#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1htw s GLU 2 N 0.00 1.63 0.10 0.03 2.02 -1.26 -4.65 118.70 116.56 1htw s GLU 2 Ca 0.00 1.23 0.02 0.00 0.02 0.00 0.00 54.97 56.24 1htw s GLU 2 Cb 0.00 -1.82 -0.04 0.00 0.10 0.00 0.00 34.13 32.37 1htw s GLU 2 CO 0.00 -2.10 -0.08 0.45 0.02 0.00 0.00 175.26 173.55 1htw s SER 3 N -3.14 1.24 -0.04 -0.19 0.15 -1.26 -2.21 113.70 108.25 1htw s SER 3 Ca 0.63 -0.96 0.03 0.00 0.70 0.00 0.00 55.95 56.36 1htw s SER 3 Cb -0.19 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 1htw s SER 3 CO 0.57 -0.41 -0.13 -0.22 1.20 0.00 0.00 173.24 174.25 1htw s LEU 4 N -2.90 1.81 -0.15 3.45 2.96 -0.41 -4.97 118.68 118.47 1htw s LEU 4 Ca 0.10 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1htw s LEU 4 Cb 0.03 -0.81 0.00 0.00 0.50 0.00 0.00 46.19 45.91 1htw s LEU 4 CO -0.03 0.10 -0.17 0.28 -1.32 0.00 0.00 176.35 175.21 1htw s THR 5 N 0.23 2.55 -0.07 3.68 -1.32 -1.26 -0.44 115.64 119.01 1htw s THR 5 Ca -0.06 -0.81 -0.01 0.00 -1.21 0.00 0.00 61.69 59.60 1htw s THR 5 Cb -0.12 -2.07 0.03 0.00 -1.51 0.00 0.00 72.50 68.84 1htw s THR 5 CO 0.02 0.52 0.00 -1.58 -2.21 0.00 0.00 174.62 171.37 1htw s GLN 6 N 0.81 0.59 0.14 7.08 2.00 0.06 -4.98 119.66 125.34 1htw s GLN 6 Ca -0.06 0.12 -0.30 0.00 -2.00 0.00 0.00 55.36 53.12 1htw s GLN 6 Cb -0.15 -0.96 -0.06 0.00 0.80 0.00 0.00 33.01 32.64 1htw s GLN 6 CO -0.00 -0.30 1.01 -0.47 -0.50 0.00 0.00 175.29 175.02 1htw s TYR 7 N 1.97 3.75 -0.44 1.67 5.04 -1.26 -0.53 117.35 127.56 1htw s TYR 7 Ca 0.05 1.74 0.03 0.00 -2.44 0.00 0.00 57.07 56.44 1htw s TYR 7 Cb -0.12 -3.12 0.12 0.00 0.35 0.00 0.00 41.96 39.19 1htw s TYR 7 CO -0.05 -0.05 0.20 0.42 -1.34 0.00 0.00 175.55 174.73 1htw s ILE 8 N -0.11 1.95 0.35 3.14 -1.09 0.12 -4.97 121.20 120.61 1htw s ILE 8 Ca 0.48 -2.69 0.35 0.00 -2.23 0.00 0.00 60.65 56.56 1htw s ILE 8 Cb -0.25 -2.39 0.38 0.00 -1.58 0.00 0.00 42.46 38.62 1htw s ILE 8 CO 0.31 -0.78 2.12 1.55 -1.23 0.00 0.00 174.94 176.91 1htw h PRO 9 N 6.94 0.00 -2.57 2.79 0.13 -1.90 0.12 132.00 137.51 1htw h PRO 9 Ca -0.06 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.21 1htw h PRO 9 Cb 0.94 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.01 1htw h PRO 9 CO 0.57 0.04 0.42 0.16 -0.23 0.00 0.00 178.00 178.96 1htw s ASP 10 N -5.66 -0.16 0.39 1.44 1.47 -1.26 -4.16 116.67 108.74 1htw s ASP 10 Ca -0.02 -0.55 0.07 0.00 1.18 0.00 0.00 52.55 53.23 1htw s ASP 10 Cb 0.11 0.58 0.82 0.00 -0.34 0.00 0.00 42.92 44.09 1htw s ASP 10 CO 0.52 -1.08 2.03 -0.08 0.68 0.00 0.00 175.17 177.23 1htw h GLU 11 N 2.00 0.61 -0.74 2.11 4.81 -1.90 -2.14 114.58 119.33 1htw h GLU 11 Ca -0.24 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 1htw h GLU 11 Cb 1.23 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 1htw h GLU 11 CO 0.27 0.40 0.40 0.74 -0.73 0.00 0.00 179.01 180.10 1htw h PHE 12 N 0.63 1.00 -0.04 0.92 0.04 -1.97 -0.91 116.94 116.61 1htw h PHE 12 Ca 0.21 -0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.86 1htw h PHE 12 Cb 0.05 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 37.87 1htw h PHE 12 CO -0.00 0.70 -0.43 0.77 -0.60 0.00 0.00 178.31 178.74 1htw h SER 13 N 1.03 0.10 -0.41 2.17 0.02 -1.80 -1.16 113.55 113.50 1htw h SER 13 Ca 0.26 -0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 61.07 1htw h SER 13 Cb 0.02 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1htw h SER 13 CO -0.04 0.52 -0.13 -0.03 -1.14 0.00 0.00 176.83 176.01 1htw h MET 14 N 0.08 0.81 -0.56 3.45 1.85 -0.74 -1.08 114.93 118.74 1htw h MET 14 Ca 0.00 -0.32 -0.11 0.00 -0.61 0.00 0.00 59.70 58.66 1htw h MET 14 Cb 0.80 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 32.77 1htw h MET 14 CO 0.06 0.95 -0.09 -0.07 -0.40 0.00 0.00 176.91 177.36 1htw h LEU 15 N 0.63 1.05 -0.74 3.39 3.38 -0.93 -0.25 115.31 121.83 1htw h LEU 15 Ca 0.10 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1htw h LEU 15 Cb 0.67 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1htw h LEU 15 CO 0.05 1.15 0.29 -0.09 0.09 0.00 0.00 178.44 179.93 1htw h ARG 16 N 0.94 1.11 -0.32 1.13 2.43 -1.17 -0.86 114.38 117.65 1htw h ARG 16 Ca 0.15 -0.20 -0.12 0.00 -0.81 0.00 0.00 59.98 58.99 1htw h ARG 16 Cb 0.66 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1htw h ARG 16 CO 0.05 0.91 -0.30 0.35 -1.51 0.00 0.00 179.97 179.47 1htw h PHE 17 N 1.07 0.78 -0.75 2.20 3.57 -1.02 -1.28 116.94 121.52 1htw h PHE 17 Ca 0.25 -0.19 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1htw h PHE 17 Cb 0.22 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 1htw h PHE 17 CO 0.02 0.89 0.34 0.78 -2.23 0.00 0.00 178.31 178.11 1htw h GLY 18 N 0.99 1.17 0.91 2.40 0.00 -0.47 -0.04 103.07 108.02 1htw h GLY 18 Ca 0.07 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1htw h GLY 18 CO 0.07 0.57 0.10 1.70 0.00 0.00 0.00 176.54 178.97 1htw h LYS 19 N 1.06 0.47 -0.54 4.80 3.64 -0.89 0.58 116.57 125.68 1htw h LYS 19 Ca 0.25 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1htw h LYS 19 Cb 0.15 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1htw h LYS 19 CO -0.03 0.51 0.24 -0.22 -2.27 0.00 0.00 179.45 177.68 1htw h LYS 20 N 0.33 0.80 -0.42 1.90 3.64 -0.82 -0.31 116.57 121.68 1htw h LYS 20 Ca 0.10 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1htw h LYS 20 Cb 0.24 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1htw