#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1htw n GLU 2 N 0.00 0.00 -3.86 0.03 4.07 -1.26 -4.66 120.64 114.96 1htw n GLU 2 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 1htw n GLU 2 Cb 0.00 -1.03 -0.12 0.00 -0.06 0.00 0.00 31.44 30.23 1htw n GLU 2 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1htw s SER 3 N -0.90 -0.04 -0.09 4.31 0.15 -1.26 -0.50 113.70 115.37 1htw s SER 3 Ca 0.65 0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.34 1htw s SER 3 Cb -0.95 0.22 0.02 0.00 -1.71 0.00 0.00 66.02 63.60 1htw s SER 3 CO 0.55 -0.18 -0.13 -0.22 1.20 0.00 0.00 173.24 174.47 1htw s LEU 4 N -0.56 1.59 -0.34 3.45 0.20 -0.61 -4.98 118.68 117.43 1htw s LEU 4 Ca -0.06 -0.36 -0.07 0.00 0.69 0.00 0.00 54.13 54.33 1htw s LEU 4 Cb -0.04 -0.95 0.04 0.00 -0.43 0.00 0.00 46.19 44.81 1htw s LEU 4 CO 0.00 -0.00 0.11 0.42 -0.29 0.00 0.00 176.35 176.59 1htw s THR 5 N 1.01 3.83 -0.22 3.68 -4.23 -1.26 -0.87 115.64 117.58 1htw s THR 5 Ca -0.07 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.35 1htw s THR 5 Cb -0.15 -3.16 0.04 0.00 1.34 0.00 0.00 72.50 70.57 1htw s THR 5 CO -0.01 -0.18 -0.16 -1.58 -0.54 0.00 0.00 174.62 172.16 1htw s GLN 6 N 1.41 2.62 0.20 3.99 2.00 0.01 -5.01 119.66 124.87 1htw s GLN 6 Ca -0.01 -1.06 -0.28 0.00 -2.00 0.00 0.00 55.36 52.00 1htw s GLN 6 Cb -0.19 -2.71 -0.08 0.00 0.80 0.00 0.00 33.01 30.83 1htw s GLN 6 CO 0.03 -0.38 0.89 -0.47 -0.50 0.00 0.00 175.29 174.86 1htw s TYR 7 N 1.21 3.94 -0.31 1.67 5.04 -1.26 -1.31 117.35 126.32 1htw s TYR 7 Ca -0.02 1.81 0.04 0.00 -2.44 0.00 0.00 57.07 56.46 1htw s TYR 7 Cb -0.16 -2.92 0.09 0.00 0.35 0.00 0.00 41.96 39.31 1htw s TYR 7 CO -0.09 0.44 -0.01 0.42 -1.34 0.00 0.00 175.55 174.97 1htw s ILE 8 N -1.01 2.24 0.21 3.14 -1.09 0.12 -4.98 121.20 119.83 1htw s ILE 8 Ca 0.40 -2.09 0.27 0.00 -2.23 0.00 0.00 60.65 57.01 1htw s ILE 8 Cb -0.25 -2.54 0.29 0.00 -1.58 0.00 0.00 42.46 38.38 1htw s ILE 8 CO 0.30 -0.39 1.93 1.55 -1.23 0.00 0.00 174.94 177.10 1htw h PRO 9 N 7.67 0.00 -2.75 2.79 0.13 -1.89 0.85 132.00 138.81 1htw h PRO 9 Ca -0.10 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.12 1htw h PRO 9 Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1htw h PRO 9 CO 0.50 0.15 0.46 0.16 -0.23 0.00 0.00 178.00 179.04 1htw s ASP 10 N -6.05 0.02 0.19 1.44 1.47 -1.24 -4.23 116.67 108.27 1htw s ASP 10 Ca -0.00 -0.90 -0.01 0.00 1.18 0.00 0.00 52.55 52.81 1htw s ASP 10 Cb 0.11 0.65 0.11 0.00 -0.34 0.00 0.00 42.92 43.45 1htw s ASP 10 CO 0.60 -1.30 1.48 -0.08 0.68 0.00 0.00 175.17 176.54 1htw h GLU 11 N 2.00 0.44 -0.89 2.11 4.81 -1.91 -2.34 114.58 118.80 1htw h GLU 11 Ca -0.30 -0.32 0.02 0.00 -0.13 0.00 0.00 59.36 58.63 1htw h GLU 11 Cb 1.23 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.62 1htw h GLU 11 CO 0.39 0.94 0.59 0.74 -0.73 0.00 0.00 179.01 180.93 1htw h PHE 12 N 0.32 1.10 0.00 0.92 0.04 -1.97 -0.84 116.94 116.51 1htw h PHE 12 Ca -0.01 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 1htw h PHE 12 Cb 1.20 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.97 1htw h PHE 12 CO 0.04 0.68 -0.20 0.77 -0.60 0.00 0.00 178.31 178.99 1htw h SER 13 N 1.17 0.00 -0.29 2.17 0.02 -1.85 -1.19 113.55 113.59 1htw h SER 13 Ca 0.33 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 61.10 1htw h SER 13 Cb -0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.45 1htw h SER 13 CO -0.08 0.20 -0.53 -0.03 -1.14 0.00 0.00 176.83 175.25 1htw h MET 14 N 0.00 0.87 -0.33 3.45 1.85 -0.69 -0.45 114.93 119.63 1htw h MET 14 Ca -0.00 -0.55 -0.05 0.00 -0.61 0.00 0.00 59.70 58.48 1htw h MET 14 Cb 0.68 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.76 1htw h MET 14 CO 0.03 1.19 -0.01 -0.07 -0.40 0.00 0.00 176.91 177.64 1htw h LEU 15 N 0.65 0.57 -0.46 3.39 3.38 -1.02 0.25 115.31 122.08 1htw h LEU 15 Ca 0.02 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.74 1htw h LEU 15 Cb 1.14 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 1htw h LEU 15 CO 0.12 0.75 0.12 -0.09 0.09 0.00 0.00 178.44 179.43 1htw h ARG 16 N 0.38 0.27 -0.46 1.13 2.43 -1.11 -1.04 114.38 115.98 1htw h ARG 16 Ca 0.09 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 1htw h ARG 16 Cb 0.46 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 1htw h ARG 16 CO 0.02 0.18 0.06 0.35 -1.51 0.00 0.00 179.97 179.06 1htw h PHE 17 N 0.27 0.75 -0.44 2.20 3.57 -0.72 -1.74 116.94 120.82 1htw h PHE 17 Ca 0.22 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 1htw h PHE 17 Cb 0.26 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1htw h PHE 17 CO -0.19 0.67 0.19 0.78 -2.23 0.00 0.00 178.31 177.53 1htw h GLY 18 N 0.93 0.71 0.98 2.40 0.00 -0.28 -0.83 103.07 106.97 1htw h GLY 18 Ca 0.15 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1htw h GLY 18 CO 0.01 0.36 0.19 1.70 0.00 0.00 0.00 176.54 178.80 1htw h LYS 19 N 0.58 0.44 -0.59 4.80 3.64 -0.95 0.16 116.57 124.66 1htw h LYS 19 Ca 0.15 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1htw h LYS 19 Cb 0.18 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1htw h LYS 19 CO -0.01 0.34 0.35 -0.22 -2.27 0.00 0.00 179.45 177.64 1htw h LYS 20 N 0.42 0.66 -0.10 1.90 3.64 -1.06 0.57 116.57 122.60 1htw h LYS 20 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1htw h LYS 20 Cb 0.02 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1htw h LYS 20 CO -0.02 0.44 0.06 0.35 -2.27 0.00 0.00 179.45 178.01 1htw h PHE 21 N 