#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pd2 s PRO 2 N 0.00 2.99 -0.05 0.03 0.04 -1.26 -5.04 135.00 131.72 1pd2 s PRO 2 Ca 0.00 0.52 -0.19 0.00 0.04 0.00 0.00 61.00 61.37 1pd2 s PRO 2 Cb 0.00 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 1pd2 s PRO 2 CO 0.00 -0.95 0.53 1.21 0.04 0.00 0.00 177.00 177.83 1pd2 s ASN 3 N -4.32 6.85 0.01 6.66 2.47 -1.26 -4.93 114.94 120.41 1pd2 s ASN 3 Ca 0.58 1.01 0.08 0.00 0.42 0.00 0.00 52.86 54.94 1pd2 s ASN 3 Cb -0.11 -2.32 -0.02 0.00 -1.45 0.00 0.00 41.25 37.34 1pd2 s ASN 3 CO 0.52 0.09 -0.24 -0.31 -3.72 0.00 0.00 177.10 173.44 1pd2 s TYR 4 N 0.03 2.11 -0.23 0.43 2.02 -1.26 -3.81 117.35 116.64 1pd2 s TYR 4 Ca 0.28 -0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 56.58 1pd2 s TYR 4 Cb -0.17 -1.32 0.07 0.00 -0.40 0.00 0.00 41.96 40.14 1pd2 s TYR 4 CO 0.14 0.03 0.01 0.15 -1.57 0.00 0.00 175.55 174.31 1pd2 s LYS 5 N -0.84 1.01 -0.03 -0.62 1.02 -0.55 -0.53 119.74 119.21 1pd2 s LYS 5 Ca 0.09 -0.75 -0.20 0.00 0.02 0.00 0.00 55.97 55.13 1pd2 s LYS 5 Cb -0.09 -2.28 -0.05 0.00 -0.52 0.00 0.00 37.83 34.89 1pd2 s LYS 5 CO 0.00 -0.69 0.58 -1.17 -0.92 0.00 0.00 175.35 173.15 1pd2 s LEU 6 N 1.64 4.38 -0.12 3.17 0.20 -0.18 -0.35 118.68 127.42 1pd2 s LEU 6 Ca -0.01 1.09 0.01 0.00 0.69 0.00 0.00 54.13 55.92 1pd2 s LEU 6 Cb -0.18 -2.89 0.02 0.00 -0.43 0.00 0.00 46.19 42.71 1pd2 s LEU 6 CO -0.10 0.07 -0.15 -0.22 -0.29 0.00 0.00 176.35 175.66 1pd2 s LEU 7 N 0.04 1.68 0.00 -0.68 1.98 -0.54 -1.36 118.68 119.80 1pd2 s LEU 7 Ca 0.31 -0.43 -0.12 0.00 -2.89 0.00 0.00 54.13 50.99 1pd2 s LEU 7 Cb -0.18 -1.09 0.04 0.00 0.66 0.00 0.00 46.19 45.63 1pd2 s LEU 7 CO 0.16 -0.01 0.60 0.00 -1.89 0.00 0.00 176.35 175.21 1pd2 n TYR 8 N 4.37 -1.48 -1.85 5.38 9.36 -0.98 -2.56 117.16 129.40 1pd2 n TYR 8 Ca -0.18 -1.02 -0.31 0.00 3.32 0.00 0.00 57.90 59.71 1pd2 n TYR 8 Cb 0.51 0.50 0.03 0.00 -0.63 0.00 0.00 39.34 39.75 1pd2 n TYR 8 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 1pd2 s PHE 9 N -3.96 3.45 -1.26 2.98 0.08 -1.26 -0.54 117.98 117.47 1pd2 s PHE 9 Ca 0.13 1.20 -0.19 0.00 0.12 0.00 0.00 56.93 58.19 1pd2 s PHE 9 Cb -0.03 -2.88 0.01 0.00 -0.57 0.00 0.00 43.02 39.55 1pd2 s PHE 9 CO 0.06 -0.95 1.88 -1.71 -0.10 0.00 0.00 175.22 174.39 1pd2 n ASN 10 N -2.90 4.16 -3.62 1.36 5.15 -1.02 -4.62 115.26 113.77 1pd2 n ASN 10 Ca 0.06 -2.84 -0.06 0.00 -0.60 0.00 0.00 54.58 51.14 1pd2 n ASN 10 Cb 0.55 -1.68 -0.02 0.00 -0.53 0.00 0.00 39.78 38.10 1pd2 n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pd2 s MET 11 N 4.61 1.06 0.01 1.20 0.23 -1.26 -4.97 119.30 120.17 1pd2 s MET 11 Ca 0.56 -0.50 -0.19 0.00 -1.03 0.00 0.00 55.69 54.53 1pd2 s MET 11 Cb 0.06 0.42 -0.11 0.00 -1.53 0.00 0.00 34.83 33.66 1pd2 s MET 11 CO 0.07 -0.47 0.97 0.00 -2.03 0.00 0.00 175.02 173.56 1pd2 h ARG 12 N 2.00 -0.67 0.00 3.16 3.08 -1.04 -3.44 114.38 117.46 1pd2 h ARG 12 Ca -0.24 0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1pd2 h ARG 12 Cb 1.24 0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.44 1pd2 h ARG 12 CO 0.29 -0.45 0.00 0.41 -1.07 0.00 0.00 179.97 179.15 1pd2 n GLY 13 N -0.45 1.87 0.19 0.04 0.00 -1.25 -1.37 105.19 104.22 1pd2 n GLY 13 Ca -0.09 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 45.90 1pd2 n GLY 13 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1pd2 