h LYS 20 CO -0.00 0.68 0.16 0.35 -2.27 0.00 0.00 179.45 178.36 1htw h PHE 21 N 0.73 0.66 -0.31 1.91 3.57 -0.76 -1.71 116.94 121.02 1htw h PHE 21 Ca 0.18 -0.06 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 1htw h PHE 21 Cb 0.16 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1htw h PHE 21 CO 0.00 0.58 -0.27 0.00 -2.23 0.00 0.00 178.31 176.39 1htw h ALA 22 N 1.00 0.94 -0.86 2.41 0.00 -0.64 -1.75 119.26 120.36 1htw h ALA 22 Ca 0.14 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1htw h ALA 22 Cb 0.22 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1htw h ALA 22 CO -0.01 0.61 0.42 0.93 0.00 0.00 0.00 179.25 181.21 1htw h GLU 23 N 0.55 1.24 -0.39 0.00 4.39 -0.85 -0.00 114.58 119.52 1htw h GLU 23 Ca 0.07 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 1htw h GLU 23 Cb 0.75 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 1htw h GLU 23 CO 0.06 0.94 0.14 0.82 -1.16 0.00 0.00 179.01 179.81 1htw h ILE 24 N 1.23 1.21 -0.71 3.13 2.04 -0.85 -0.82 117.51 122.74 1htw h ILE 24 Ca 0.30 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1htw h ILE 24 Cb 0.10 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1htw h ILE 24 CO -0.04 0.24 0.38 -0.07 0.00 0.00 0.00 178.15 178.65 1htw h LEU 25 N 0.49 0.89 -0.32 1.44 3.38 -0.63 -1.86 115.31 118.69 1htw h LEU 25 Ca 0.13 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 1htw h LEU 25 Cb 0.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1htw h LEU 25 CO -0.01 0.72 -0.43 -0.07 0.09 0.00 0.00 178.44 178.75 1htw h LEU 26 N 1.00 0.93 -1.31 1.67 3.38 -0.60 -3.16 115.31 117.22 1htw h LEU 26 Ca 0.25 -0.50 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 1htw h LEU 26 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1htw h LEU 26 CO -0.04 1.25 -0.33 0.11 0.09 0.00 0.00 178.44 179.52 1htw h LYS 27 N 0.64 0.00 0.00 1.13 1.79 -0.75 -2.30 116.57 117.09 1htw h LYS 27 Ca 0.04 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.48 1htw h LYS 27 Cb 1.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1htw h LYS 27 CO 0.10 0.33 -0.13 -0.07 -1.08 0.00 0.00 179.45 178.60 1htw h LEU 28 N 0.00 0.00 -3.28 2.94 3.38 -1.31 -3.47 115.31 113.57 1htw h LEU 28 Ca -0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 1htw h LEU 28 Cb 0.65 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.45 1htw h LEU 28 CO 0.04 0.13 -0.95 1.57 0.09 0.00 0.00 178.44 179.32 1htw n HIS 29 N -3.65 -1.76 -3.05 1.13 -0.00 -0.87 -4.95 115.22 102.09 1htw n HIS 29 Ca -0.02 0.38 -0.31 0.00 0.46 0.00 0.00 57.72 58.23 1htw n HIS 29 Cb 0.25 -3.30 -0.05 0.00 -0.12 0.00 0.00 29.99 26.77 1htw n HIS 29 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1htw s THR 30 N -3.52 4.76 0.10 3.57 -4.23 -1.26 -4.97 115.64 110.08 1htw s THR 30 Ca 0.44 0.73 0.10 0.00 -1.18 0.00 0.00 61.69 61.79 1htw s THR 30 Cb -0.18 -3.67 -0.10 0.00 1.34 0.00 0.00 72.50 69.89 1htw s THR 30 CO 0.89 -0.33 1.40 -0.08 -0.54 0.00 0.00 174.62 175.97 1htw h GLU 31 N 1.82 0.00 -6.80 3.99 4.81 -1.95 -3.44 114.58 113.02 1htw h GLU 31 Ca -0.47 0.00 -0.49 0.00 -0.13 0.00 0.00 59.36 58.27 1htw h GLU 31 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1htw h GLU 31 CO 0.65 0.80 0.13 -1.59 -0.73 0.00 0.00 179.01 178.26 1htw s LYS 32 N -2.98 3.93 0.29 1.92 -2.85 -1.26 -3.19 119.74 115.60 1htw s LYS 32 Ca 0.01 0.63 -0.29 0.00 -1.00 0.00 0.00 55.97 55.32 1htw s LYS 32 Cb 0.10 -2.39 -0.10 0.00 -2.06 0.00 0.00 37.83 33.38 1htw s LYS 32 CO 0.79 0.06 1.26 0.00 0.10 0.00 0.00 175.35 177.56 1htw s ALA 33 N -2.16 3.49 -0.22 0.59 0.00 -1.05 -4.51 121.76 117.89 1htw s ALA 33 Ca 0.54 1.15 -0.19 0.00 0.00 0.00 0.00 51.96 53.46 1htw s ALA 33 Cb -0.10 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 1htw s ALA 33 CO 0.23 -0.51 0.53 0.42 0.00 0.00 0.00 175.76 176.43 1htw s ILE 34 N -0.85 5.08 -0.27 0.00 1.01 -0.40 -4.94 121.20 120.83 1htw s ILE 34 Ca 0.50 0.96 -0.13 0.00 0.00 0.00 0.00 60.65 61.98 1htw s ILE 34 Cb -0.37 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1htw s ILE 34 CO 0.47 0.14 0.27 -0.04 0.00 0.00 0.00 174.94 175.78 1htw s MET 35 N 1.89 4.00 -0.18 2.79 -1.94 -1.26 -0.51 119.30 124.08 1htw s MET 35 Ca 0.24 -0.15 0.01 0.00 -1.71 0.00 0.00 55.69 54.08 1htw s MET 35 Cb -0.15 -3.64 0.02 0.00 2.01 0.00 0.00 34.83 33.06 1htw s MET 35 CO 0.09 -0.19 -0.19 0.08 -0.01 0.00 0.00 175.02 174.80 1htw s VAL 36 N 1.81 1.99 -0.26 -6.03 1.01 -0.13 -0.66 120.40 118.13 1htw s VAL 36 Ca 0.11 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 61.05 1htw s VAL 36 Cb -0.16 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 1htw s VAL 36 CO 0.10 0.51 0.21 -0.31 0.00 0.00 0.00 175.10 175.61 1htw s TYR 37 N 1.31 3.26 -0.34 5.22 1.51 -0.79 -0.82 117.35 126.70 1htw s TYR 37 Ca 0.04 0.21 -0.12 0.00 -1.01 0.00 0.00 57.07 56.19 1htw s TYR 37 Cb -0.13 -2.37 -0.01 0.00 -0.11 0.00 0.00 41.96 39.33 1htw s TYR 37 CO -0.12 -0.09 0.22 -0.51 -1.11 0.00 0.00 175.55 173.94 1htw s LEU 38 N 1.56 4.48 0.13 -1.29 1.43 0.62 -0.55 118.68 125.06 1htw s LEU 38 Ca 0.09 -0.52 0.10 0.00 -1.03 0.00 0.00 54.13 52.77 1htw s LEU 38 Cb -0.15 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1htw s LEU 38 CO 0.09 -0.25 -0.25 0.20 0.23 0.00 0.00 176.35 176.37 1htw s ASN 39 N 1.68 3.46 0.00 2.29 0.01 0.19 -4.11 114.94 118.46 1htw s ASN 39 Ca 0.05 -0.70 0.00 