0.68 0.12 -0.44 1.91 3.57 -0.85 -2.60 116.94 119.33 1htw h PHE 21 Ca 0.24 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.71 1htw h PHE 21 Cb 0.05 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1htw h PHE 21 CO -0.06 0.07 0.12 0.00 -2.23 0.00 0.00 178.31 176.21 1htw h ALA 22 N 1.04 1.38 -0.83 2.41 0.00 -0.37 -2.19 119.26 120.70 1htw h ALA 22 Ca 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1htw h ALA 22 Cb -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1htw h ALA 22 CO -0.01 0.45 0.43 0.93 0.00 0.00 0.00 179.25 181.05 1htw h GLU 23 N 0.64 1.17 0.04 0.00 5.08 -0.69 0.11 114.58 120.94 1htw h GLU 23 Ca 0.15 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1htw h GLU 23 Cb 0.22 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1htw h GLU 23 CO -0.01 0.88 -0.02 0.82 -1.00 0.00 0.00 179.01 179.69 1htw h ILE 24 N 1.17 1.04 -0.74 3.13 2.04 -1.05 -2.98 117.51 120.11 1htw h ILE 24 Ca 0.29 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.96 1htw h ILE 24 Cb 0.06 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 1htw h ILE 24 CO -0.04 0.06 0.49 -0.07 0.00 0.00 0.00 178.15 178.59 1htw h LEU 25 N -0.15 0.74 -1.31 1.44 3.38 -0.96 -2.74 115.31 115.70 1htw h LEU 25 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1htw h LEU 25 Cb 0.14 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1htw h LEU 25 CO 0.01 0.49 -0.10 0.25 0.09 0.00 0.00 178.44 179.18 1htw h LEU 26 N 0.85 0.00 -0.45 1.67 5.85 -0.64 -2.81 115.31 119.77 1htw h LEU 26 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1htw h LEU 26 Cb 0.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1htw h LEU 26 CO -0.10 0.10 0.00 0.29 -0.34 0.00 0.00 178.44 178.40 1htw n LYS 27 N -3.25 1.30 -3.84 1.25 5.02 -1.03 -4.78 118.16 112.82 1htw n LYS 27 Ca 0.00 -0.45 -0.36 0.00 -2.02 0.00 0.00 58.31 55.49 1htw n LYS 27 Cb 0.36 -1.42 -0.11 0.00 -0.02 0.00 0.00 35.03 33.84 1htw n LYS 27 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1htw s LEU 28 N -1.82 3.75 -0.69 -0.35 1.43 -1.06 -5.05 118.68 114.89 1htw s LEU 28 Ca 0.38 -0.02 -0.12 0.00 -1.03 0.00 0.00 54.13 53.34 1htw s LEU 28 Cb 0.19 -1.98 0.18 0.00 0.03 0.00 0.00 46.19 44.60 1htw s LEU 28 CO 0.30 0.07 0.61 -2.28 0.23 0.00 0.00 176.35 175.28 1htw s HIS 29 N 1.01 3.56 0.55 0.29 2.46 -1.26 -5.03 115.29 116.89 1htw s HIS 29 Ca 0.05 -1.98 -0.01 0.00 0.47 0.00 0.00 55.06 53.58 1htw s HIS 29 Cb -0.14 -3.66 0.02 0.00 -0.13 0.00 0.00 32.58 28.67 1htw s HIS 29 CO 0.03 -0.97 0.80 0.95 -2.47 0.00 0.00 174.74 173.09 1htw s THR 30 N 0.54 3.15 -0.06 0.89 -4.23 -1.26 -5.01 115.64 109.66 1htw s THR 30 Ca 0.13 -0.44 0.22 0.00 -1.18 0.00 0.00 61.69 60.42 1htw s THR 30 Cb -0.18 -3.21 -0.34 0.00 1.34 0.00 0.00 72.50 70.11 1htw s THR 30 CO -0.05 -0.18 0.49 -0.62 -0.54 0.00 0.00 174.62 173.73 1htw n GLU 31 N -2.40 0.64 -4.28 3.99 4.71 -1.26 -3.99 120.64 118.04 1htw n GLU 31 Ca 0.05 -0.19 -0.15 0.00 -0.01 0.00 0.00 57.16 56.86 1htw n GLU 31 Cb 0.59 -1.52 -0.10 0.00 -1.01 0.00 0.00 31.44 29.40 1htw n GLU 31 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1htw s LYS 32 N -3.50 1.32 0.22 3.49 1.02 -1.26 -4.47 119.74 116.56 1htw s LYS 32 Ca -0.07 -1.70 -0.30 0.00 0.02 0.00 0.00 55.97 53.92 1htw s LYS 32 Cb 0.14 -0.17 -0.09 0.00 -0.52 0.00 0.00 37.83 37.19 1htw s LYS 32 CO 0.91 -0.28 1.25 0.00 -0.92 0.00 0.00 175.35 176.31 1htw s ALA 33 N -3.81 3.48 -0.25 5.17 0.00 -0.99 -4.39 121.76 120.97 1htw s ALA 33 Ca 0.36 1.06 -0.29 0.00 0.00 0.00 0.00 51.96 53.09 1htw s ALA 33 Cb 0.07 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1htw s ALA 33 CO 0.12 -0.46 1.20 0.42 0.00 0.00 0.00 175.76 177.03 1htw s ILE 34 N -0.24 4.35 -0.29 0.00 1.01 0.51 -4.91 121.20 121.63 1htw s ILE 34 Ca 0.53 1.58 -0.11 0.00 0.00 0.00 0.00 60.65 62.65 1htw s ILE 34 Cb -0.35 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 37.88 1htw s ILE 34 CO 0.40 -0.33 0.20 -0.04 0.00 0.00 0.00 174.94 175.17 1htw s MET 35 N 3.70 3.89 -0.19 2.79 -1.94 -1.26 -0.50 119.30 125.80 1htw s MET 35 Ca 0.51 -0.36 0.01 0.00 -1.71 0.00 0.00 55.69 54.14 1htw s MET 35 Cb -0.17 -3.68 0.03 0.00 2.01 0.00 0.00 34.83 33.02 1htw s MET 35 CO 0.16 -0.22 -0.14 0.08 -0.01 0.00 0.00 175.02 174.89 1htw s VAL 36 N 1.76 1.81 -0.24 -6.03 1.01 -0.60 -0.00 120.40 118.11 1htw s VAL 36 Ca 0.07 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 60.92 1htw s VAL 36 Cb -0.16 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1htw s VAL 36 CO 0.11 0.33 0.48 -0.31 0.00 0.00 0.00 175.10 175.71 1htw s TYR 37 N 1.36 3.31 -0.40 5.22 1.51 -0.57 -1.11 117.35 126.66 1htw s TYR 37 Ca 0.01 0.63 -0.17 0.00 -1.01 0.00 0.00 57.07 56.54 1htw s TYR 37 Cb -0.15 -2.66 0.01 0.00 -0.11 0.00 0.00 41.96 39.06 1htw s TYR 37 CO -0.10 -0.19 0.45 -0.51 -1.11 0.00 0.00 175.55 174.09 1htw s LEU 38 N 1.96 4.72 -0.10 -1.29 1.43 0.02 -0.31 118.68 125.10 1htw s LEU 38 Ca 0.21 -0.52 -0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1htw s LEU 38 Cb -0.15 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 1htw s LEU 38 CO 0.09 -0.55 -0.08 0.20 0.23 0.00 0.00 176.35 176.24 1htw s ASN 39 N 1.81 4.47 0.00 2.29 0.01 0.00 -3.71 114.94 119.82 1htw s ASN 39 Ca 0.13 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.14 1htw s ASN 39 Cb -0.17 -1.40 0.00 0.00 0.41 0.00 0.00 41.25 40.09 1htw s ASN 39 CO 0.14 0.26 0.00 0.61 -1.51 0.00 0.00 177.10 176.60 1htw n GLY 40 N 2.89 2.43 3.65 