h ARG 14 N 0.00 0.00 0.00 1.61 2.47 -1.95 -3.30 114.38 113.21 1pd2 h ARG 14 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1pd2 h ARG 14 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1pd2 h ARG 14 CO 0.00 0.25 -0.39 0.00 0.56 0.00 0.00 179.97 180.39 1pd2 h ALA 15 N 1.75 0.81 -0.85 0.04 0.00 -1.83 -3.38 119.26 115.80 1pd2 h ALA 15 Ca -0.00 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 1pd2 h ALA 15 Cb 1.05 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1pd2 h ALA 15 CO 0.03 0.00 0.56 1.49 0.00 0.00 0.00 179.25 181.34 1pd2 h GLU 16 N 0.00 0.45 -0.50 0.00 4.57 -1.30 0.18 114.58 117.98 1pd2 h GLU 16 Ca -0.00 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.10 1pd2 h GLU 16 Cb 1.00 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.47 1pd2 h GLU 16 CO 0.00 0.30 0.10 0.97 -1.18 0.00 0.00 179.01 179.20 1pd2 h ILE 17 N 0.47 1.22 -0.36 2.32 6.09 -1.84 -0.96 117.51 124.45 1pd2 h ILE 17 Ca 0.43 -0.82 -0.08 0.00 -1.37 0.00 0.00 64.86 63.02 1pd2 h ILE 17 Cb 0.97 0.73 -0.01 0.00 0.47 0.00 0.00 36.82 38.98 1pd2 h ILE 17 CO -0.17 0.30 -0.08 0.40 -3.07 0.00 0.00 178.15 175.54 1pd2 h ILE 18 N 0.75 1.28 -0.40 2.19 2.04 -1.25 -2.20 117.51 119.92 1pd2 h ILE 18 Ca 0.16 -1.15 -0.03 0.00 1.00 0.00 0.00 64.86 64.85 1pd2 h ILE 18 Cb 0.31 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1pd2 h ILE 18 CO 0.00 0.38 0.12 0.03 0.00 0.00 0.00 178.15 178.68 1pd2 h ARG 19 N 0.50 0.58 -0.09 2.37 3.08 -0.96 -1.27 114.38 118.58 1pd2 h ARG 19 Ca 0.09 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1pd2 h ARG 19 Cb 0.59 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1pd2 h ARG 19 CO 0.03 0.51 -0.01 1.88 -1.07 0.00 0.00 179.97 181.31 1pd2 h TYR 20 N 0.57 0.18 -0.58 3.04 -1.99 -0.97 -2.01 116.97 115.21 1pd2 h TYR 20 Ca 0.14 -0.04 0.03 0.00 2.00 0.00 0.00 58.73 60.86 1pd2 h TYR 20 Cb 0.18 -0.05 -0.04 0.00 2.00 0.00 0.00 36.73 38.83 1pd2 h TYR 20 CO 0.01 0.47 0.34 0.82 -0.00 0.00 0.00 178.16 179.80 1pd2 h ILE 21 N -0.15 1.05 -0.41 -2.88 2.04 -1.12 -0.34 117.51 115.68 1pd2 h ILE 21 Ca 0.02 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1pd2 h ILE 21 Cb 0.40 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1pd2 h ILE 21 CO 0.01 0.12 0.23 -0.26 0.00 0.00 0.00 178.15 178.25 1pd2 h PHE 22 N 0.67 0.56 -0.25 1.37 0.04 -1.25 -0.91 116.94 117.17 1pd2 h PHE 22 Ca 0.24 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 61.02 1pd2 h PHE 22 Cb 0.04 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 1pd2 h PHE 22 CO -0.06 0.42 0.10 0.00 -0.60 0.00 0.00 178.31 178.17 1pd2 h ALA 23 N 1.09 0.29 -0.33 2.45 0.00 -0.86 0.18 119.26 122.08 1pd2 h ALA 23 Ca 0.15 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1pd2 h ALA 23 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1pd2 h ALA 23 CO -0.02 -0.31 0.13 -0.92 0.00 0.00 0.00 179.25 178.13 1pd2 h TYR 24 N 0.22 0.50 -0.03 0.00 3.20 -0.92 -2.21 116.97 117.73 1pd2 h TYR 24 Ca 0.11 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1pd2 h TYR 24 Cb 0.06 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1pd2 h TYR 24 CO -0.12 0.47 0.00 1.28 -1.64 0.00 0.00 178.16 178.16 1pd2 n LEU 25 N -4.71 0.35 -3.81 2.82 4.77 -0.36 -4.90 117.00 111.16 1pd2 n LEU 25 Ca -0.01 -0.14 -0.29 0.00 -0.03 0.00 0.00 56.01 