0.00 -0.71 0.00 0.00 52.86 51.50 1htw s ASN 39 Cb -0.18 -0.30 0.00 0.00 0.41 0.00 0.00 41.25 41.18 1htw s ASN 39 CO 0.09 0.18 0.00 0.61 -1.51 0.00 0.00 177.10 176.47 1htw n GLY 40 N 0.88 4.18 3.60 0.66 0.00 -1.26 -1.35 105.19 111.90 1htw n GLY 40 Ca -0.17 -1.00 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 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 2.17 -0.00 1.61 1.01 -1.26 -4.86 116.67 115.33 1htw s ASP 41 Ca 0.00 1.72 -0.36 0.00 0.71 0.00 0.00 52.55 54.62 1htw s ASP 41 Cb 0.00 -2.35 -0.14 0.00 1.01 0.00 0.00 42.92 41.43 1htw s ASP 41 CO 0.00 -3.49 1.63 -0.11 0.21 0.00 0.00 175.17 173.40 1htw n LEU 42 N -4.46 2.69 0.00 1.23 7.94 -1.26 -1.10 117.00 122.04 1htw n LEU 42 Ca 0.07 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 1htw n LEU 42 Cb 0.54 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 43.19 1htw n LEU 42 CO 0.54 -0.45 0.00 0.61 -1.11 0.00 0.00 177.39 176.99 1htw n GLY 43 N 3.59 0.84 0.23 -3.96 0.00 -1.26 -4.94 105.19 99.69 1htw n GLY 43 Ca 0.21 0.00 0.05 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 1.72 0.00 4.61 0.00 -1.45 -3.46 119.26 120.68 1htw h ALA 44 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1htw h ALA 44 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1htw h ALA 44 CO 0.00 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.87 1htw n GLY 45 N -1.07 1.69 0.08 0.00 0.00 -1.26 -4.90 105.19 99.73 1htw n GLY 45 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 0.15 -0.23 1.61 1.57 -1.90 0.44 116.57 118.21 1htw h LYS 46 Ca 0.00 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1htw h LYS 46 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1htw h LYS 46 CO 0.00 0.32 -0.22 1.15 -0.57 0.00 0.00 179.45 180.13 1htw h THR 47 N -0.04 1.25 -0.31 -0.16 2.02 -1.99 -0.94 112.91 112.75 1htw h THR 47 Ca 0.03 -1.16 -0.11 0.00 0.77 0.00 0.00 66.41 65.94 1htw h THR 47 Cb 0.23 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1htw h THR 47 CO -0.00 0.37 -0.27 0.74 0.37 0.00 0.00 175.52 176.73 1htw h THR 48 N 0.38 1.27 -0.36 3.16 2.02 -1.92 0.56 112.91 118.03 1htw h THR 48 Ca 0.06 -1.35 -0.11 0.00 0.77 0.00 0.00 66.41 65.78 1htw h THR 48 Cb 0.60 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1htw h THR 48 CO 0.04 0.44 -0.21 0.25 0.37 0.00 0.00 175.52 176.41 1htw h LEU 49 N 0.54 0.81 -0.64 2.58 5.85 -0.65 -1.20 115.31 122.60 1htw h LEU 49 Ca 0.07 -0.42 0.05 0.00 0.84 0.00 0.00 57.88 58.42 1htw h LEU 49 Cb 0.74 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1htw h LEU 49 CO 0.06 1.06 0.36 0.74 -0.34 0.00 0.00 178.44 180.32 1htw h THR 50 N 0.57 1.00 -0.57 1.05 2.02 -0.93 -0.25 112.91 115.80 1htw h THR 50 Ca 0.08 -0.23 0.02 0.00 0.77 0.00 0.00 66.41 67.04 1htw h THR 50 Cb 0.77 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1htw h THR 50 CO 0.06 0.12 0.36 -0.09 0.37 0.00 0.00 175.52 176.34 1htw h ARG 51 N 0.68 0.70 -0.80 6.66 2.43 -0.54 0.22 114.38 123.73 1htw h ARG 51 Ca 0.28 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1htw h ARG 51 Cb 0.14 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 1htw h ARG 51 CO -0.16 0.46 0.37 0.78 -1.51 0.00 0.00 179.97 179.92 1htw h GLY 52 N 0.72 1.25 0.79 2.80 0.00 -0.47 0.27 103.07 108.42 1htw h GLY 52 Ca 0.22 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 1htw h GLY 52 CO -0.07 0.60 0.01 -0.33 0.00 0.00 0.00 176.54 176.74 1htw h MET 53 N 1.15 0.04 -0.02 4.80 2.86 -0.52 0.79 114.93 124.04 1htw h MET 53 Ca 0.28 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.82 1htw h MET 53 Cb 0.14 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 31.80 1htw h MET 53 CO -0.03 0.25 -0.34 -0.07 1.06 0.00 0.00 176.91 177.78 1htw h LEU 54 N -0.18 0.33 -1.12 1.22 3.38 -0.70 -2.42 115.31 115.83 1htw h LEU 54 Ca 0.01 -0.74 -0.09 0.00 0.09 0.00 0.00 57.88 57.15 1htw h LEU 54 Cb 0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1htw h LEU 54 CO 0.00 1.02 -0.44 1.56 0.09 0.00 0.00 178.44 180.67 1htw h GLN 55 N -0.33 0.00 -0.16 1.13 4.20 -1.08 -0.18 115.11 118.69 1htw h GLN 55 Ca -0.04 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 1htw h GLN 55 Cb 1.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 1htw h GLN 55 CO 0.07 0.44 -0.17 0.78 -0.67 0.00 0.00 178.83 179.27 1htw h GLY 56 N 1.34 0.29 -2.46 3.46 0.00 -0.69 -1.76 103.07 103.25 1htw h GLY 56 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1htw h GLY 56 CO 0.06 0.18 0.00 0.29 0.00 0.00 0.00 176.54 177.07 1htw n ILE 57 N -4.23 1.01 0.00 2.60 -5.35 -0.92 -4.95 119.36 107.53 1htw n ILE 57 Ca -0.01 -0.90 0.00 0.00 -0.27 0.00 0.00 62.75 61.58 1htw n ILE 57 Cb 0.31 0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 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 1.43 1.28 3.69 3.28 0.00 -0.66 -4.91 105.19 109.30 1htw n GLY 58 Ca 0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.13 2.55 -4.25 1.61 -0.00 -0.10 -4.95 115.22 109.94 1htw n HIS 59 Ca 0.00 0.02 -0.34 0.00 -0.00 0.00 0.00 57.72 57.40 1htw n HIS 59 Cb 0.00 -2.66 -0.14 0.00 -0.00 0.00 0.00 29.99 27.19 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 1.95 3.40 0.00 1.57 -0.21 -1.26 -4.32 119.66 120.79 1htw s GLN 60 Ca 0.80 -0.64 0.00 0.00 0.02 0.00 0.00 55.36 55.54 1htw s GLN 60 Cb -0.56 -2.86 0.00 0.00 1.00 0.00 0.00 33.01 30.59 1htw s GLN 60 CO 0.37 -0.02 0.00 0.41 -2.12 0.00 0.00 175.29 173.94 1htw n GLY 61 N 4.23 2.87 3.77 3.09 0.00 -1.26 -5.09 105.19 112.81 1htw n GLY 61 Ca -0.18 -1.95 -0.36 0.00 0.00 0.00 0.00 46.02 43.52 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 6.00 -0.54 1.61 0.02 -1.26 -4.98 114.94 115.79 1htw s ASN 62 Ca 0.00 2.24 -0.07 0.00 -1.02 0.00 0.00 52.86 54.01 1htw s ASN 62 Cb 0.00 -2.59 0.14 0.00 0.02 0.00 0.00 41.25 38.82 1htw s ASN 62 CO 0.00 -1.03 0.39 -0.69 0.02 0.00 0.00 177.10 175.79 1htw s VAL 63 N -1.64 4.09 -0.25 1.60 1.01 -1.26 -5.07 120.40 118.88 1htw s VAL 63 Ca 0.67 -2.18 -0.15 0.00 0.00 0.00 0.00 61.98 60.32 1htw s VAL 63 Cb -0.26 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1htw s VAL 63 CO 0.31 -0.81 0.37 -0.75 0.00 0.00 0.00 175.10 174.22 1htw s LYS 64 N 0.86 4.07 0.31 2.72 2.20 -1.26 -4.98 119.74 123.67 1htw s LYS 64 Ca 0.10 0.08 -0.29 0.00 -0.36 0.00 0.00 55.97 55.50 1htw s LYS 64 Cb -0.23 -3.61 -0.11 0.00 -1.51 0.00 0.00 37.83 32.38 1htw s LYS 64 CO -0.03 -0.18 1.47 0.45 -0.36 0.00 0.00 175.35 176.70 1htw s SER 65 N 1.41 6.51 -1.39 1.43 0.15 -1.26 -4.87 113.70 115.68 1htw s SER 65 Ca 0.16 2.86 -0.11 0.00 0.70 0.00 0.00 55.95 59.55 1htw s SER 65 Cb -0.15 -2.64 0.09 0.00 -1.71 0.00 0.00 66.02 61.60 1htw s SER 65 CO 0.09 -0.78 2.15 -0.81 1.20 0.00 0.00 173.24 175.09 1htw n PRO 66 N 1.48 3.33 -0.19 5.44 -0.04 -1.26 -4.79 135.00 138.97 1htw n PRO 66 Ca 0.04 -3.00 -0.00 0.00 -0.04 0.00 0.00 63.50 60.50 1htw n PRO 66 Cb 0.39 -3.07 0.10 0.00 -0.04 0.00 0.00 33.50 30.88 1htw n PRO 66 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1htw h THR 67 N 3.74 0.70 0.00 0.52 2.02 -1.89 0.24 112.91 118.24 1htw h THR 67 Ca 0.53 -0.10 -0.19 0.00 0.77 0.00 0.00 66.41 67.42 1htw h THR 67 Cb 0.59 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 1htw h THR 67 CO 1.75 0.05 -2.04 -1.22 0.37 0.00 0.00 175.52 174.44 1htw n TYR 68 N -5.09 0.00 0.17 3.16 4.01 -1.26 -4.42 117.16 113.74 1htw n TYR 68 Ca 0.08 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.93 1htw n TYR 68 Cb 0.29 -0.67 0.10 0.00 -0.31 0.00 0.00 39.34 38.74 1htw n TYR 68 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1htw h THR 69 N 0.00 0.08 0.00 -0.72 1.35 -1.93 -3.47 112.91 108.22 1htw h THR 69 Ca -0.28 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1htw h THR 69 Cb 1.57 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.87 1htw h THR 69 CO 0.02 0.04 0.00 0.18 -0.25 0.00 0.00 175.52 175.51 1htw n LEU 70 N -2.97 0.00 -3.91 3.87 4.32 0.84 -4.85 117.00 114.29 1htw n LEU 70 Ca 0.02 0.00 -0.16 0.00 -0.02 0.00 0.00 56.01 55.85 1htw n LEU 70 Cb 0.56 0.00 -0.15 0.00 -1.62 0.00 0.00 43.42 42.21 1htw n LEU 70 CO 0.37 0.00 -0.39 0.54 -1.22 0.00 0.00 177.39 176.68 1htw s VAL 71 N 0.00 0.34 -0.10 4.08 0.11 -1.26 -1.47 120.40 122.10 1htw s VAL 71 Ca 0.00 -0.12 0.03 0.00 -2.93 0.00 0.00 61.98 58.96 1htw s VAL 71 Cb 0.00 -0.33 -0.00 0.00 -1.53 0.00 0.00 36.38 34.51 1htw s VAL 71 CO 0.00 0.13 -0.21 -0.70 -3.33 0.00 0.00 175.10 170.98 1htw s GLU 72 N 0.30 3.07 -0.18 1.54 2.56 -0.16 -4.95 118.70 120.89 1htw s GLU 72 Ca -0.03 -0.83 -0.09 0.00 0.00 0.00 0.00 54.97 54.01 1htw s GLU 72 Cb -0.06 -2.36 -0.05 0.00 2.00 0.00 0.00 34.13 33.65 1htw s GLU 72 CO -0.00 0.21 0.13 -2.00 -0.56 0.00 0.00 175.26 173.04 1htw s GLU 73 N 0.28 4.01 -0.00 4.30 2.12 -1.26 -1.40 118.70 126.74 1htw s GLU 73 Ca -0.15 -0.21 0.06 0.00 0.36 0.00 0.00 54.97 55.03 1htw s GLU 73 Cb -0.17 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 1htw s GLU 73 CO 0.08 0.41 -0.18 0.71 -0.54 0.00 0.00 175.26 175.73 1htw s TYR 74 N 0.04 2.57 -0.34 5.30 1.51 0.49 -4.99 117.35 121.93 1htw s TYR 74 Ca 0.09 -0.25 0.03 0.00 -1.01 0.00 0.00 57.07 55.93 1htw s TYR 74 Cb -0.11 -1.53 0.10 0.00 -0.11 0.00 0.00 41.96 40.30 1htw s TYR 74 CO -0.01 0.18 0.05 1.21 -1.11 0.00 0.00 175.55 175.87 1htw s ASN 75 N -1.03 4.79 -0.43 2.29 3.84 -1.26 -0.93 114.94 122.20 1htw s ASN 75 Ca 0.13 -2.04 -0.07 0.00 0.21 0.00 0.00 52.86 51.09 1htw s ASN 75 Cb -0.10 -1.64 0.10 0.00 -0.55 0.00 0.00 41.25 39.05 1htw s ASN 75 CO 0.02 -0.37 0.26 -0.63 -2.79 0.00 0.00 177.10 173.59 1htw s ILE 76 N 0.96 3.86 -1.29 -5.21 -1.09 -0.28 -4.58 121.20 113.56 1htw s ILE 76 Ca 0.08 -1.76 -0.06 0.00 -2.23 0.00 0.00 60.65 56.68 1htw s ILE 76 Cb -0.20 -3.51 0.04 0.00 -1.58 0.00 0.00 42.46 37.21 1htw s ILE 76 CO -0.07 -0.65 0.40 0.00 -1.23 0.00 0.00 174.94 173.39 1htw n ALA 77 N 4.80 -0.98 0.00 9.38 0.00 -1.26 -1.38 120.51 131.06 1htw n ALA 77 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1htw n ALA 77 Cb 0.42 -2.72 0.00 0.00 0.00 0.00 0.00 19.45 17.15 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 -1.16 2.06 3.71 0.00 0.00 -1.26 -5.05 105.19 103.49 1htw n GLY 78 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1htw n GLY 78 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1htw s LYS 79 N -0.91 4.46 -0.17 1.61 2.47 -0.48 -5.04 119.74 121.68 1htw s LYS 79 Ca 0.00 1.02 -0.19 0.00 -1.56 0.00 0.00 55.97 55.24 1htw s LYS 79 Cb 0.00 -3.46 -0.03 0.00 -1.46 0.00 0.00 37.83 32.88 1htw s LYS 79 CO 0.00 0.01 0.54 -1.64 0.16 0.00 0.00 175.35 174.42 1htw s MET 80 N 0.95 4.24 -0.06 4.03 -1.94 -1.26 -1.12 119.30 124.14 1htw s MET 80 Ca 0.41 0.49 0.02 0.00 -1.71 0.00 0.00 55.69 54.90 1htw s MET 80 Cb -0.18 -3.53 0.01 0.00 2.01 0.00 0.00 34.83 33.14 1htw s MET 80 