0.66 0.00 -1.26 -0.91 105.19 112.65 1htw n GLY 40 Ca -0.18 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 1htw n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1htw s ASP 41 N 0.00 2.55 0.23 1.61 1.01 -1.26 -4.82 116.67 115.98 1htw s ASP 41 Ca 0.00 1.36 -0.32 0.00 0.71 0.00 0.00 52.55 54.30 1htw s ASP 41 Cb 0.00 -2.04 -0.13 0.00 1.01 0.00 0.00 42.92 41.76 1htw s ASP 41 CO 0.00 -3.20 1.53 0.18 0.21 0.00 0.00 175.17 173.89 1htw n LEU 42 N -4.24 3.51 0.00 1.23 4.77 -1.26 -1.18 117.00 119.83 1htw n LEU 42 Ca 0.05 1.12 0.00 0.00 -0.03 0.00 0.00 56.01 57.16 1htw n LEU 42 Cb 0.56 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 1htw n LEU 42 CO 0.57 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1htw n GLY 43 N 2.63 1.32 0.28 -0.72 0.00 -1.26 -4.90 105.19 102.53 1htw n GLY 43 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1htw n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1htw h ALA 44 N 0.00 1.52 0.00 4.61 0.00 -1.47 -3.47 119.26 120.45 1htw h ALA 44 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1htw h ALA 44 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1htw h ALA 44 CO 0.00 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1htw n GLY 45 N -1.16 1.61 0.28 0.00 0.00 -1.26 -4.86 105.19 99.81 1htw n GLY 45 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 1htw n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1htw h LYS 46 N 0.36 0.84 0.00 1.61 1.57 -1.90 0.16 116.57 119.21 1htw h LYS 46 Ca 0.00 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.56 1htw h LYS 46 Cb 0.00 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 1htw h LYS 46 CO 0.00 0.56 -0.80 1.15 -0.57 0.00 0.00 179.45 179.79 1htw h THR 47 N 0.87 1.52 -0.24 -0.16 2.02 -1.98 -0.40 112.91 114.55 1htw h THR 47 Ca 0.30 -2.79 -0.18 0.00 0.77 0.00 0.00 66.41 64.51 1htw h THR 47 Cb 0.05 2.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.99 1htw h THR 47 CO -0.12 0.78 -0.56 0.74 0.37 0.00 0.00 175.52 176.73 1htw h THR 48 N 0.00 1.30 -0.56 3.16 2.02 -1.91 0.30 112.91 117.21 1htw h THR 48 Ca -0.01 -1.78 -0.03 0.00 0.77 0.00 0.00 66.41 65.36 1htw h THR 48 Cb 1.46 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 69.56 1htw h THR 48 CO 0.10 0.57 0.22 0.25 0.37 0.00 0.00 175.52 177.03 1htw h LEU 49 N 0.55 0.77 -1.25 2.58 5.85 -0.82 -0.38 115.31 122.61 1htw h LEU 49 Ca 0.01 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 1htw h LEU 49 Cb 1.14 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1htw h LEU 49 CO 0.12 0.73 -0.14 0.74 -0.34 0.00 0.00 178.44 179.54 1htw h THR 50 N 0.76 1.21 -0.48 1.05 2.02 -0.36 -0.88 112.91 116.22 1htw h THR 50 Ca 0.19 -0.92 -0.11 0.00 0.77 0.00 0.00 66.41 66.33 1htw h THR 50 Cb 0.20 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1htw h THR 50 CO -0.02 0.29 -0.14 -0.09 0.37 0.00 0.00 175.52 175.94 1htw h ARG 51 N 0.32 0.94 -0.53 6.66 2.43 0.10 -0.22 114.38 124.08 1htw h ARG 51 Ca 0.06 -0.37 -0.06 0.00 -0.81 0.00 0.00 59.98 58.80 1htw h ARG 51 Cb 0.45 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1htw h ARG 51 CO 0.03 1.03 0.07 0.78 -1.51 0.00 0.00 179.97 180.37 1htw h GLY 52 N 0.79 0.90 0.93 2.80 0.00 -0.24 -0.07 103.07 108.19 1htw h GLY 52 Ca 0.12 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 1htw h GLY 52 CO 0.05 0.52 -0.32 -0.33 0.00 0.00 0.00 176.54 176.46 1htw h MET 53 N 0.80 -0.87 0.06 4.80 2.86 -0.82 0.17 114.93 121.93 1htw h MET 53 Ca 0.17 0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1htw h MET 53 Cb 0.37 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.23 1htw h MET 53 CO 0.01 -0.55 -0.03 -0.07 1.06 0.00 0.00 176.91 177.33 1htw h LEU 54 N -0.99 -0.06 -1.00 1.22 3.38 -0.92 -2.70 115.31 114.25 1htw h LEU 54 Ca -0.09 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 1htw h LEU 54 Cb 0.71 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1htw h LEU 54 CO 0.15 0.32 -0.26 1.56 0.09 0.00 0.00 178.44 180.30 1htw h GLN 55 N -0.46 0.41 -0.77 1.13 4.20 -1.12 -1.33 115.11 117.16 1htw h GLN 55 Ca -0.01 -0.15 0.08 0.00 0.06 0.00 0.00 58.65 58.63 1htw h GLN 55 Cb 0.41 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1htw h GLN 55 CO 0.01 0.64 0.50 0.78 -0.67 0.00 0.00 178.83 180.10 1htw h GLY 56 N 1.02 1.02 -1.41 3.46 0.00 -0.63 -1.58 103.07 104.94 1htw h GLY 56 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1htw h GLY 56 CO 0.05 0.21 0.00 0.29 0.00 0.00 0.00 176.54 177.08 1htw n ILE 57 N -4.49 0.41 0.00 2.60 -5.35 -1.02 -4.93 119.36 106.58 1htw n ILE 57 Ca 0.12 -0.52 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 1htw n ILE 57 Cb 0.27 0.46 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 1htw n ILE 57 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1htw n GLY 58 N 1.23 1.37 3.68 3.28 0.00 -0.59 -4.71 105.19 109.45 1htw n GLY 58 Ca 0.16 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.71 1htw n GLY 58 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1htw n HIS 59 N -0.06 2.30 -3.85 1.61 -0.00 -0.51 -4.97 115.22 109.74 1htw n HIS 59 Ca 0.00 0.11 -0.36 0.00 -0.00 0.00 0.00 57.72 57.47 1htw n HIS 59 Cb 0.00 -2.61 -0.13 0.00 -0.00 0.00 0.00 29.99 27.24 1htw n HIS 59 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1htw s GLN 60 N 2.74 2.81 0.00 1.57 -0.21 -1.26 -4.34 119.66 120.97 1htw s GLN 60 Ca 0.87 -1.02 0.00 0.00 0.02 0.00 0.00 55.36 55.23 1htw s GLN 60 Cb -0.69 