55.53 1pd2 n LEU 25 Cb 0.14 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1pd2 n LEU 25 CO 0.36 0.07 0.09 -0.67 -1.33 0.00 0.00 177.39 175.91 1pd2 n ASP 26 N -0.60 -4.79 -4.64 -1.43 2.03 0.42 -4.94 116.55 102.61 1pd2 n ASP 26 Ca 0.16 -0.71 -0.38 0.00 0.52 0.00 0.00 54.79 54.38 1pd2 n ASP 26 Cb 0.13 -3.84 -0.08 0.00 -0.72 0.00 0.00 41.12 36.61 1pd2 n ASP 26 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1pd2 s ILE 27 N -3.25 5.21 0.43 5.18 1.01 0.09 -5.02 121.20 124.85 1pd2 s ILE 27 Ca 0.62 0.57 -0.24 0.00 0.00 0.00 0.00 60.65 61.61 1pd2 s ILE 27 Cb -0.31 -3.68 -0.08 0.00 0.01 0.00 0.00 42.46 38.39 1pd2 s ILE 27 CO 0.77 0.22 1.13 -0.54 0.00 0.00 0.00 174.94 176.52 1pd2 s LYS 28 N 1.64 3.95 0.19 2.79 1.02 -1.26 -4.66 119.74 123.41 1pd2 s LYS 28 Ca 0.16 1.71 -0.22 0.00 0.02 0.00 0.00 55.97 57.64 1pd2 s LYS 28 Cb -0.15 -2.51 0.06 0.00 -0.52 0.00 0.00 37.83 34.70 1pd2 s LYS 28 CO 0.08 -0.38 0.64 1.52 -0.92 0.00 0.00 175.35 176.29 1pd2 s TYR 29 N -1.55 -0.44 -0.26 3.18 1.13 -1.26 -4.36 117.35 113.80 1pd2 s TYR 29 Ca 0.60 0.16 -0.17 0.00 -1.41 0.00 0.00 57.07 56.25 1pd2 s TYR 29 Cb -0.27 0.60 -0.03 0.00 -1.10 0.00 0.00 41.96 41.16 1pd2 s TYR 29 CO 0.34 -0.96 0.46 -2.00 -2.51 0.00 0.00 175.55 170.88 1pd2 s GLU 30 N -3.80 4.06 -1.18 -3.49 2.12 0.31 -4.98 118.70 111.75 1pd2 s GLU 30 Ca 0.04 0.23 -0.11 0.00 0.36 0.00 0.00 54.97 55.49 1pd2 s GLU 30 Cb -0.02 -3.64 0.21 0.00 0.26 0.00 0.00 34.13 30.94 1pd2 s GLU 30 CO -0.07 -0.30 1.36 -3.47 -0.54 0.00 0.00 175.26 172.23 1pd2 n ASP 31 N 5.39 5.37 -4.59 -1.70 2.03 -1.26 -1.01 116.55 120.77 1pd2 n ASP 31 Ca -0.06 -3.02 -0.42 0.00 0.52 0.00 0.00 54.79 51.81 1pd2 n ASP 31 Cb 0.50 -1.49 -0.02 0.00 -0.72 0.00 0.00 41.12 39.39 1pd2 n ASP 31 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1pd2 s HIS 32 N 0.35 2.41 -0.13 -0.67 5.65 -0.46 -5.01 115.29 117.44 1pd2 s HIS 32 Ca 0.38 0.56 -0.06 0.00 0.25 0.00 0.00 55.06 56.19 1pd2 s HIS 32 Cb -0.04 -4.39 -0.04 0.00 -1.18 0.00 0.00 32.58 26.93 1pd2 s HIS 32 CO -0.02 -1.85 0.08 1.03 -0.65 0.00 0.00 174.74 173.32 1pd2 s ARG 33 N 5.15 3.47 0.21 2.88 0.52 -1.26 -2.31 118.95 127.62 1pd2 s ARG 33 Ca 0.54 -0.27 0.11 0.00 -0.52 0.00 0.00 55.73 55.59 1pd2 s ARG 33 Cb -0.11 -3.08 -0.05 0.00 0.52 0.00 0.00 34.95 32.23 1pd2 s ARG 33 CO 0.28 0.61 -0.23 0.96 0.02 0.00 0.00 175.30 176.94 1pd2 s ILE 34 N -0.57 2.36 0.29 1.52 -4.36 0.30 -4.85 121.20 115.89 1pd2 s ILE 34 Ca 0.11 -2.12 -0.05 0.00 -0.26 0.00 0.00 60.65 58.34 1pd2 s ILE 34 Cb -0.12 -2.16 -0.05 0.00 1.25 0.00 0.00 42.46 41.38 1pd2 s ILE 34 CO 0.02 -0.19 0.55 -1.61 0.24 0.00 0.00 174.94 173.95 1pd2 s GLU 35 N -2.88 3.62 0.36 0.37 0.41 -1.26 -2.43 118.70 116.89 1pd2 s GLU 35 Ca 0.23 -0.01 0.11 0.00 -0.41 0.00 0.00 54.97 54.88 1pd2 s GLU 35 Cb -0.07 -2.65 0.88 0.00 -1.78 0.00 0.00 34.13 30.51 1pd2 s GLU 35 CO 0.11 0.21 1.83 1.96 -0.49 0.00 0.00 175.26 178.88 1pd2 h GLN 36 N 1.65 0.61 -0.10 1.61 1.08 -2.00 -0.01 115.11 117.95 1pd2 h GLN 36 Ca -0.48 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 56.72 1pd2 h GLN 36 Cb 1.19 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 28.48 1pd2 h GLN 36 CO 0.66 0.40 0.08 0.00 -0.95 0.00 0.00 178.83 179.02 1pd2 h ALA 37 N 1.61 1.99 0.00 3.87 0.00 -2.06 -2.44 119.26 122.24 1pd2 h ALA 37 Ca 0.51 