CO 0.20 -0.09 -0.11 0.42 -0.01 0.00 0.00 175.02 175.43 1htw s ILE 81 N 1.42 1.05 -0.18 2.53 1.01 -0.11 -2.01 121.20 124.92 1htw s ILE 81 Ca 0.26 -0.44 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 1htw s ILE 81 Cb -0.16 -0.97 0.00 0.00 0.01 0.00 0.00 42.46 41.35 1htw s ILE 81 CO 0.10 0.34 -0.14 -0.31 0.00 0.00 0.00 174.94 174.93 1htw s TYR 82 N 0.64 2.82 -0.23 3.97 2.02 0.09 -0.38 117.35 126.28 1htw s TYR 82 Ca -0.13 -1.16 -0.08 0.00 -0.37 0.00 0.00 57.07 55.33 1htw s TYR 82 Cb -0.15 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.43 1htw s TYR 82 CO 0.03 -0.57 0.08 -1.58 -1.57 0.00 0.00 175.55 171.95 1htw s HIS 83 N 1.08 3.16 -0.08 2.71 5.65 -0.50 -0.13 115.29 127.17 1htw s HIS 83 Ca -0.00 -0.17 0.02 0.00 0.25 0.00 0.00 55.06 55.16 1htw s HIS 83 Cb -0.14 -2.20 -0.02 0.00 -1.18 0.00 0.00 32.58 29.03 1htw s HIS 83 CO -0.04 -0.15 -0.14 -0.06 -0.65 0.00 0.00 174.74 173.70 1htw s PHE 84 N 1.21 2.74 -0.27 3.88 0.40 0.88 -0.99 117.98 125.83 1htw s PHE 84 Ca 0.05 -0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1htw s PHE 84 Cb -0.14 -1.71 0.08 0.00 0.51 0.00 0.00 43.02 41.75 1htw s PHE 84 CO 0.04 0.03 -0.00 0.34 0.70 0.00 0.00 175.22 176.32 1htw s ASP 85 N -0.31 4.12 0.00 1.36 -1.08 -0.54 -0.45 116.67 119.78 1htw s ASP 85 Ca 0.03 -1.50 0.16 0.00 -0.52 0.00 0.00 52.55 50.71 1htw s ASP 85 Cb -0.13 -1.24 0.46 0.00 -1.46 0.00 0.00 42.92 40.56 1htw s ASP 85 CO 0.03 -0.30 1.38 0.18 0.52 0.00 0.00 175.17 176.97 1htw n LEU 86 N 4.60 2.50 -0.34 -1.34 4.77 -0.80 -4.38 117.00 122.01 1htw n LEU 86 Ca -0.06 -1.22 0.12 0.00 -0.03 0.00 0.00 56.01 54.82 1htw n LEU 86 Cb 0.43 -0.29 0.31 0.00 -2.33 0.00 0.00 43.42 41.54 1htw n LEU 86 CO 0.18 0.61 1.17 0.22 -1.33 0.00 0.00 177.39 178.23 1htw h TYR 87 N 2.83 0.99 -0.64 -1.77 3.20 -1.83 0.27 116.97 120.03 1htw h TYR 87 Ca 0.00 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.76 1htw h TYR 87 Cb 0.64 -0.29 -0.09 0.00 1.54 0.00 0.00 36.73 38.53 1htw h TYR 87 CO 0.29 0.19 0.18 0.54 -1.64 0.00 0.00 178.16 177.73 1htw n ARG 88 N -4.81 3.77 -2.62 1.82 1.74 -1.26 -4.81 116.66 110.48 1htw n ARG 88 Ca 0.23 -2.79 -0.41 0.00 -0.77 0.00 0.00 57.85 54.10 1htw n ARG 88 Cb 0.57 -2.15 -0.03 0.00 -1.02 0.00 0.00 32.46 29.83 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 -2.63 3.52 0.17 0.55 2.96 0.08 -4.88 118.68 118.46 1htw s LEU 89 Ca 0.50 -0.83 -0.22 0.00 -0.22 0.00 0.00 54.13 53.36 1htw s LEU 89 Cb 0.39 -2.53 0.08 0.00 0.50 0.00 0.00 46.19 44.63 1htw s LEU 89 CO 0.13 -1.67 1.60 0.00 -1.32 0.00 0.00 176.35 175.09 1htw h ALA 90 N 9.85 -0.11 -3.41 5.97 0.00 -1.87 -3.42 119.26 126.27 1htw h ALA 90 Ca -0.15 0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 1htw h ALA 90 Cb 1.04 0.69 -0.26 0.00 0.00 0.00 0.00 17.79 19.26 1htw h ALA 90 CO 1.29 -0.69 -0.59 0.16 0.00 0.00 0.00 179.25 179.42 1htw s ASP 91 N -5.10 -0.10 0.53 0.00 -4.77 -1.26 -5.03 116.67 100.94 1htw s ASP 91 Ca -0.15 0.17 0.28 0.00 -3.30 0.00 0.00 52.55 49.55 1htw s ASP 91 Cb 0.14 0.22 1.42 0.00 -1.09 0.00 0.00 42.92 43.62 1htw s ASP 91 CO 0.68 -0.07 1.95 1.55 0.70 0.00 0.00 175.17 179.99 1htw h PRO 92 N 5.83 0.01 -1.00 2.11 0.13 -1.82 -1.45 132.00 135.80 1htw h PRO 92 Ca -0.25 -0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.11 1htw h PRO 92 Cb 1.20 -0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 1htw h PRO 92 CO 0.44 0.01 0.60 1.49 -0.23 0.00 0.00 178.00 180.30 1htw h GLU 93 N 0.01 0.61 -0.02 0.86 4.81 -1.93 0.90 114.58 119.83 1htw h GLU 93 Ca 0.32 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.52 1htw h GLU 93 Cb 1.28 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1htw h GLU 93 CO -0.01 0.41 0.10 0.93 -0.73 0.00 0.00 179.01 179.71 1htw h GLU 94 N 0.63 0.00 -0.37 1.92 4.39 -1.69 -2.42 114.58 117.04 1htw h GLU 94 Ca 0.63 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.28 1htw h GLU 94 Cb 1.14 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 1htw h GLU 94 CO -0.45 0.00 0.07 -0.07 -1.16 0.00 0.00 179.01 177.40 1htw h LEU 95 N 0.00 0.58 -1.36 1.33 3.38 -1.00 -2.77 115.31 115.46 1htw h LEU 95 Ca 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1htw h LEU 95 Cb 0.20 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1htw h LEU 95 CO -0.00 0.69 0.00 1.21 0.09 0.00 0.00 178.44 180.43 1htw n GLU 96 N -4.56 0.14 -0.05 1.13 2.13 -0.91 -3.21 120.64 115.31 1htw n GLU 96 Ca -0.01 0.62 -0.02 0.00 0.66 0.00 0.00 57.16 58.41 1htw n GLU 96 Cb 0.22 -1.94 -0.01 0.00 0.27 0.00 0.00 31.44 29.98 1htw n GLU 96 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 1htw h PHE 97 N 0.00 0.00 -2.40 4.31 0.04 -1.64 -3.46 116.94 113.79 1htw h PHE 97 Ca 0.00 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.47 1htw h PHE 97 Cb 0.02 0.00 0.17 0.00 2.20 0.00 0.00 35.95 38.34 1htw h PHE 97 CO 0.00 0.00 -0.26 -1.33 -0.60 0.00 0.00 178.31 176.12 1htw n MET 98 N -4.16 -3.23 0.00 1.51 0.00 -1.18 -4.80 117.12 105.27 1htw n MET 98 Ca -0.03 -0.95 0.02 0.00 0.00 0.00 0.00 57.70 56.74 1htw n MET 98 Cb 0.11 -1.69 0.12 0.00 0.00 0.00 0.00 33.22 31.76 1htw n MET 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1htw n GLY 99 N 2.14 -0.44 0.32 3.03 0.00 -1.26 -4.27 105.19 104.71 1htw n GLY 99 Ca 0.08 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1htw n GLY 99 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1htw