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.10 1htw s GLN 60 CO 0.46 -0.50 0.00 0.41 -2.12 0.00 0.00 175.29 173.54 1htw n GLY 61 N 4.75 2.35 3.76 3.09 0.00 -1.26 -5.12 105.19 112.77 1htw n GLY 61 Ca -0.15 -1.76 -0.37 0.00 0.00 0.00 0.00 46.02 43.75 1htw n GLY 61 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1htw s ASN 62 N 0.00 5.72 -0.71 1.61 0.01 -1.26 -4.97 114.94 115.35 1htw s ASN 62 Ca 0.00 2.36 0.02 0.00 -0.71 0.00 0.00 52.86 54.53 1htw s ASN 62 Cb 0.00 -2.60 0.17 0.00 0.41 0.00 0.00 41.25 39.23 1htw s ASN 62 CO 0.00 -1.23 0.51 -0.69 -1.51 0.00 0.00 177.10 174.19 1htw s VAL 63 N -1.57 3.37 0.03 1.60 1.01 -1.26 -5.08 120.40 118.50 1htw s VAL 63 Ca 0.70 -3.75 -0.29 0.00 0.00 0.00 0.00 61.98 58.64 1htw s VAL 63 Cb -0.30 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1htw s VAL 63 CO 0.34 -0.96 0.92 -1.59 0.00 0.00 0.00 175.10 173.81 1htw s LYS 64 N -0.96 4.58 -0.09 2.72 -2.85 -1.26 -4.91 119.74 116.97 1htw s LYS 64 Ca 0.23 1.33 -0.39 0.00 -1.00 0.00 0.00 55.97 56.14 1htw s LYS 64 Cb -0.12 -3.43 -0.17 0.00 -2.06 0.00 0.00 37.83 32.05 1htw s LYS 64 CO -0.10 0.07 1.44 0.45 0.10 0.00 0.00 175.35 177.31 1htw n SER 65 N 3.48 1.56 -0.94 0.03 2.88 -1.26 -4.84 113.62 114.54 1htw n SER 65 Ca 0.03 1.12 0.04 0.00 -1.33 0.00 0.00 58.87 58.73 1htw n SER 65 Cb 0.50 -1.11 0.17 0.00 -0.75 0.00 0.00 64.21 63.03 1htw n SER 65 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1htw n PRO 66 N 3.34 2.40 -0.34 -1.46 -0.02 -1.26 -4.45 135.00 133.21 1htw n PRO 66 Ca 0.22 -1.34 0.32 0.00 -2.02 0.00 0.00 63.50 60.68 1htw n PRO 66 Cb 0.13 -1.63 0.68 0.00 -0.02 0.00 0.00 33.50 32.66 1htw n PRO 66 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1htw h THR 67 N 1.86 0.42 0.00 3.45 2.02 -1.88 0.37 112.91 119.14 1htw h THR 67 Ca 0.00 -0.04 -0.18 0.00 0.77 0.00 0.00 66.41 66.96 1htw h THR 67 Cb 0.91 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1htw h THR 67 CO 0.14 0.02 -0.99 0.10 0.37 0.00 0.00 175.52 175.16 1htw h TYR 68 N 0.11 0.00 0.00 3.16 -0.00 -1.89 -3.40 116.97 114.96 1htw h TYR 68 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.32 1htw h TYR 68 Cb 2.10 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.83 1htw h TYR 68 CO -0.00 1.32 -0.06 1.79 -0.00 0.00 0.00 178.16 181.21 1htw h THR 69 N -1.00 0.00 0.00 -0.90 1.35 -1.80 -3.48 112.91 107.08 1htw h THR 69 Ca -0.27 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1htw h THR 69 Cb 1.20 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1htw h THR 69 CO -0.16 0.00 0.00 -0.11 -0.25 0.00 0.00 175.52 175.00 1htw n LEU 70 N -2.40 0.00 -3.85 3.87 7.94 0.13 -4.87 117.00 117.81 1htw n LEU 70 Ca 0.05 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.83 1htw n LEU 70 Cb 0.45 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.26 1htw n LEU 70 CO 0.32 0.00 -0.30 0.54 -1.11 0.00 0.00 177.39 176.83 1htw s VAL 71 N -0.13 0.00 -0.04 1.96 0.11 -1.26 -1.32 120.40 119.71 1htw s VAL 71 Ca 0.00 -0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 1htw s VAL 71 Cb 0.00 -0.08 -0.01 0.00 -1.53 0.00 0.00 36.38 34.76 1htw s VAL 71 CO 0.00 -0.00 -0.21 -1.61 -3.33 0.00 0.00 175.10 169.95 1htw s GLU 72 N 0.02 2.01 -0.04 1.54 0.41 0.19 -4.97 118.70 117.85 1htw s GLU 72 Ca -0.00 -0.74 -0.01 0.00 -0.41 0.00 0.00 54.97 53.81 1htw s GLU 72 Cb -0.00 -1.77 -0.04 0.00 -1.78 0.00 0.00 34.13 30.54 1htw s GLU 72 CO 0.00 0.34 0.04 -1.83 -0.49 0.00 0.00 175.26 173.32 1htw s GLU 73 N -0.16 3.02 0.02 1.61 -1.05 -1.26 -0.84 118.70 120.04 1htw s GLU 73 Ca -0.01 -0.45 0.04 0.00 -0.15 0.00 0.00 54.97 54.40 1htw s GLU 73 Cb -0.11 -2.83 -0.02 0.00 -0.44 0.00 0.00 34.13 30.73 1htw s GLU 73 CO 0.02 0.68 -0.11 0.71 0.95 0.00 0.00 175.26 177.50 1htw s TYR 74 N -1.05 0.99 -0.34 4.83 1.51 0.22 -5.00 117.35 118.51 1htw s TYR 74 Ca 0.18 -0.30 0.03 0.00 -1.01 0.00 0.00 57.07 55.97 1htw s TYR 74 Cb -0.12 -0.60 0.10 0.00 -0.11 0.00 0.00 41.96 41.23 1htw s TYR 74 CO 0.08 -0.00 0.05 1.21 -1.11 0.00 0.00 175.55 175.78 1htw s ASN 75 N -0.85 4.78 -0.05 2.29 3.84 -1.26 -0.58 114.94 123.11 1htw s ASN 75 Ca 0.01 -2.05 0.04 0.00 0.21 0.00 0.00 52.86 51.07 1htw s ASN 75 Cb -0.06 -1.64 -0.00 0.00 -0.55 0.00 0.00 41.25 38.99 1htw s ASN 75 CO 0.01 -0.37 -0.18 -0.63 -2.79 0.00 0.00 177.10 173.14 1htw s ILE 76 N 0.95 1.48 -1.20 -5.21 1.01 0.42 -4.81 121.20 113.83 1htw s ILE 76 Ca 0.08 -0.74 -0.05 0.00 0.00 0.00 0.00 60.65 59.94 1htw s ILE 76 Cb -0.19 -1.27 0.05 0.00 0.01 0.00 0.00 42.46 41.05 1htw s ILE 76 CO -0.07 0.43 0.13 0.00 0.00 0.00 0.00 174.94 175.42 1htw n ALA 77 N 3.17 -1.48 -0.07 9.38 0.00 -1.26 0.11 120.51 130.36 1htw n ALA 77 Ca -0.18 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1htw n ALA 77 Cb 0.53 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1htw n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1htw n GLY 78 N -1.79 1.61 3.40 0.00 0.00 -1.26 -5.04 105.19 102.12 1htw n GLY 78 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1htw n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1htw s LYS 79 N -0.43 1.97 0.05 1.61 1.02 0.30 -5.10 119.74 119.17 1htw s LYS 79 Ca 0.00 -1.03 -0.27 0.00 0.02 0.00 0.00 55.97 54.69 1htw s LYS 79 Cb 0.00 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.16 1htw s LYS 79 CO 0.00 0.53 0.86 -1.64 -0.92 0.00 0.00 175.35 174.18 1htw s MET 80 N -1.30 4.57 -0.10 1.68 -1.94 -1.26 -0.44 119.30 120.52 1htw s MET 80 Ca 0.13 