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.26 1pd2 h ALA 37 Cb 0.96 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1pd2 h ALA 37 CO -0.26 -0.13 -1.09 -0.44 0.00 0.00 0.00 179.25 177.32 1pd2 h ASP 38 N 0.00 0.00 -0.76 0.00 3.32 -1.38 -3.39 116.42 114.21 1pd2 h ASP 38 Ca 0.05 0.00 0.17 0.00 0.02 0.00 0.00 57.03 57.27 1pd2 h ASP 38 Cb 0.21 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.62 1pd2 h ASP 38 CO -0.00 0.62 -0.05 -0.25 -1.72 0.00 0.00 179.24 177.83 1pd2 h TRP 39 N 0.00 -0.16 -0.82 4.55 -0.00 -1.31 -1.54 115.95 116.67 1pd2 h TRP 39 Ca -0.10 0.06 0.20 0.00 -0.00 0.00 0.00 58.89 59.04 1pd2 h TRP 39 Cb 1.56 0.19 -0.05 0.00 -0.00 0.00 0.00 29.16 30.86 1pd2 h TRP 39 CO 0.00 -0.27 0.56 -1.35 -0.00 0.00 0.00 178.44 177.37 1pd2 h PRO 40 N 0.06 0.26 0.04 2.65 0.11 -1.76 0.13 132.00 133.49 1pd2 h PRO 40 Ca 0.40 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 66.27 1pd2 h PRO 40 Cb 0.69 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.74 1pd2 h PRO 40 CO -0.71 0.17 -1.00 0.87 -0.21 0.00 0.00 178.00 177.12 1pd2 h LYS 41 N 0.27 0.29 0.10 1.05 1.79 -1.57 -3.37 116.57 115.13 1pd2 h LYS 41 Ca 0.41 -0.36 -0.20 0.00 -2.18 0.00 0.00 60.65 58.32 1pd2 h LYS 41 Cb 1.19 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 1pd2 h LYS 41 CO -0.11 1.09 -0.98 0.82 -1.08 0.00 0.00 179.45 179.19 1pd2 h ILE 42 N 0.14 1.30 -0.81 1.86 2.04 -1.06 -3.41 117.51 117.57 1pd2 h ILE 42 Ca -0.08 -2.42 0.14 0.00 1.00 0.00 0.00 64.86 63.50 1pd2 h ILE 42 Cb 1.67 2.94 -0.14 0.00 -0.74 0.00 0.00 36.82 40.55 1pd2 h ILE 42 CO 0.16 0.66 -0.28 1.17 0.00 0.00 0.00 178.15 179.86 1pd2 n LYS 43 N -4.14 -0.15 0.00 2.37 4.81 0.32 -0.64 118.16 120.73 1pd2 n LYS 43 Ca -0.20 1.26 0.03 0.00 -0.87 0.00 0.00 58.31 58.53 1pd2 n LYS 43 Cb 0.79 -1.87 0.13 0.00 0.02 0.00 0.00 35.03 34.10 1pd2 n LYS 43 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1pd2 n PRO 44 N -5.24 0.02 0.06 1.64 -0.04 -1.26 -2.21 135.00 127.96 1pd2 n PRO 44 Ca 0.10 0.36 0.11 0.00 -0.04 0.00 0.00 63.50 64.03 1pd2 n PRO 44 Cb 0.35 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.33 1pd2 n PRO 44 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1pd2 n THR 45 N -1.44 0.35 -2.97 0.52 -2.24 0.19 -4.93 114.28 103.75 1pd2 n THR 45 Ca 0.02 -0.40 -0.36 0.00 -2.27 0.00 0.00 64.05 61.04 1pd2 n THR 45 Cb 0.06 -0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 1pd2 n THR 45 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1pd2 s LEU 46 N -4.59 4.33 0.01 3.22 1.43 -0.94 -5.01 118.68 117.13 1pd2 s LEU 46 Ca 0.01 1.58 -0.03 0.00 -1.03 0.00 0.00 54.13 54.66 1pd2 s LEU 46 Cb 0.12 -3.77 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 1pd2 s LEU 46 CO 0.80 -0.02 1.05 1.55 0.23 0.00 0.00 176.35 179.96 1pd2 h PRO 47 N 3.28 -0.02 -0.79 1.29 0.13 -1.91 -1.87 132.00 132.12 1pd2 h PRO 47 Ca -0.47 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.29 1pd2 h PRO 47 Cb 1.19 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 1pd2 h PRO 47 CO 0.65 -0.01 0.41 1.19 -0.23 0.00 0.00 178.00 180.01 1pd2 n PHE 48 N -3.11 2.50 -1.99 1.56 3.01 -1.26 -4.93 117.46 113.23 1pd2 n PHE 48 Ca -0.00 -1.61 -0.16 0.00 1.01 0.00 0.00 57.45 56.69 1pd2 n PHE 48 Cb 0.03 -0.78 -0.03 0.00 -0.01 0.00 0.00 39.48 38.68 1pd2 n PHE 48 