -4.52 135.00 135.89 2hwf n PRO 253 Ca -0.08 0.92 -0.28 0.00 -0.01 0.00 0.00 63.50 64.05 2hwf n PRO 253 Cb 0.61 -2.67 0.25 0.00 -0.01 0.00 0.00 33.50 31.68 2hwf n PRO 253 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 175.50 173.35 2hwf s PRO 254 N -1.01 -0.95 -0.43 0.52 0.01 -1.26 -4.78 135.00 127.10 2hwf s PRO 254 Ca 0.61 0.68 -0.09 0.00 0.01 0.00 0.00 61.00 62.21 2hwf s PRO 254 Cb -0.51 -1.56 0.08 0.00 0.01 0.00 0.00 34.50 32.53 2hwf s PRO 254 CO 0.54 -3.70 0.27 0.50 0.01 0.00 0.00 177.00 174.62 2hwf s ARG 255 N -4.59 2.59 0.21 5.54 3.52 -1.26 -4.95 118.95 120.01 2hwf s ARG 255 Ca 0.68 -1.51 0.21 0.00 -0.13 0.00 0.00 55.73 54.99 2hwf s ARG 255 Cb -0.23 -3.81 0.02 0.00 -1.56 0.00 0.00 34.95 29.37 2hwf s ARG 255 CO 0.63 -0.99 1.10 0.00 -0.81 0.00 0.00 175.30 175.22 2hwf h ALA 256 N 8.42 0.60 -2.66 6.12 0.00 -1.98 -3.45 119.26 126.30 2hwf h ALA 256 Ca -0.23 -0.17 -0.66 0.00 0.00 0.00 0.00 54.91 53.85 2hwf h ALA 256 Cb 1.08 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 2hwf h ALA 256 CO 0.78 0.19 -0.46 0.08 0.00 0.00 0.00 179.25 179.83 2hwf s VAL 257 N -3.25 5.47 0.22 0.00 1.01 -1.26 -4.35 120.40 118.24 2hwf s VAL 257 Ca 0.00 0.20 -0.32 0.00 0.00 0.00 0.00 61.98 61.87 2hwf s VAL 257 Cb 0.09 -3.44 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 2hwf s VAL 257 CO 0.78 0.58 1.71 -0.81 0.00 0.00 0.00 175.10 177.35 2hwf n PRO 258 N 1.83 2.79 -0.71 2.72 -0.04 -1.26 -4.91 135.00 135.43 2hwf n PRO 258 Ca -0.18 1.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.99 2hwf n PRO 258 Cb 0.55 -2.84 0.25 0.00 -0.04 0.00 0.00 33.50 31.41 2hwf n PRO 258 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2hwf s TYR 259 N 0.98 0.56 0.00 0.54 1.51 -1.26 -4.70 117.35 114.98 2hwf s TYR 259 Ca 0.73 0.76 0.00 0.00 -1.01 0.00 0.00 57.07 57.55 2hwf s TYR 259 Cb -0.50 -3.14 0.00 0.00 -0.11 0.00 0.00 41.96 38.21 2hwf s TYR 259 CO 0.35 -4.15 0.00 2.41 -1.11 0.00 0.00 175.55 173.05 2hwf n THR 260 N -5.04 0.00 -2.25 -0.71 -1.04 -1.23 -4.95 114.28 99.05 2hwf n THR 260 Ca 0.09 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.81 2hwf n THR 260 Cb 0.58 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.11 2hwf n THR 260 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2hwf s HIS 261 N 1.73 3.44 0.00 -1.42 3.76 -1.26 -5.09 115.29 116.45 2hwf s HIS 261 Ca 0.00 0.91 0.00 0.00 -0.15 0.00 0.00 55.06 55.82 2hwf s HIS 261 Cb 0.00 -2.67 0.00 0.00 1.11 0.00 0.00 32.58 31.02 2hwf s HIS 261 CO 0.00 -0.70 0.00 0.45 -0.85 0.00 0.00 174.74 173.64 2hwf n SER 262 N -2.61 -0.31 0.00 1.40 2.88 -1.26 -4.70 113.62 109.02 2hwf n SER 262 Ca 0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2hwf n SER 262 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2hwf n SER 262 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2hwf n HIS 263 N -1.20 0.00 0.00 0.66 -0.00 -1.26 -4.76 115.22 108.66 2hwf n HIS 263 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2hwf n HIS 263 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2hwf n HIS 263 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.34 177.67 2hwf n VAL 264 N 0.00 0.00 -0.03 1.59 0.24 -1.26 -4.88 118.33 113.99 2hwf n VAL 