1.24 0.01 0.00 -1.71 0.00 0.00 55.69 55.36 1htw s MET 80 Cb -0.10 -3.39 0.02 0.00 2.01 0.00 0.00 34.83 33.37 1htw s MET 80 CO 0.03 0.20 -0.13 0.42 -0.01 0.00 0.00 175.02 175.53 1htw s ILE 81 N 0.17 1.32 -0.22 2.53 1.01 0.26 -1.73 121.20 124.54 1htw s ILE 81 Ca 0.43 -0.54 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 1htw s ILE 81 Cb -0.21 -1.22 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 1htw s ILE 81 CO 0.26 0.41 -0.04 -0.31 0.00 0.00 0.00 174.94 175.25 1htw s TYR 82 N 1.02 2.96 -0.39 3.97 2.02 -0.21 -0.61 117.35 126.11 1htw s TYR 82 Ca -0.07 -0.91 -0.13 0.00 -0.37 0.00 0.00 57.07 55.59 1htw s TYR 82 Cb -0.15 -2.10 0.02 0.00 -0.40 0.00 0.00 41.96 39.33 1htw s TYR 82 CO -0.01 -0.53 0.24 -1.58 -1.57 0.00 0.00 175.55 172.10 1htw s HIS 83 N 1.44 3.24 0.02 2.71 5.65 -0.02 -0.44 115.29 127.89 1htw s HIS 83 Ca 0.05 -0.76 -0.00 0.00 0.25 0.00 0.00 55.06 54.60 1htw s HIS 83 Cb -0.14 -2.50 -0.04 0.00 -1.18 0.00 0.00 32.58 28.72 1htw s HIS 83 CO -0.03 -0.61 0.12 -0.06 -0.65 0.00 0.00 174.74 173.52 1htw s PHE 84 N 1.61 3.36 -0.31 3.88 0.40 0.61 -0.64 117.98 126.91 1htw s PHE 84 Ca 0.03 0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.57 1htw s PHE 84 Cb -0.19 -1.74 0.10 0.00 0.51 0.00 0.00 43.02 41.70 1htw s PHE 84 CO 0.08 0.57 0.13 0.34 0.70 0.00 0.00 175.22 177.04 1htw s ASP 85 N -2.01 3.70 -0.06 1.36 -1.08 -0.44 -0.77 116.67 117.38 1htw s ASP 85 Ca 0.27 -1.53 0.04 0.00 -0.52 0.00 0.00 52.55 50.80 1htw s ASP 85 Cb -0.12 -0.58 0.23 0.00 -1.46 0.00 0.00 42.92 40.98 1htw s ASP 85 CO 0.18 -0.42 0.89 0.18 0.52 0.00 0.00 175.17 176.52 1htw n LEU 86 N 4.95 2.19 -0.36 -1.34 4.32 -0.81 -4.27 117.00 121.68 1htw n LEU 86 Ca -0.03 -1.11 0.06 0.00 -0.02 0.00 0.00 56.01 54.92 1htw n LEU 86 Cb 0.41 -0.51 0.23 0.00 -1.62 0.00 0.00 43.42 41.93 1htw n LEU 86 CO 0.08 0.35 1.23 0.22 -1.22 0.00 0.00 177.39 178.05 1htw h TYR 87 N 1.13 1.14 -0.63 -1.77 3.20 -1.84 -1.88 116.97 116.32 1htw h TYR 87 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1htw h TYR 87 Cb 0.84 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1htw h TYR 87 CO 0.29 0.47 0.00 0.54 -1.64 0.00 0.00 178.16 177.82 1htw n ARG 88 N -4.61 2.52 -1.77 1.82 1.74 -1.26 -4.91 116.66 110.19 1htw n ARG 88 Ca 0.18 -2.36 -0.42 0.00 -0.77 0.00 0.00 57.85 54.48 1htw n ARG 88 Cb 0.33 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 1htw n ARG 88 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1htw s LEU 89 N -1.07 4.40 0.00 0.55 2.96 -0.71 -4.88 118.68 119.94 1htw s LEU 89 Ca 0.44 2.55 -0.25 0.00 -0.22 0.00 0.00 54.13 56.65 1htw s LEU 89 Cb 0.23 -3.53 -0.17 0.00 0.50 0.00 0.00 46.19 43.22 1htw s LEU 89 CO 0.30 -1.01 1.20 0.00 -1.32 0.00 0.00 176.35 175.52 1htw h ALA 90 N 10.21 -0.35 -3.48 5.97 0.00 -1.91 -3.45 119.26 126.24 1htw h ALA 90 Ca -0.46 -0.19 -0.35 0.00 0.00 0.00 0.00 54.91 53.91 1htw h ALA 90 Cb 1.22 0.14 -0.34 0.00 0.00 0.00 0.00 17.79 18.80 1htw h ALA 90 CO 0.94 -0.51 -0.75 -0.51 0.00 0.00 0.00 179.25 178.43 1htw s ASP 91 N -5.17 0.49 0.32 0.00 1.01 -1.26 -5.04 116.67 107.03 1htw s ASP 91 Ca -0.14 -0.03 0.09 0.00 0.71 0.00 0.00 52.55 53.18 1htw s ASP 91 Cb 0.02 -0.23 0.93 0.00 1.01 0.00 0.00 42.92 44.65 1htw s ASP 91 CO 0.55 -0.10 1.64 -0.65 0.21 0.00 0.00 175.17 176.82 1htw h PRO 92 N 7.30 0.22 -0.91 8.23 0.11 -1.87 0.50 132.00 145.58 1htw h PRO 92 Ca -0.41 -0.01 0.21 0.00 0.11 0.00 0.00 66.00 65.89 1htw h PRO 92 Cb 1.13 -0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.08 1htw h PRO 92 CO 0.46 0.15 0.46 1.49 -0.21 0.00 0.00 178.00 180.35 1htw h GLU 93 N 0.23 0.49 0.00 1.05 4.81 -1.96 0.21 114.58 119.42 1htw h GLU 93 Ca 0.66 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.86 1htw h GLU 93 Cb 1.46 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.72 1htw h GLU 93 CO -0.66 0.33 0.05 -1.91 -0.73 0.00 0.00 179.01 176.09 1htw n GLU 94 N -4.96 0.02 0.08 1.92 0.00 0.18 -0.60 120.64 117.28 1htw n GLU 94 Ca 0.22 0.48 -0.23 0.00 0.00 0.00 0.00 57.16 57.64 1htw n GLU 94 Cb 0.62 -1.63 -0.15 0.00 0.00 0.00 0.00 31.44 30.28 1htw n GLU 94 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1htw h LEU 95 N 0.00 0.63 -1.83 4.31 6.46 -0.68 -3.34 115.31 120.87 1htw h LEU 95 Ca 0.00 -0.92 0.06 0.00 -0.12 0.00 0.00 57.88 56.90 1htw h LEU 95 Cb 0.10 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.81 1htw h LEU 95 CO 0.00 1.66 0.24 -0.08 -0.62 0.00 0.00 178.44 179.64 1htw h GLU 96 N -0.05 0.20 -0.38 1.25 4.81 -0.91 -2.85 114.58 116.67 1htw h GLU 96 Ca -0.27 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1htw h GLU 96 Cb 1.98 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.31 1htw h GLU 96 CO 0.19 0.13 0.00 1.19 -0.73 0.00 0.00 179.01 179.79 1htw n PHE 97 N -4.47 0.65 -2.51 0.92 3.72 -1.25 -4.93 117.46 109.58 1htw n PHE 97 Ca 0.04 -0.58 -0.23 0.00 -0.05 0.00 0.00 57.45 56.63 1htw n PHE 97 Cb 0.27 -0.09 0.04 0.00 -0.94 0.00 0.00 39.48 38.76 1htw n PHE 97 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1htw s MET 98 N -1.39 2.53 0.00 -1.08 -1.94 -1.08 -4.98 119.30 111.36 1htw s MET 98 Ca 0.30 -0.51 0.00 0.00 -1.71 0.00 0.00 55.69 53.77 1htw s MET 98 Cb 0.18 -2.37 0.00 0.00 2.01 0.00 0.00 34.83 34.65 1htw s MET 98 CO 0.16 -0.83 0.03 0.41 -0.01 0.00 0.00 175.02 174.78 1htw n GLY 99 N -2.52 0.07 0.00 -0.03 0.00 -1.26 -4.37 105.19 97.08 1htw n GLY 99 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1htw n