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pd2 n GLY 49 N -0.88 0.39 3.21 1.37 0.00 -0.70 -4.96 105.19 103.62 1pd2 n GLY 49 Ca 0.49 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.39 1pd2 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pd2 s LYS 50 N -4.27 1.07 0.24 1.61 1.02 -1.26 -4.90 119.74 113.25 1pd2 s LYS 50 Ca 0.00 -1.53 0.05 0.00 0.02 0.00 0.00 55.97 54.51 1pd2 s LYS 50 Cb 0.00 -0.03 -0.05 0.00 -0.52 0.00 0.00 37.83 37.22 1pd2 s LYS 50 CO 0.00 -0.22 -0.05 0.96 -0.92 0.00 0.00 175.35 175.13 1pd2 s ILE 51 N -3.85 1.35 0.77 2.17 -4.36 -1.26 -4.60 121.20 111.42 1pd2 s ILE 51 Ca 0.26 -2.09 -0.11 0.00 -0.26 0.00 0.00 60.65 58.46 1pd2 s ILE 51 Cb 0.07 -2.31 0.05 0.00 1.25 0.00 0.00 42.46 41.52 1pd2 s ILE 51 CO 0.05 -0.38 1.08 -2.16 0.24 0.00 0.00 174.94 173.77 1pd2 s PRO 52 N -3.78 2.30 0.05 0.37 0.04 -1.26 -4.97 135.00 127.75 1pd2 s PRO 52 Ca 0.27 0.94 0.02 0.00 0.04 0.00 0.00 61.00 62.27 1pd2 s PRO 52 Cb 0.04 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 1pd2 s PRO 52 CO 0.09 -1.55 -0.06 0.14 0.04 0.00 0.00 177.00 175.66 1pd2 s VAL 53 N -3.00 0.46 -0.18 -0.36 -7.23 -1.06 -3.74 120.40 105.29 1pd2 s VAL 53 Ca 0.60 -1.20 0.01 0.00 -1.81 0.00 0.00 61.98 59.59 1pd2 s VAL 53 Cb -0.16 -0.72 0.02 0.00 0.56 0.00 0.00 36.38 36.08 1pd2 s VAL 53 CO 0.55 -0.50 -0.17 -0.22 -0.31 0.00 0.00 175.10 174.45 1pd2 s LEU 54 N -1.82 2.08 -0.32 1.32 2.96 -0.42 -1.47 118.68 121.02 1pd2 s LEU 54 Ca -0.07 -0.66 -0.20 0.00 -0.22 0.00 0.00 54.13 52.97 1pd2 s LEU 54 Cb -0.07 -1.38 -0.01 0.00 0.50 0.00 0.00 46.19 45.23 1pd2 s LEU 54 CO -0.01 -0.04 0.64 -0.70 -1.32 0.00 0.00 176.35 174.92 1pd2 s GLU 55 N 1.34 3.85 -0.22 1.98 -6.30 0.52 -0.62 118.70 119.26 1pd2 s GLU 55 Ca 0.04 0.25 0.01 0.00 -2.50 0.00 0.00 54.97 52.76 1pd2 s GLU 55 Cb -0.14 -3.75 0.05 0.00 0.00 0.00 0.00 34.13 30.30 1pd2 s GLU 55 CO -0.12 -0.62 -0.09 0.08 0.02 0.00 0.00 175.26 174.54 1pd2 s VAL 56 N 2.64 1.64 -1.37 3.70 1.01 0.47 -1.49 120.40 127.01 1pd2 s VAL 56 Ca 0.25 -1.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.01 1pd2 s VAL 56 Cb -0.15 -1.78 0.07 0.00 0.00 0.00 0.00 36.38 34.52 1pd2 s VAL 56 CO 0.13 0.06 0.57 1.21 0.00 0.00 0.00 175.10 177.06 1pd2 n GLU 57 N 4.66 -3.82 -2.25 2.72 4.07 -1.25 -0.62 120.64 124.15 1pd2 n GLU 57 Ca -0.14 0.55 -0.05 0.00 -0.06 0.00 0.00 57.16 57.46 1pd2 n GLU 57 Cb 0.45 -5.30 0.00 0.00 -0.06 0.00 0.00 31.44 26.54 1pd2 n GLU 57 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1pd2 n GLY 58 N -1.28 0.30 2.98 8.31 0.00 -1.26 -5.04 105.19 109.20 1pd2 n GLY 58 Ca -0.02 -0.64 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1pd2 n GLY 58 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pd2 s LEU 59 N -1.56 1.55 -0.38 0.99 0.20 0.21 -5.11 118.68 114.58 1pd2 s LEU 59 Ca 0.03 -0.23 -0.15 0.00 0.69 0.00 0.00 54.13 54.47 1pd2 s LEU 59 Cb -0.01 -0.68 0.00 0.00 -0.43 0.00 0.00 46.19 45.07 1pd2 s LEU 59 CO 0.04 0.01 0.32 -0.89 -0.29 0.00 0.00 176.35 175.53 1pd2 s THR 60 N 0.71 5.22 0.27 3.68 2.01 -1.26 -0.40 115.64 125.88 1pd2 s THR 60 Ca -0.13 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 61.53 1pd2 s THR 60 Cb -0.15 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 1pd2 s THR 60 CO 0.02 -0.19 0.47 -0.76 -0.69 0.00 0.00 174.62 173.47 1pd2 s LEU 61 N 1.83 4.13 