n ILE 100 N -0.64 -0.38 0.00 -0.61 -0.00 -1.26 -3.26 119.36 113.22 1htw n ILE 100 Ca 0.03 2.04 0.00 0.00 -0.00 0.00 0.00 62.75 64.82 1htw n ILE 100 Cb 0.01 -2.83 0.00 0.00 -0.00 0.00 0.00 39.64 36.82 1htw n ILE 100 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1htw n ARG 101 N -5.45 0.00 0.11 0.38 1.74 -1.26 0.23 116.66 112.42 1htw n ARG 101 Ca 0.15 0.06 0.18 0.00 -0.77 0.00 0.00 57.85 57.47 1htw n ARG 101 Cb 0.46 -0.14 0.75 0.00 -1.02 0.00 0.00 32.46 32.50 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 -0.22 0.55 3.32 -1.94 -2.31 116.42 115.82 1htw h ASP 102 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 1htw h ASP 102 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1htw h ASP 102 CO 0.00 0.00 -0.10 1.88 -1.72 0.00 0.00 179.24 179.30 1htw h TYR 103 N 0.00 0.65 -0.00 4.55 0.05 -0.36 -2.62 116.97 119.24 1htw h TYR 103 Ca 0.16 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1htw h TYR 103 Cb 0.75 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.32 1htw h TYR 103 CO 0.00 0.68 -0.35 1.19 -1.05 0.00 0.00 178.16 178.63 1htw n PHE 104 N -4.20 0.00 -0.81 4.88 3.72 -0.88 -4.11 117.46 116.06 1htw n PHE 104 Ca 0.01 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.49 1htw n PHE 104 Cb 0.33 -0.23 0.27 0.00 -0.94 0.00 0.00 39.48 38.91 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 -1.23 4.09 -4.00 4.37 4.13 -0.99 -4.40 115.26 117.22 1htw n ASN 105 Ca 0.08 -2.79 -0.23 0.00 1.68 0.00 0.00 54.58 53.33 1htw n ASN 105 Cb 0.33 -0.52 -0.09 0.00 -1.54 0.00 0.00 39.78 37.97 1htw n ASN 105 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1htw s THR 106 N -2.43 0.48 -1.50 3.41 -1.32 -1.17 -4.97 115.64 108.14 1htw s THR 106 Ca 0.42 -2.00 -0.08 0.00 -1.21 0.00 0.00 61.69 58.82 1htw s THR 106 Cb 0.32 -2.44 -0.00 0.00 -1.51 0.00 0.00 72.50 68.86 1htw s THR 106 CO 0.13 0.00 2.72 -0.90 -2.21 0.00 0.00 174.62 174.36 1htw n ASP 107 N -1.20 8.44 -4.99 8.08 5.75 -1.19 -2.53 116.55 128.90 1htw n ASP 107 Ca -0.02 -2.81 -0.22 0.00 -0.01 0.00 0.00 54.79 51.73 1htw n ASP 107 Cb 0.65 -1.48 0.04 0.00 -1.03 0.00 0.00 41.12 39.30 1htw n ASP 107 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1htw s SER 108 N 1.45 4.90 -0.05 -1.12 1.04 -1.26 -4.59 113.70 114.06 1htw s SER 108 Ca 0.63 -1.03 0.04 0.00 0.48 0.00 0.00 55.95 56.08 1htw s SER 108 Cb 0.18 0.41 -0.00 0.00 0.10 0.00 0.00 66.02 66.71 1htw s SER 108 CO -0.07 -1.29 -0.18 -0.63 0.98 0.00 0.00 173.24 172.05 1htw s ILE 109 N -2.73 1.49 -0.09 -1.02 1.01 -0.85 -1.28 121.20 117.73 1htw s ILE 109 Ca 0.51 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.48 1htw s ILE 109 Cb -0.04 -1.29 -0.00 0.00 0.01 0.00 0.00 42.46 41.14 1htw s ILE 109 CO 0.32 0.43 -0.23 0.00 0.00 0.00 0.00 174.94 175.46 1htw s LEU 111 N 0.27 2.34 -0.18 0.00 1.43 0.81 -0.95 118.68 122.41 1htw s LEU 111 Ca -0.16 -0.79 0.01 0.00 -1.03 0.00 0.00 54.13 52.16 1htw s LEU 111 Cb -0.17 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.63 1htw s LEU 111 CO 0.08 -0.05 -0.20 -0.63 0.23 0.00 0.00 176.35 175.77 1htw s ILE 112 N 1.28 2.03 -0.11 -0.59 1.01 0.00 -0.08 121.20 124.73 1htw s ILE 112 Ca 0.02 -0.92 -0.07 0.00 0.00 0.00 0.00 60.65 59.67 1htw s ILE 112 Cb -0.15 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 1htw s ILE 112 CO -0.11 0.54 0.15 -1.61 0.00 0.00 0.00 174.94 173.91 1htw s GLU 113 N 1.27 3.48 -1.14 2.79 2.02 0.41 -0.27 118.70 127.25 1htw s GLU 113 Ca 0.04 -0.10 -0.03 0.00 0.02 0.00 0.00 54.97 54.90 1htw s GLU 113 Cb -0.13 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 30.91 1htw s GLU 113 CO -0.12 0.77 0.97 0.91 0.02 0.00 0.00 175.26 177.81 1htw n TRP 114 N 1.99 -2.21 0.28 1.61 7.02 -1.26 -1.90 117.44 122.97 1htw n TRP 114 Ca -0.20 0.88 0.15 0.00 -1.02 0.00 0.00 57.50 57.32 1htw n TRP 114 Cb 0.55 -4.79 0.80 0.00 -2.42 0.00 0.00 31.31 25.45 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 -1.98 0.00 -0.88 -0.99 4.64 -1.86 -2.10 113.55 110.38 1htw h SER 115 Ca -0.53 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 60.91 1htw h SER 115 Cb 1.32 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.34 1htw h SER 115 CO 0.47 0.08 0.57 -0.33 -0.87 0.00 0.00 176.83 176.75 1htw h GLU 116 N 0.00 0.76 0.00 4.77 3.07 -1.97 -0.67 114.58 120.54 1htw h GLU 116 Ca -0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1htw h GLU 116 Cb 0.30 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1htw h GLU 116 CO 0.01 0.50 0.00 0.87 -1.40 0.00 0.00 179.01 178.99 1htw h LYS 117 N 0.78 0.00 -0.56 2.33 1.79 -1.69 -2.45 116.57 116.77 1htw h LYS 117 Ca 0.43 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 1htw h LYS 117 Cb 0.56 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1htw h LYS 117 CO -0.19 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.59 1htw n GLY 118 N -0.96 2.28 3.60 3.86 0.00 -0.26 -3.74 105.19 109.95 1htw n GLY 118 Ca -0.03 -0.69 -0.52 0.00 0.00 0.00 0.00 46.02 44.78 1htw n GLY 118 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1htw n GLN 119 N 1.39 1.23 0.00 1.61 7.27 -0.92 -1.51 117.38 126.45 1htw n GLN 119 Ca 0.20 0.44 0.00 0.00 0.07 0.00 0.00 57.00 57.72 1htw n GLN 119 Cb 0.57 -2.10 0.00 0.00 2.41 0.00 0.00 30.24 31.13 1htw n GLN 119 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1htw n GLY 120 N 2.61 2.85 0.12 1.69 0.00 -1.26 -4.76 105.19 106.43 1htw n GLY 120 Ca 0.18 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 1.11 -3.79 -0.61 1.08 -1.65 -3.46 117.51 110.19 1htw h ILE 121 Ca 0.00 -2.40 -0.53 0.00 -0.39 0.00 0.00 64.86 61.54 1htw h ILE 121 Cb 0.00 2.77 0.07 0.00 -3.07 0.00 0.00 36.82 36.59 1htw h ILE 121 CO 0.00 0.68 0.70 -0.76 -0.69 0.00 0.00 178.15 178.07 1htw s LEU 122 N -7.63 4.39 0.64 1.44 1.43 -0.57 -4.97 118.68 113.41 1htw s LEU 122 Ca -0.20 2.77 -0.18 0.00 -1.03 0.00 0.00 54.13 55.49 1htw s LEU 122 Cb 0.04 -3.65 -0.01 0.00 0.03 0.00 0.00 46.19 42.60 1htw s LEU 122 CO 0.76 -0.65 1.27 -2.84 0.23 0.00 0.00 176.35 175.12 1htw s PRO 123 N -1.57 2.63 0.65 1.29 0.02 -1.26 -4.92 135.00 131.84 1htw s PRO 123 Ca 0.52 1.98 -0.18 0.00 0.02 0.00 0.00 61.00 63.34 1htw s PRO 123 Cb -0.42 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.23 1htw s PRO 123 CO 0.53 -1.52 1.24 -2.00 -0.33 0.00 0.00 177.00 174.93 1htw s GLU 124 N -3.41 2.60 0.46 5.54 2.12 -1.26 -4.96 118.70 119.79 1htw s GLU 124 Ca 0.81 1.91 -0.22 0.00 0.36 0.00 0.00 54.97 57.83 1htw s GLU 124 Cb -0.35 -1.87 -0.08 0.00 0.26 0.00 0.00 34.13 32.09 1htw s GLU 124 CO 0.38 -1.52 1.07 0.00 -0.54 0.00 0.00 175.26 174.66 1htw s ALA 125 N -1.60 2.95 -0.02 6.30 0.00 -1.26 -4.75 121.76 123.38 1htw s ALA 125 Ca 0.79 0.71 0.02 0.00 0.00 0.00 0.00 51.96 53.48 1htw s ALA 125 Cb -0.33 -3.29 -0.25 0.00 0.00 0.00 0.00 23.12 19.24 1htw s ALA 125 CO 0.39 -0.37 0.77 -0.44 0.00 0.00 0.00 175.76 176.10 1htw h ASP 126 N 1.94 0.24 -3.72 0.00 3.32 -1.26 -3.39 116.42 113.55 1htw h ASP 126 Ca -0.49 -0.39 -0.16 0.00 0.02 0.00 0.00 57.03 56.01 1htw h ASP 126 Cb 1.23 -0.08 -0.26 0.00 0.22 0.00 0.00 39.33 40.44 1htw h ASP 126 CO 0.60 1.33 -0.39 -0.51 -1.72 0.00 0.00 179.24 178.56 1htw s ILE 127 N -2.61 -0.01 -0.12 0.35 2.07 -1.10 -0.81 121.20 118.97 1htw s ILE 127 Ca -0.09 0.03 -0.08 0.00 -1.41 0.00 0.00 60.65 59.10 1htw s ILE 127 Cb 0.07 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.20 1htw s ILE 127 CO 0.83 0.01 0.17 -0.76 -1.91 0.00 0.00 174.94 173.28 1htw s LEU 128 N 0.42 4.38 -0.29 8.50 1.43 0.08 -1.89 118.68 131.31 1htw s LEU 128 Ca -0.02 0.49 0.01 0.00 -1.03 0.00 0.00 54.13 53.58 1htw s LEU 128 Cb -0.04 -2.12 0.06 0.00 0.03 0.00 0.00 46.19 44.12 1htw s LEU 128 CO -0.02 0.37 -0.04 -0.69 0.23 0.00 0.00 176.35 176.21 1htw s VAL 129 N -0.86 2.53 -0.31 -1.59 1.01 0.28 -1.34 120.40 120.12 1htw s VAL 129 Ca 0.15 -1.66 -0.10 0.00 0.00 0.00 0.00 61.98 60.38 1htw s VAL 129 Cb -0.12 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 1htw s VAL 129 CO 0.04 -0.16 0.16 0.20 0.00 0.00 0.00 175.10 175.34 1htw s ASN 130 N 1.17 5.58 -0.22 3.32 0.01 0.78 -0.64 114.94 124.94 1htw s ASN 130 Ca -0.04 -0.50 -0.09 0.00 -0.71 0.00 0.00 52.86 51.52 1htw s ASN 130 Cb -0.20 -2.01 -0.04 0.00 0.41 0.00 0.00 41.25 39.40 1htw s ASN 130 CO -0.04 -0.19 0.12 -0.63 -1.51 0.00 0.00 177.10 174.85 1htw s ILE 131 N 1.62 5.06 0.27 0.60 1.01 -0.45 -0.94 121.20 128.37 1htw s ILE 131 Ca 0.05 0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.86 1htw s ILE 131 Cb -0.17 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 1htw s ILE 131 CO 0.07 0.38 0.06 -0.62 0.00 0.00 0.00 174.94 174.83 1htw s ASP 132 N 0.89 4.77 0.07 3.58 2.15 0.28 -4.47 116.67 123.94 1htw s ASP 132 Ca 0.06 -0.58 -0.09 0.00 0.43 0.00 0.00 52.55 52.37 1htw s ASP 132 Cb -0.13 -0.95 -0.00 0.00 -0.30 0.00 0.00 42.92 41.54 1htw s ASP 132 CO 0.03 -0.05 0.18 -0.72 -0.17 0.00 0.00 175.17 174.44 1htw s TYR 133 N -2.30 0.14 -0.28 -5.34 1.13 -1.26 -1.59 117.35 107.85 1htw s TYR 133 Ca 0.33 -0.51 -0.03 0.00 -1.41 0.00 0.00 57.07 55.45 1htw s TYR 133 Cb -0.06 -0.06 0.16 0.00 -1.10 0.00 0.00 41.96 40.89 1htw s TYR 133 CO 0.21 -0.50 0.53 -0.47 -2.51 0.00 0.00 175.55 172.81 1htw s TYR 134 N -3.46 -1.30 0.00 -3.49 6.14 -0.63 -4.99 117.35 109.63 1htw s TYR 134 Ca 0.02 1.52 0.00 0.00 0.64 0.00 0.00 57.07 59.25 1htw s TYR 134 Cb 0.03 0.42 0.00 0.00 0.42 0.00 0.00 41.96 42.83 1htw s TYR 134 CO -0.09 -0.78 0.00 -0.25 0.64 0.00 0.00 175.55 175.07 1htw n ASP 135 N 5.41 0.00 -1.41 4.32 8.00 -1.26 -1.20 116.55 130.42 1htw n ASP 135 Ca -0.04 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.56 1htw n ASP 135 Cb 0.50 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 41.93 1htw n ASP 135 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1htw n ASP 136 N 5.59 4.45 -4.82 -2.24 8.00 -1.26 -4.93 116.55 121.33 1htw n ASP 136 Ca 0.00 -2.42 -0.22 0.00 0.71 0.00 0.00 54.79 52.86 1htw n ASP 136 Cb 0.00 -0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 40.52 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 -1.79 3.59 0.15 2.24 0.00 -0.34 -4.03 121.76 121.57 1htw s ALA 137 Ca 0.47 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 1htw s ALA 137 Cb 0.30 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.09 1htw s ALA 137 CO 0.23 0.25 0.07 1.03 0.00 0.00 0.00 175.76 177.33 1htw s ARG 138 N -3.84 1.00 -0.04 0.00 1.81 0.42 -1.61 118.95 116.69 1htw s ARG 138 Ca 0.33 -1.49 -0.02 0.00 -1.72 0.00 0.00 55.73 52.83 1htw s ARG 138 Cb -0.08 0.22 0.03 0.00 -0.45 0.00 0.00 34.95 34.68 1htw s ARG 138 CO 0.25 -0.28 0.09 1.21 -0.68 0.00 0.00 175.30 175.88 1htw s ASN 139 N -3.08 -0.03 -0.06 0.23 2.47 -0.62 -0.70 114.94 113.15 1htw s ASN 139 Ca 0.28 0.17 0.04 0.00 0.42 0.00 0.00 