GLY 99 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1htw n ILE 100 N 0.38 0.39 0.00 -0.61 -5.35 -1.26 -3.97 119.36 108.93 1htw n ILE 100 Ca 0.00 0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.62 1htw n ILE 100 Cb 0.01 -1.14 0.00 0.00 -1.74 0.00 0.00 39.64 36.77 1htw n ILE 100 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1htw n ARG 101 N -0.98 0.00 0.24 6.28 1.74 -1.26 -2.99 116.66 119.69 1htw n ARG 101 Ca 0.00 0.18 0.16 0.00 -0.77 0.00 0.00 57.85 57.42 1htw n ARG 101 Cb 0.05 -0.80 0.83 0.00 -1.02 0.00 0.00 32.46 31.52 1htw n ARG 101 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1htw h ASP 102 N 0.00 0.00 -0.09 0.55 3.32 -1.97 -3.09 116.42 115.14 1htw h ASP 102 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1htw h ASP 102 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1htw h ASP 102 CO 0.00 0.00 -0.06 1.88 -1.72 0.00 0.00 179.24 179.34 1htw h TYR 103 N 0.00 0.24 0.00 4.55 -1.99 -1.76 -3.23 116.97 114.77 1htw h TYR 103 Ca 0.00 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.66 1htw h TYR 103 Cb 0.05 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1htw h TYR 103 CO 0.00 0.59 -0.36 1.19 -0.00 0.00 0.00 178.16 179.59 1htw n PHE 104 N -4.71 0.23 1.33 4.88 3.72 -1.17 -4.07 117.46 117.66 1htw n PHE 104 Ca -0.07 0.07 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 1htw n PHE 104 Cb 0.29 -0.48 0.38 0.00 -0.94 0.00 0.00 39.48 38.73 1htw n PHE 104 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1htw n ASN 105 N -1.73 1.74 -4.23 4.37 4.13 -1.19 -2.34 115.26 116.01 1htw n ASN 105 Ca 0.05 -1.49 -0.28 0.00 1.68 0.00 0.00 54.58 54.54 1htw n ASN 105 Cb 0.37 0.05 -0.07 0.00 -1.54 0.00 0.00 39.78 38.60 1htw n ASN 105 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 1htw n THR 106 N 0.24 0.00 -0.54 3.41 5.66 -1.22 -4.75 114.28 117.08 1htw n THR 106 Ca 0.16 -2.32 -0.17 0.00 -3.05 0.00 0.00 64.05 58.67 1htw n THR 106 Cb 0.41 0.63 -0.02 0.00 -1.55 0.00 0.00 70.33 69.81 1htw n THR 106 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1htw n ASP 107 N -1.41 3.29 -4.65 1.09 2.03 -1.26 -2.62 116.55 113.03 1htw n ASP 107 Ca -0.14 -2.25 -0.31 0.00 0.52 0.00 0.00 54.79 52.62 1htw n ASP 107 Cb 0.61 -0.91 -0.09 0.00 -0.72 0.00 0.00 41.12 40.01 1htw n ASP 107 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1htw s SER 108 N 4.03 3.87 -0.14 1.67 1.04 -1.26 -4.35 113.70 118.56 1htw s SER 108 Ca 0.30 -1.58 0.02 0.00 0.48 0.00 0.00 55.95 55.17 1htw s SER 108 Cb 0.08 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.47 1htw s SER 108 CO -0.01 -0.75 -0.21 -0.63 0.98 0.00 0.00 173.24 172.62 1htw s ILE 109 N -2.89 2.17 -0.21 -1.02 1.01 -0.70 -0.36 121.20 119.20 1htw s ILE 109 Ca 0.16 -0.95 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 1htw s ILE 109 Cb 0.04 -1.87 -0.00 0.00 0.01 0.00 0.00 42.46 40.64 1htw s ILE 109 CO 0.08 0.55 -0.07 0.00 0.00 0.00 0.00 174.94 175.50 1htw s LEU 111 N 1.37 3.86 -0.19 0.00 1.43 0.41 -1.56 118.68 124.01 1htw s LEU 111 Ca 0.05 -0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 1htw s LEU 111 Cb -0.14 -1.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.19 1htw s LEU 111 CO -0.04 -0.19 -0.10 -0.63 0.23 0.00 0.00 176.35 175.61 1htw s ILE 112 N 1.51 2.98 -0.02 -0.59 1.01 -0.27 -0.28 121.20 125.54 1htw s ILE 112 Ca 0.03 -0.64 -0.15 0.00 0.00 0.00 0.00 60.65 59.88 1htw s ILE 112 Cb -0.17 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 1htw s ILE 112 CO 0.03 0.48 0.41 -1.61 0.00 0.00 0.00 174.94 174.24 1htw s GLU 113 N 1.12 3.99 -1.33 2.79 2.02 0.05 -0.80 118.70 126.53 1htw s GLU 113 Ca 0.01 0.40 -0.07 0.00 0.02 0.00 0.00 54.97 55.33 1htw s GLU 113 Cb -0.14 -3.26 0.01 0.00 0.10 0.00 0.00 34.13 30.84 1htw s GLU 113 CO -0.03 0.61 1.11 0.91 0.02 0.00 0.00 175.26 177.88 1htw n TRP 114 N 2.13 -2.65 -0.21 1.61 7.02 -1.24 -1.93 117.44 122.17 1htw n TRP 114 Ca -0.13 0.99 0.28 0.00 -1.02 0.00 0.00 57.50 57.62 1htw n TRP 114 Cb 0.52 -4.96 0.70 0.00 -2.42 0.00 0.00 31.31 25.16 1htw n TRP 114 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1htw h SER 115 N -2.44 0.05 -0.30 -0.99 4.64 -1.84 -1.90 113.55 110.77 1htw h SER 115 Ca -0.58 0.01 0.03 0.00 -0.47 0.00 0.00 61.79 60.78 1htw h SER 115 Cb 1.36 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.44 1htw h SER 115 CO 0.55 0.02 0.20 1.05 -0.87 0.00 0.00 176.83 177.78 1htw h GLU 116 N 0.05 0.28 0.00 4.77 4.11 -1.97 -1.68 114.58 120.14 1htw h GLU 116 Ca 0.45 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.87 1htw h GLU 116 Cb 1.73 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.92 1htw h GLU 116 CO -0.03 0.19 0.01 1.63 0.07 0.00 0.00 179.01 180.87 1htw n LYS 117 N -4.49 0.00 -3.09 1.06 4.76 -0.71 -3.05 118.16 112.63 1htw n LYS 117 Ca 0.02 0.30 -0.21 0.00 -2.87 0.00 0.00 58.31 55.55 1htw n LYS 117 Cb 0.16 -1.51 -0.03 0.00 -1.84 0.00 0.00 35.03 31.81 1htw n LYS 117 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1htw n GLY 118 N -1.30 4.38 0.00 0.72 0.00 -0.63 -3.90 105.19 104.45 1htw n GLY 118 Ca 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.91 1htw n GLY 118 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1htw n GLN 119 N 0.08 0.00 -0.11 1.61 1.13 -1.17 -3.49 117.38 115.42 1htw n GLN 119 Ca 0.27 0.15 0.10 0.00 -1.94 0.00 0.00 57.00 55.59 1htw n GLN 119 Cb 0.56 -0.32 0.15 0.00 0.11 0.00 0.00 30.24 30.74 1htw n GLN 119 