0.21 4.42 1.43 0.21 -4.90 118.68 126.01 1pd2 s LEU 61 Ca 0.08 0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 53.61 1pd2 s LEU 61 Cb -0.18 -3.25 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 1pd2 s LEU 61 CO 0.11 -0.16 0.15 -1.38 0.23 0.00 0.00 176.35 175.30 1pd2 s HIS 62 N -2.08 1.16 -0.01 0.29 -3.43 -1.26 -1.31 115.29 108.66 1pd2 s HIS 62 Ca 0.39 -1.37 -0.01 0.00 -0.80 0.00 0.00 55.06 53.28 1pd2 s HIS 62 Cb -0.10 -0.54 0.00 0.00 -1.43 0.00 0.00 32.58 30.51 1pd2 s HIS 62 CO 0.32 -0.67 0.01 1.04 -2.00 0.00 0.00 174.74 173.44 1pd2 n GLN 63 N -0.29 -0.24 -0.23 -0.38 1.13 -1.24 -4.46 117.38 111.66 1pd2 n GLN 63 Ca 0.02 0.65 0.04 0.00 -1.94 0.00 0.00 57.00 55.77 1pd2 n GLN 63 Cb 0.66 -1.12 0.14 0.00 0.11 0.00 0.00 30.24 30.03 1pd2 n GLN 63 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1pd2 h SER 64 N 0.21 -0.14 0.98 1.08 4.64 -1.87 -0.38 113.55 118.06 1pd2 h SER 64 Ca -0.02 0.15 -0.10 0.00 -0.47 0.00 0.00 61.79 61.35 1pd2 h SER 64 Cb 0.05 0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1pd2 h SER 64 CO 0.00 -0.08 -0.48 -0.07 -0.87 0.00 0.00 176.83 175.33 1pd2 h LEU 65 N 0.19 0.00 -0.24 5.97 3.38 -1.92 -0.23 115.31 122.46 1pd2 h LEU 65 Ca 0.38 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.16 1pd2 h LEU 65 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1pd2 h LEU 65 CO -0.53 0.48 -0.59 0.00 0.09 0.00 0.00 178.44 177.88 1pd2 h ALA 66 N 1.52 0.39 -0.43 1.53 0.00 -1.45 -1.84 119.26 118.99 1pd2 h ALA 66 Ca -0.00 -0.53 -0.13 0.00 0.00 0.00 0.00 54.91 54.24 1pd2 h ALA 66 Cb 1.09 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1pd2 h ALA 66 CO 0.06 0.64 -0.25 0.82 0.00 0.00 0.00 179.25 180.52 1pd2 h ILE 67 N 0.58 1.27 -0.60 0.00 2.04 -0.97 -2.08 117.51 117.75 1pd2 h ILE 67 Ca -0.01 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.41 1pd2 h ILE 67 Cb 1.21 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.51 1pd2 h ILE 67 CO 0.13 0.48 0.28 0.00 0.00 0.00 0.00 178.15 179.04 1pd2 h ALA 68 N 0.82 0.78 -0.13 1.87 0.00 -1.01 -0.84 119.26 120.75 1pd2 h ALA 68 Ca 0.09 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1pd2 h ALA 68 Cb 0.83 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1pd2 h ALA 68 CO 0.07 0.35 -0.35 -0.09 0.00 0.00 0.00 179.25 179.23 1pd2 h ARG 69 N 0.82 0.26 -0.22 0.00 2.43 -1.29 -2.24 114.38 114.15 1pd2 h ARG 69 Ca 0.21 -0.11 -0.19 0.00 -0.81 0.00 0.00 59.98 59.07 1pd2 h ARG 69 Cb 0.13 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1pd2 h ARG 69 CO -0.02 0.58 -0.62 -0.92 -1.51 0.00 0.00 179.97 177.48 1pd2 h TYR 70 N 0.23 1.00 0.00 2.20 3.20 -1.01 -2.93 116.97 119.66 1pd2 h TYR 70 Ca 0.03 -0.38 -0.07 0.00 3.14 0.00 0.00 58.73 61.44 1pd2 h TYR 70 Cb 0.73 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 1pd2 h TYR 70 CO 0.01 1.20 -0.34 -0.07 -1.64 0.00 0.00 178.16 177.32 1pd2 h LEU 71 N 0.58 0.00 -0.44 2.82 3.38 -1.02 -3.17 115.31 117.46 1pd2 h LEU 71 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1pd2 h LEU 71 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1pd2 h LEU 71 CO 0.13 0.34 -0.35 0.35 0.09 0.00 0.00 178.44 179.00 1pd2 n THR 72 N -3.41 0.00 -1.77 0.22 -2.24 -0.85 -4.95 114.28 101.28 1pd2 n THR 72 Ca 0.00 -0.11 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 1pd2 n THR 72 Cb 0.53 