52.86 53.76 1htw s ASN 139 Cb 0.07 0.07 -0.02 0.00 -1.45 0.00 0.00 41.25 39.92 1htw s ASN 139 CO 0.04 -0.13 -0.16 -0.63 -3.72 0.00 0.00 177.10 172.50 1htw s ILE 140 N 1.04 2.85 -0.18 -5.21 1.01 0.31 -0.56 121.20 120.46 1htw s ILE 140 Ca -0.08 -0.79 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1htw s ILE 140 Cb -0.11 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 1htw s ILE 140 CO -0.04 0.58 -0.05 -1.83 0.00 0.00 0.00 174.94 173.59 1htw s GLU 141 N -0.49 3.50 -0.17 2.79 -1.05 -0.12 -0.76 118.70 122.40 1htw s GLU 141 Ca 0.06 -0.59 -0.08 0.00 -0.15 0.00 0.00 54.97 54.22 1htw s GLU 141 Cb -0.12 -2.92 -0.04 0.00 -0.44 0.00 0.00 34.13 30.61 1htw s GLU 141 CO 0.01 0.04 0.08 -0.51 0.95 0.00 0.00 175.26 175.84 1htw s LEU 142 N 0.86 3.98 -0.13 1.83 1.43 0.42 -0.16 118.68 126.91 1htw s LEU 142 Ca -0.01 0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1htw s LEU 142 Cb -0.15 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.09 1htw s LEU 142 CO 0.01 0.23 -0.14 -0.63 0.23 0.00 0.00 176.35 176.05 1htw s ILE 143 N 0.05 1.51 0.23 -0.59 1.01 -0.45 -1.29 121.20 121.67 1htw s ILE 143 Ca 0.07 -0.62 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 1htw s ILE 143 Cb -0.12 -1.40 -0.09 0.00 0.01 0.00 0.00 42.46 40.86 1htw s ILE 143 CO 0.00 0.45 0.93 0.00 0.00 0.00 0.00 174.94 176.32 1htw s ALA 144 N 1.23 3.35 -0.02 9.38 0.00 -0.94 -0.74 121.76 134.02 1htw s ALA 144 Ca -0.01 0.60 0.05 0.00 0.00 0.00 0.00 51.96 52.60 1htw s ALA 144 Cb -0.14 -3.19 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 1htw s ALA 144 CO -0.06 0.21 0.09 0.94 0.00 0.00 0.00 175.76 176.95 1htw n GLN 145 N 1.51 1.06 -4.62 0.00 -0.06 0.01 0.12 117.38 115.40 1htw n GLN 145 Ca -0.02 -0.04 -0.29 0.00 -2.00 0.00 0.00 57.00 54.65 1htw n GLN 145 Cb 0.47 -1.14 -0.08 0.00 -4.06 0.00 0.00 30.24 25.43 1htw n GLN 145 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1htw s THR 146 N -2.32 0.99 0.27 1.69 -4.23 -1.20 -4.89 115.64 105.95 1htw s THR 146 Ca -0.02 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.45 1htw s THR 146 Cb 0.03 -2.36 0.26 0.00 1.34 0.00 0.00 72.50 71.77 1htw s THR 146 CO 0.23 0.00 1.94 -1.13 -0.54 0.00 0.00 174.62 175.12 1htw h ASN 147 N 1.63 1.05 -0.76 3.99 -1.24 -1.97 -0.54 115.58 117.73 1htw h ASN 147 Ca -0.40 -0.04 -0.05 0.00 0.71 0.00 0.00 56.30 56.53 1htw h ASN 147 Cb 1.29 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 40.04 1htw h ASN 147 CO 0.67 0.77 0.29 0.25 -1.29 0.00 0.00 177.43 178.12 1htw h LEU 148 N 1.23 1.06 -0.66 0.34 5.85 -1.96 -1.75 115.31 119.42 1htw h LEU 148 Ca 0.33 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.93 1htw h LEU 148 Cb -0.12 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.57 1htw h LEU 148 CO -0.07 0.96 0.36 1.23 -0.34 0.00 0.00 178.44 180.58 1htw h GLY 149 N 1.11 0.97 0.65 3.75 0.00 -1.33 0.49 103.07 108.71 1htw h GLY 149 Ca 0.25 -0.25 0.07 0.00 0.00 0.00 0.00 47.33 47.41 1htw h GLY 149 CO -0.02 0.14 0.48 1.70 0.00 0.00 0.00 176.54 178.84 1htw h LYS 150 N 0.66 0.84 -0.39 4.80 3.64 -0.56 -0.85 116.57 124.70 1htw h LYS 150 Ca 0.30 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.57 1htw h LYS 150 Cb 0.21 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1htw h LYS 150 CO -0.20 0.55 -0.03 -0.91 -2.27 0.00 0.00 179.45 176.59 1htw h ASN 151 N 0.86 0.61 -0.29 4.20 2.35 -0.43 -1.03 115.58 121.85 1htw h ASN 151 Ca 0.37 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 1htw h ASN 151 Cb 0.23 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1htw h ASN 151 CO -0.20 0.70 0.07 0.40 -1.65 0.00 0.00 177.43 176.76 1htw h ILE 152 N 0.60 1.21 -0.40 2.81 2.04 -0.29 -2.22 117.51 121.25 1htw h ILE 152 Ca 0.12 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.19 1htw h ILE 152 Cb 0.43 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1htw h ILE 152 CO 0.02 0.23 -0.10 0.40 0.00 0.00 0.00 178.15 178.70 1htw h ILE 153 N 0.30 1.25 0.00 -0.67 2.04 -0.92 -2.20 117.51 117.32 1htw h ILE 153 Ca 0.09 -1.11 -0.05 0.00 1.00 0.00 0.00 64.86 64.79 1htw h ILE 153 Cb 0.28 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1htw h ILE 153 CO 0.00 0.38 -0.23 0.77 0.00 0.00 0.00 178.15 179.07 1htw h SER 154 N 0.64 0.00 0.79 1.72 4.64 -1.07 -1.92 113.55 118.36 1htw h SER 154 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1htw h SER 154 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1htw h SER 154 CO 0.03 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.22 1htw h ALA 155 N 1.77 1.00 0.00 5.18 0.00 -0.76 -2.86 119.26 123.59 1htw h ALA 155 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1htw h ALA 155 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1htw h ALA 155 CO 0.03 0.00 0.00 0.74 0.00 0.00 0.00 179.25 180.02 1htw h PHE 156 N 0.00 0.00 -2.79 0.00 0.04 -1.39 -3.46 116.94 109.34 1htw h PHE 156 Ca 0.00 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 60.39 1htw h PHE 156 Cb 0.40 0.00 0.21 0.00 2.20 0.00 0.00 35.95 38.76 1htw h PHE 156 CO 0.00 0.00 -0.24 0.43 -0.60 0.00 0.00 178.31 177.90 1htw n SER 157 N -2.41 -3.11 -0.44 2.17 7.64 -1.08 -5.18 113.62 111.22 1htw n SER 157 Ca 0.02 -0.52 0.05 0.00 1.01 0.00 0.00 58.87 59.44 1htw n SER 157 Cb 0.28 -1.05 0.05 0.00 -1.01 0.00 0.00 64.21 62.48 1htw n SER 157 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83