264 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.32 2hwf n VAL 264 Cb 0.00 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.27 2hwf n VAL 264 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2hwf n THR 265 N 1.27 0.32 -0.26 3.34 5.66 -1.26 -4.95 114.28 118.40 2hwf n THR 265 Ca 0.00 -0.38 -0.09 0.00 -3.05 0.00 0.00 64.05 60.53 2hwf n THR 265 Cb 0.00 -0.14 -0.01 0.00 -1.55 0.00 0.00 70.33 68.64 2hwf n THR 265 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2hwf n ASN 266 N -2.14 -0.23 -3.97 1.09 4.13 -1.26 -4.81 115.26 108.07 2hwf n ASN 266 Ca -0.09 0.21 -0.25 0.00 1.68 0.00 0.00 54.58 56.13 2hwf n ASN 266 Cb 0.55 -0.17 -0.17 0.00 -1.54 0.00 0.00 39.78 38.45 2hwf n ASN 266 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 2hwf s TYR 267 N -0.18 1.38 0.00 3.10 -0.85 -1.26 -3.55 117.35 115.99 2hwf s TYR 267 Ca 0.12 -0.56 0.00 0.00 -0.52 0.00 0.00 57.07 56.11 2hwf s TYR 267 Cb -0.17 -1.07 0.00 0.00 0.38 0.00 0.00 41.96 41.09 2hwf s TYR 267 CO 0.10 -0.34 0.00 -1.33 -1.52 0.00 0.00 175.55 172.46 2hwf n MET 268 N 4.19 0.00 -0.95 -3.49 2.81 -1.26 -5.07 117.12 113.35 2hwf n MET 268 Ca -0.20 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.41 2hwf n MET 268 Cb 0.51 0.00 0.20 0.00 -0.71 0.00 0.00 33.22 33.23 2hwf n MET 268 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2hwf s PRO 269 N 0.00 -0.10 -1.34 0.03 0.04 -1.26 -4.89 135.00 127.48 2hwf s PRO 269 Ca 0.00 0.61 -0.13 0.00 0.04 0.00 0.00 61.00 61.52 2hwf s PRO 269 Cb 0.00 -1.67 0.11 0.00 0.04 0.00 0.00 34.50 32.98 2hwf s PRO 269 CO 0.00 -3.11 1.92 0.39 0.04 0.00 0.00 177.00 176.23 2hwf n GLU 270 N -4.46 3.24 0.00 4.56 1.02 -1.26 -4.51 120.64 119.23 2hwf n GLU 270 Ca 0.04 -3.20 0.00 0.00 -0.02 0.00 0.00 57.16 53.98 2hwf n GLU 270 Cb 0.56 -3.17 0.00 0.00 -0.02 0.00 0.00 31.44 28.82 2hwf n GLU 270 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2hwf n THR 271 N 4.65 0.00 0.00 2.62 -1.04 -1.26 -4.93 114.28 114.32 2hwf n THR 271 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 2hwf n THR 271 Cb 0.40 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 2hwf n THR 271 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2hwf n GLY 272 N 0.00 0.00 0.00 3.41 0.00 -1.26 -3.31 105.19 104.02 2hwf n GLY 272 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hwf n GLY 272 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hwf n ASP 273 N 0.00 0.00 0.00 1.61 -0.08 -1.26 -3.35 116.55 113.47 2hwf n ASP 273 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2hwf n ASP 273 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2hwf n ASP 273 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 2hwf n VAL 274 N 0.00 0.00 -3.62 5.18 3.14 -1.21 -5.05 118.33 116.76 2hwf n VAL 274 Ca 0.00 0.00 -0.15 0.00 -2.96 0.00 0.00 64.34 61.23 2hwf n VAL 274 Cb 0.00 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 32.71 2hwf n VAL 274 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2hwf s THR 275 N -3.25 0.00 0.16 1.55 2.01 -1.21 -5.08 115.64 109.82 2hwf s THR 275 Ca 0.00 -0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.01 2hwf s THR 275 Cb 0.00 -0.95 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 