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1htw n GLY 120 N -0.62 1.29 0.01 1.08 0.00 -1.26 -4.75 105.19 100.94 1htw n GLY 120 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 46.02 45.39 1htw n GLY 120 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1htw h ILE 121 N 3.94 0.00 -4.02 -0.61 5.03 -1.90 -3.47 117.51 116.49 1htw h ILE 121 Ca 0.00 -0.03 -0.51 0.00 -0.12 0.00 0.00 64.86 64.20 1htw h ILE 121 Cb 0.88 0.00 0.08 0.00 -3.03 0.00 0.00 36.82 34.75 1htw h ILE 121 CO 0.00 0.00 0.49 -1.48 -0.68 0.00 0.00 178.15 176.48 1htw s LEU 122 N -4.19 3.94 1.14 1.44 2.34 -1.26 -5.01 118.68 117.07 1htw s LEU 122 Ca -0.00 2.35 -0.14 0.00 0.06 0.00 0.00 54.13 56.40 1htw s LEU 122 Cb 0.00 -4.31 0.23 0.00 -0.56 0.00 0.00 46.19 41.55 1htw s LEU 122 CO 0.01 -1.08 0.78 -0.81 -1.06 0.00 0.00 176.35 174.19 1htw n PRO 123 N -0.73 -2.08 -2.01 1.48 -0.04 -1.26 -4.95 135.00 125.41 1htw n PRO 123 Ca 0.09 -0.58 -0.40 0.00 -0.04 0.00 0.00 63.50 62.57 1htw n PRO 123 Cb 0.48 -2.07 -0.01 0.00 -0.04 0.00 0.00 33.50 31.87 1htw n PRO 123 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1htw s GLU 124 N -4.17 4.12 0.35 0.54 -1.05 -1.26 -4.97 118.70 112.25 1htw s GLU 124 Ca 0.65 2.27 -0.28 0.00 -0.15 0.00 0.00 54.97 57.47 1htw s GLU 124 Cb -0.22 -2.91 -0.10 0.00 -0.44 0.00 0.00 34.13 30.46 1htw s GLU 124 CO 0.65 -0.41 1.29 0.00 0.95 0.00 0.00 175.26 177.75 1htw s ALA 125 N -1.19 3.43 0.10 -0.84 0.00 -1.26 -4.76 121.76 117.25 1htw s ALA 125 Ca 0.53 1.23 -0.07 0.00 0.00 0.00 0.00 51.96 53.65 1htw s ALA 125 Cb -0.41 -3.47 -0.18 0.00 0.00 0.00 0.00 23.12 19.06 1htw s ALA 125 CO 0.54 -0.66 1.22 -0.44 0.00 0.00 0.00 175.76 176.42 1htw h ASP 126 N 3.22 0.60 -3.60 0.00 3.32 -0.80 -3.41 116.42 115.75 1htw h ASP 126 Ca -0.49 -0.53 -0.34 0.00 0.02 0.00 0.00 57.03 55.70 1htw h ASP 126 Cb 1.23 -0.19 -0.32 0.00 0.22 0.00 0.00 39.33 40.27 1htw h ASP 126 CO 0.65 1.35 -0.75 -0.63 -1.72 0.00 0.00 179.24 178.14 1htw s ILE 127 N -3.09 0.24 -0.20 0.35 1.01 -0.98 -1.18 121.20 117.36 1htw s ILE 127 Ca -0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.47 1htw s ILE 127 Cb 0.08 -0.29 -0.05 0.00 0.01 0.00 0.00 42.46 42.21 1htw s ILE 127 CO 0.89 0.13 0.18 -0.76 0.00 0.00 0.00 174.94 175.38 1htw s LEU 128 N 0.67 4.19 -0.41 2.97 1.02 -0.41 -1.51 118.68 125.20 1htw s LEU 128 Ca -0.07 0.26 -0.01 0.00 0.02 0.00 0.00 54.13 54.33 1htw s LEU 128 Cb -0.10 -2.17 0.11 0.00 0.02 0.00 0.00 46.19 44.05 1htw s LEU 128 CO -0.01 0.12 0.19 -0.69 0.02 0.00 0.00 176.35 175.97 1htw s VAL 129 N 0.63 3.05 -0.35 -1.59 1.01 0.57 -0.95 120.40 122.78 1htw s VAL 129 Ca 0.10 -2.23 -0.17 0.00 0.00 0.00 0.00 61.98 59.68 1htw s VAL 129 Cb -0.12 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 1htw s VAL 129 CO 0.01 -0.69 0.45 0.20 0.00 0.00 0.00 175.10 175.08 1htw s ASN 130 N 1.47 6.26 -0.24 3.32 0.01 0.28 -0.82 114.94 125.22 1htw s ASN 130 Ca 0.10 -0.11 -0.06 0.00 -0.71 0.00 0.00 52.86 52.07 1htw s ASN 130 Cb -0.22 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.18 1htw s ASN 130 CO -0.05 -0.42 0.04 -0.63 -1.51 0.00 0.00 177.10 174.53 1htw s ILE 131 N 2.24 4.07 0.19 0.60 1.01 -0.08 -0.46 121.20 128.77 1htw s ILE 131 Ca 0.16 -0.27 0.06 0.00 0.00 0.00 0.00 60.65 60.60 1htw s ILE 131 Cb -0.16 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.37 1htw s ILE 131 CO 0.13 0.35 0.15 -1.81 0.00 0.00 0.00 174.94 173.76 1htw s ASP 132 N 1.58 5.50 0.04 3.58 1.01 0.47 -4.51 116.67 124.34 1htw s ASP 132 Ca 0.06 -0.18 0.01 0.00 0.71 0.00 0.00 52.55 53.15 1htw s ASP 132 Cb -0.15 -1.42 -0.02 0.00 1.01 0.00 0.00 42.92 42.34 1htw s ASP 132 CO 0.02 0.04 -0.06 -0.72 0.21 0.00 0.00 175.17 174.66 1htw s TYR 133 N -1.87 0.51 -0.25 4.23 1.13 -1.26 -1.18 117.35 118.66 1htw s TYR 133 Ca 0.31 -0.58 -0.09 0.00 -1.41 0.00 0.00 57.07 55.31 1htw s TYR 133 Cb -0.09 -0.33 0.11 0.00 -1.10 0.00 0.00 41.96 40.55 1htw s TYR 133 CO 0.24 -0.15 0.54 -0.47 -2.51 0.00 0.00 175.55 173.20 1htw s TYR 134 N -1.73 -1.08 0.00 -3.49 6.14 -0.61 -5.01 117.35 111.58 1htw s TYR 134 Ca -0.10 1.94 0.00 0.00 0.64 0.00 0.00 57.07 59.55 1htw s TYR 134 Cb -0.08 0.56 0.00 0.00 0.42 0.00 0.00 41.96 42.86 1htw s TYR 134 CO -0.01 -0.57 0.00 -3.47 0.64 0.00 0.00 175.55 172.13 1htw n ASP 135 N 5.38 0.00 -1.91 4.32 2.03 -1.26 -0.64 116.55 124.47 1htw n ASP 135 Ca -0.11 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.27 1htw n ASP 135 Cb 0.49 0.00 0.41 0.00 -0.72 0.00 0.00 41.12 41.30 1htw n ASP 135 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1htw n ASP 136 N 3.76 5.78 -4.76 1.67 8.00 -1.26 -4.93 116.55 124.81 1htw n ASP 136 Ca 0.00 -2.94 -0.28 0.00 0.71 0.00 0.00 54.79 52.28 1htw n ASP 136 Cb 0.00 -0.69 -0.06 0.00 -0.02 0.00 0.00 41.12 40.35 1htw n ASP 136 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1htw s ALA 137 N -2.78 3.50 0.11 2.24 0.00 0.19 -3.73 121.76 121.28 1htw s ALA 137 Ca 0.55 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 51.38 1htw s ALA 137 Cb 0.42 -1.