0.49 0.02 0.00 -2.10 0.00 0.00 70.33 69.26 1pd2 n THR 72 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1pd2 s LYS 73 N -2.61 3.73 -1.41 -0.78 1.02 -1.11 -2.35 119.74 116.24 1pd2 s LYS 73 Ca 0.21 2.48 -0.10 0.00 0.02 0.00 0.00 55.97 58.58 1pd2 s LYS 73 Cb 0.19 -2.70 0.04 0.00 -0.52 0.00 0.00 37.83 34.83 1pd2 s LYS 73 CO 0.57 -0.80 1.08 0.09 -0.92 0.00 0.00 175.35 175.37 1pd2 n ASN 74 N -0.11 -5.26 -3.93 2.83 3.02 -1.26 -4.98 115.26 105.57 1pd2 n ASN 74 Ca 0.04 -0.65 -0.10 0.00 -0.03 0.00 0.00 54.58 53.85 1pd2 n ASN 74 Cb 0.41 -4.58 -0.10 0.00 -0.61 0.00 0.00 39.78 34.90 1pd2 n ASN 74 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pd2 s THR 75 N -3.33 0.12 0.26 3.41 2.01 -0.99 -5.05 115.64 112.07 1pd2 s THR 75 Ca 0.55 -1.02 0.22 0.00 0.31 0.00 0.00 61.69 61.75 1pd2 s THR 75 Cb -0.25 -0.73 0.20 0.00 0.01 0.00 0.00 72.50 71.73 1pd2 s THR 75 CO 0.77 -0.56 1.87 0.44 -0.69 0.00 0.00 174.62 176.45 1pd2 h ASP 76 N 3.92 0.00 -0.58 3.53 3.32 -1.88 -3.16 116.42 121.57 1pd2 h ASP 76 Ca -0.32 0.00 0.16 0.00 0.02 0.00 0.00 57.03 56.89 1pd2 h ASP 76 Cb 1.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 1pd2 h ASP 76 CO 0.48 0.26 0.42 -0.07 -1.72 0.00 0.00 179.24 178.60 1pd2 h LEU 77 N 0.00 0.02 -0.04 1.55 3.38 -1.83 -0.51 115.31 117.89 1pd2 h LEU 77 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pd2 h LEU 77 Cb 0.66 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1pd2 h LEU 77 CO 0.03 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1pd2 h ALA 78 N 1.71 1.00 0.00 1.53 0.00 -1.67 -0.74 119.26 121.09 1pd2 h ALA 78 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1pd2 h ALA 78 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1pd2 h ALA 78 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1pd2 n GLY 79 N 1.22 2.88 0.12 0.00 0.00 -0.20 -4.06 105.19 105.14 1pd2 n GLY 79 Ca 0.05 -1.55 -0.14 0.00 0.00 0.00 0.00 46.02 44.38 1pd2 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pd2 h LYS 80 N 0.00 0.27 -6.41 1.61 1.57 -1.87 -3.42 116.57 108.31 1pd2 h LYS 80 Ca 0.00 -0.19 -0.44 0.00 -1.87 0.00 0.00 60.65 58.15 1pd2 h LYS 80 Cb 0.00 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.35 1pd2 h LYS 80 CO 0.00 0.81 -0.27 0.95 -0.57 0.00 0.00 179.45 180.37 1pd2 s THR 81 N -3.80 2.88 0.29 -0.16 -4.23 -1.26 -4.97 115.64 104.38 1pd2 s THR 81 Ca -0.15 -1.05 0.03 0.00 -1.18 0.00 0.00 61.69 59.34 1pd2 s THR 81 Cb 0.03 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 71.02 1pd2 s THR 81 CO 0.75 0.00 1.75 -0.08 -0.54 0.00 0.00 174.62 176.50 1pd2 h GLU 82 N 0.67 0.49 -0.47 3.99 4.57 -1.99 -1.22 114.58 120.61 1pd2 h GLU 82 Ca -0.39 -0.17 -0.09 0.00 -1.18 0.00 0.00 59.36 57.53 1pd2 h GLU 82 Cb 1.28 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.81 1pd2 h GLU 82 CO 0.47 0.67 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.86 1pd2 h LEU 83 N 0.44 0.85 -0.57 1.64 -0.00 -1.98 -2.38 115.31 113.32 1pd2 h LEU 83 Ca 0.07 -0.33 -0.15 0.00 -0.00 0.00 0.00 57.88 57.47 1pd2 h LEU 83 Cb 0.60 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.02 1pd2 h LEU 83 CO 0.04 0.98 -0.54 -0.33 -0.00 0.00 0.00 178.44 178.58 1pd2 h GLU 84 N 0.71 0.49 -0.72 1.13 5.08 -1.92 -2.38 114.58 116.97 1pd2 h GLU 84 Ca 0.13 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1pd2 