2hwf s THR 275 CO 0.00 -0.01 -0.03 0.28 -0.69 0.00 0.00 174.62 174.18 2hwf s THR 276 N 0.03 0.81 0.31 -0.82 -1.32 -1.26 -4.37 115.64 109.02 2hwf s THR 276 Ca -0.02 -1.99 0.34 0.00 -1.21 0.00 0.00 61.69 58.80 2hwf s THR 276 Cb -0.04 -2.02 0.37 0.00 -1.51 0.00 0.00 72.50 69.30 2hwf s THR 276 CO 0.03 -0.57 2.08 0.00 -2.21 0.00 0.00 174.62 173.94 2hwf h ALA 277 N 2.73 1.06 -2.51 11.08 0.00 -2.01 -3.46 119.26 126.15 2hwf h ALA 277 Ca -0.37 -0.04 -0.57 0.00 0.00 0.00 0.00 54.91 53.94 2hwf h ALA 277 Cb 1.20 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 19.07 2hwf h ALA 277 CO 0.63 0.06 0.66 -0.89 0.00 0.00 0.00 179.25 179.72 2hwf n ILE 278 N -3.24 1.25 -3.80 0.00 5.41 -1.26 -4.99 119.36 112.73 2hwf n ILE 278 Ca -0.01 -0.31 -0.24 0.00 1.00 0.00 0.00 62.75 63.18 2hwf n ILE 278 Cb 0.25 -1.64 -0.02 0.00 -0.71 0.00 0.00 39.64 37.51 2hwf n ILE 278 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2hwf s VAL 279 N -0.32 5.24 -0.06 1.39 1.01 -1.26 -5.10 120.40 121.30 2hwf s VAL 279 Ca 0.64 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2hwf s VAL 279 Cb -0.58 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2hwf s VAL 279 CO 0.53 -0.26 0.12 -0.13 0.00 0.00 0.00 175.10 175.36 2hwf s ARG 280 N -3.65 3.30 0.12 2.72 3.00 -1.26 -5.11 118.95 118.07 2hwf s ARG 280 Ca 0.36 -0.30 0.07 0.00 0.00 0.00 0.00 55.73 55.86 2hwf s ARG 280 Cb -0.10 -3.04 -0.04 0.00 0.00 0.00 0.00 34.95 31.77 2hwf s ARG 280 CO 0.30 0.71 -0.05 0.50 0.00 0.00 0.00 175.30 176.75 2hwf s ARG 281 N -1.45 2.28 -0.03 3.54 6.06 -1.26 -5.02 118.95 123.07 2hwf s ARG 281 Ca 0.20 -1.02 -0.24 0.00 -2.50 0.00 0.00 55.73 52.17 2hwf s ARG 281 Cb -0.12 -2.36 -0.20 0.00 0.06 0.00 0.00 34.95 32.33 2hwf s ARG 281 CO 0.10 0.50 1.17 -0.91 -2.50 0.00 0.00 175.30 173.66 2hwf h ASN 282 N 3.30 0.16 -4.40 -2.12 -0.26 -1.99 -3.47 115.58 106.79 2hwf h ASN 282 Ca -0.48 -0.61 -0.17 0.00 -0.56 0.00 0.00 56.30 54.48 2hwf h ASN 282 Cb 1.18 -0.05 -0.23 0.00 -1.06 0.00 0.00 38.32 38.16 2hwf h ASN 282 CO 0.55 0.74 -0.53 -0.89 -1.06 0.00 0.00 177.43 176.25 2hwf s THR 283 N -3.76 0.04 0.31 2.81 2.01 -1.26 -5.02 115.64 110.77 2hwf s THR 283 Ca -0.16 -0.37 0.08 0.00 0.31 0.00 0.00 61.69 61.55 2hwf s THR 283 Cb 0.02 -0.32 0.05 0.00 0.01 0.00 0.00 72.50 72.26 2hwf s THR 283 CO 0.71 -0.20 1.73 0.16 -0.69 0.00 0.00 174.62 176.33 2hwf h ILE 284 N 4.60 1.30 -0.44 1.82 3.07 -2.04 -3.13 117.51 122.69 2hwf h ILE 284 Ca -0.28 -1.48 0.13 0.00 1.55 0.00 0.00 64.86 64.78 2hwf h ILE 284 Cb 1.20 1.69 -0.02 0.00 -0.27 0.00 0.00 36.82 39.42 2hwf h ILE 284 CO 0.41 0.44 0.33 0.74 -1.05 0.00 0.00 178.15 179.01 2hwf h THR 285 N 0.16 0.76 -3.68 0.16 2.02 -2.02 -3.40 112.91 106.89 2hwf h THR 285 Ca 0.01 0.00 -0.49 0.00 0.77 0.00 0.00 66.41 66.71 2hwf h THR 285 Cb 0.79 0.77 -0.32 0.00 -1.74 0.00 0.00 68.15 67.65 2hwf h THR 285 CO 0.06 0.00 -0.81 0.42 0.37 0.00 0.00 175.52 175.56 2hwf s THR 286 N -5.00 1.03 -3.00 3.16 -4.23 -1.19 -5.25 115.64 101.16 2hwf s THR 286 Ca -0.05 -0.46 0.24 0.00 -1.18 0.00 0.00 61.69 60.24 2hwf s THR 286 Cb 0.19 -0.92 0.19 0.00 1.34 0.00 0.00 72.50 73.30 2hwf s THR 286 CO 0.71 0.32 1.26 0.00 -0.54 0.00 0.00 174.62 176.37