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 1htw s ALA 137 CO 0.16 0.61 -0.07 1.03 0.00 0.00 0.00 175.76 177.49 1htw s ARG 138 N -2.75 0.88 -0.14 0.00 1.81 0.29 -1.58 118.95 117.47 1htw s ARG 138 Ca 0.29 -1.36 -0.02 0.00 -1.72 0.00 0.00 55.73 52.92 1htw s ARG 138 Cb -0.11 -0.27 0.05 0.00 -0.45 0.00 0.00 34.95 34.17 1htw s ARG 138 CO 0.22 -0.01 0.03 1.21 -0.68 0.00 0.00 175.30 176.07 1htw s ASN 139 N -3.07 2.23 -0.01 0.23 2.47 -0.32 -0.71 114.94 115.77 1htw s ASN 139 Ca 0.13 -0.46 0.03 0.00 0.42 0.00 0.00 52.86 52.98 1htw s ASN 139 Cb 0.05 -0.47 -0.03 0.00 -1.45 0.00 0.00 41.25 39.35 1htw s ASN 139 CO -0.04 -0.27 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.36 1htw s ILE 140 N 1.96 3.49 -0.10 -5.21 1.01 -0.43 -0.39 121.20 121.53 1htw s ILE 140 Ca 0.02 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.92 1htw s ILE 140 Cb -0.15 -2.49 0.01 0.00 0.01 0.00 0.00 42.46 39.84 1htw s ILE 140 CO -0.07 0.43 -0.19 -0.70 0.00 0.00 0.00 174.94 174.41 1htw s GLU 141 N -1.28 2.54 -0.21 2.79 2.12 0.39 -0.81 118.70 124.25 1htw s GLU 141 Ca 0.16 -0.69 -0.10 0.00 0.36 0.00 0.00 54.97 54.69 1htw s GLU 141 Cb -0.11 -2.01 -0.05 0.00 0.26 0.00 0.00 34.13 32.22 1htw s GLU 141 CO 0.06 0.07 0.14 -0.51 -0.54 0.00 0.00 175.26 174.48 1htw s LEU 142 N 0.62 4.19 -0.20 2.70 1.43 -0.05 -0.55 118.68 126.82 1htw s LEU 142 Ca -0.14 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 1htw s LEU 142 Cb -0.16 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 43.99 1htw s LEU 142 CO 0.04 0.15 -0.12 -0.63 0.23 0.00 0.00 176.35 176.03 1htw s ILE 143 N 0.52 1.71 0.26 -0.59 1.01 -0.13 -1.58 121.20 122.41 1htw s ILE 143 Ca 0.08 -1.01 -0.30 0.00 0.00 0.00 0.00 60.65 59.42 1htw s ILE 143 Cb -0.12 -1.75 -0.09 0.00 0.01 0.00 0.00 42.46 40.51 1htw s ILE 143 CO -0.00 0.22 1.03 0.00 0.00 0.00 0.00 174.94 176.18 1htw s ALA 144 N 1.37 3.38 -0.05 9.38 0.00 0.35 -1.29 121.76 134.90 1htw s ALA 144 Ca -0.01 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1htw s ALA 144 Cb -0.16 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1htw s ALA 144 CO -0.09 0.00 0.38 1.04 0.00 0.00 0.00 175.76 177.10 1htw n GLN 145 N 1.32 1.15 -3.93 0.00 6.02 -0.32 -4.42 117.38 117.19 1htw n GLN 145 Ca -0.02 -0.39 -0.08 0.00 -0.01 0.00 0.00 57.00 56.51 1htw n GLN 145 Cb 0.46 -0.88 -0.08 0.00 1.02 0.00 0.00 30.24 30.76 1htw n GLN 145 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1htw s THR 146 N -0.30 0.16 0.33 5.09 -1.32 -1.24 -4.98 115.64 113.37 1htw s THR 146 Ca 0.00 -1.38 0.03 0.00 -1.21 0.00 0.00 61.69 59.13 1htw s THR 146 Cb 0.00 -1.44 0.28 0.00 -1.51 0.00 0.00 72.50 69.84 1htw s THR 146 CO 0.01 -0.72 1.94 0.78 -2.21 0.00 0.00 174.62 174.42 1htw h ASN 147 N 2.85 0.80 -0.51 8.08 -0.26 -1.96 0.86 115.58 125.44 1htw h ASN 147 Ca -0.34 0.00 -0.12 0.00 -0.56 0.00 0.00 56.30 55.28 1htw h ASN 147 Cb 1.18 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 38.26 1htw h ASN 147 CO 0.59 0.52 -0.16 0.25 -1.06 0.00 0.00 177.43 177.57 1htw h LEU 148 N 0.91 1.02 -0.78 1.61 5.85 -1.96 -1.24 115.31 120.72 1htw h LEU 148 Ca 0.34 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1htw h LEU 148 Cb 0.18 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 1htw h LEU 148 CO -0.11 1.16 0.48 1.23 -0.34 0.00 0.00 178.44 180.86 1htw h GLY 149 N 0.87 1.15 1.57 3.75 0.00 -1.44 -2.06 103.07 106.90 1htw h GLY 149 Ca 0.12 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 1htw h GLY 149 CO 0.06 0.28 -0.38 0.50 0.00 0.00 0.00 176.54 177.00 1htw h LYS 150 N 0.92 0.48 -0.52 4.80 1.57 -0.17 -2.07 116.57 121.58 1htw h LYS 150 Ca 0.33 -0.23 -0.12 0.00 -1.87 0.00 0.00 60.65 58.76 1htw h LYS 150 Cb 0.08 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1htw h LYS 150 CO -0.14 0.79 -0.13 -0.91 -0.57 0.00 0.00 179.45 178.49 1htw h ASN 151 N 0.40 0.99 -0.69 0.86 2.35 -0.99 -0.90 115.58 117.60 1htw h ASN 151 Ca 0.04 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.42 1htw h ASN 151 Cb 0.84 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.91 1htw h ASN 151 CO 0.07 1.12 0.29 0.40 -1.65 0.00 0.00 177.43 177.66 1htw h ILE 152 N 0.87 1.24 -0.37 2.81 1.08 -1.05 -2.70 117.51 119.40 1htw h ILE 152 Ca 0.13 -0.74 -0.07 0.00 -0.39 0.00 0.00 64.86 63.79 1htw h ILE 152 Cb 0.69 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 34.86 1htw h ILE 152 CO 0.05 0.30 -0.05 0.40 -0.69 0.00 0.00 178.15 178.15 1htw h ILE 153 N 0.98 1.27 -0.57 -0.67 2.04 -1.23 -2.17 117.51 117.16 1htw h ILE 153 Ca 0.23 -1.10 0.11 0.00 1.00 0.00 0.00 64.86 65.11 1htw h ILE 153 Cb 0.19 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1htw h ILE 153 CO -0.02 0.36 0.39 -1.28 0.00 0.00 0.00 178.15 177.60 1htw h SER 154 N 0.48 0.27 0.64 1.72 0.87 -1.10 -1.41 113.55 115.01 1htw h SER 154 Ca 0.10 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1htw h SER 154 Cb 0.55 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1htw h SER 154 CO 0.03 0.15 -0.06 0.00 -0.53 0.00 0.00 176.83 176.42 1htw h ALA 155 N 1.71 1.08 0.00 6.23 0.00 -1.05 -2.62 119.26 124.61 1htw h ALA 155 Ca 0.27 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1htw h ALA 155 Cb 0.67 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1htw h ALA 155 CO -0.06 0.08 -0.22 0.74 0.00 0.00 0.00 179.25 179.79 1htw h PHE 156 N 0.00 0.00 -0.26 0.00 -1.00 -1.31 -3.10 116.94 111.28 1htw h PHE 156 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1htw h PHE 156 Cb 0.40 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.96 1htw h PHE 156 CO 0.00 0.22 0.00 0.43 -1.61 0.00 0.00 178.31 177.35 1htw n SER 157 N -3.41 3.41 -0.88 2.17 7.64 -1.00 -5.18 113.62 116.37 1htw n SER 157 Ca -0.00 -2.67 0.12 0.00 1.01 0.00 0.00 58.87 57.33 1htw n SER 157 Cb 0.42 -0.42 0.17 0.00 -1.01 0.00 0.00 64.21 63.37 1htw n SER 157 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57