h GLU 84 Cb 0.56 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1pd2 h GLU 84 CO 0.03 0.91 0.29 1.96 -1.00 0.00 0.00 179.01 181.20 1pd2 h GLN 85 N 0.38 1.07 -0.57 2.33 4.20 -1.11 0.19 115.11 121.59 1pd2 h GLN 85 Ca 0.01 -0.18 -0.11 0.00 0.06 0.00 0.00 58.65 58.43 1pd2 h GLN 85 Cb 1.07 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.65 1pd2 h GLN 85 CO 0.10 0.87 -0.06 0.00 -0.67 0.00 0.00 178.83 179.06 1pd2 h GLN 87 N 0.93 0.61 -0.28 0.00 4.20 -0.99 0.11 115.11 119.70 1pd2 h GLN 87 Ca 0.15 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.60 1pd2 h GLN 87 Cb 0.63 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1pd2 h GLN 87 CO 0.04 0.73 -0.08 0.28 -0.67 0.00 0.00 178.83 179.13 1pd2 h VAL 88 N 0.56 1.28 -0.51 -0.54 2.07 -0.72 -2.30 116.25 116.10 1pd2 h VAL 88 Ca 0.10 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1pd2 h VAL 88 Cb 0.55 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1pd2 h VAL 88 CO 0.03 0.35 0.28 0.44 0.02 0.00 0.00 177.57 178.69 1pd2 h ASP 89 N 0.31 0.63 -0.95 0.57 3.32 -0.87 -2.65 116.42 116.78 1pd2 h ASP 89 Ca 0.07 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.07 1pd2 h ASP 89 Cb 0.56 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1pd2 h ASP 89 CO 0.03 0.55 0.62 0.00 -1.72 0.00 0.00 179.24 178.71 1pd2 h ALA 90 N 1.11 1.26 -0.35 3.45 0.00 -0.60 -1.14 119.26 123.00 1pd2 h ALA 90 Ca 0.18 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1pd2 h ALA 90 Cb 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1pd2 h ALA 90 CO -0.03 0.48 -0.04 0.28 0.00 0.00 0.00 179.25 179.94 1pd2 h VAL 91 N 1.18 1.27 -0.76 0.00 2.07 -1.25 -0.71 116.25 118.05 1pd2 h VAL 91 Ca 0.38 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.81 1pd2 h VAL 91 Cb 0.03 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1pd2 h VAL 91 CO -0.13 0.35 0.34 0.58 0.02 0.00 0.00 177.57 178.73 1pd2 h VAL 92 N 0.44 1.25 -0.54 2.57 2.07 -1.24 -1.72 116.25 119.08 1pd2 h VAL 92 Ca 0.09 -0.74 -0.08 0.00 0.82 0.00 0.00 66.70 66.79 1pd2 h VAL 92 Cb 0.52 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1pd2 h VAL 92 CO 0.03 0.31 -0.00 0.44 0.02 0.00 0.00 177.57 178.36 1pd2 h ASP 93 N 1.09 0.89 -0.58 0.57 3.32 -1.01 -0.51 116.42 120.19 1pd2 h ASP 93 Ca 0.26 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1pd2 h ASP 93 Cb 0.17 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1pd2 h ASP 93 CO -0.03 0.95 0.16 0.74 -1.72 0.00 0.00 179.24 179.34 1pd2 h THR 94 N 0.84 1.24 -0.17 0.35 2.02 -0.80 -0.60 112.91 115.80 1pd2 h THR 94 Ca 0.16 -0.86 -0.16 0.00 0.77 0.00 0.00 66.41 66.32 1pd2 h THR 94 Cb 0.50 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1pd2 h THR 94 CO 0.02 0.32 -0.55 -0.07 0.37 0.00 0.00 175.52 175.61 1pd2 h LEU 95 N 0.82 0.56 -0.51 2.58 3.38 -1.03 -3.00 115.31 118.11 1pd2 h LEU 95 Ca 0.18 -0.30 -0.17 0.00 0.09 0.00 0.00 57.88 57.69 1pd2 h LEU 95 Cb 0.32 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1pd2 h LEU 95 CO -0.00 1.00 -0.70 -0.78 0.09 0.00 0.00 178.44 178.05 1pd2 h ASP 96 N 0.39 0.29 -0.37 -0.43 3.58 -1.00 -2.36 116.42 116.51 1pd2 h ASP 96 Ca 0.01 -0.19 0.03 0.00 0.42 0.00 0.00 57.03 57.30 1pd2 h ASP 96 Cb 1.09 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 42.02 1pd2 h ASP 96 CO 0.10 0.89 0.18 0.44 -2.88 0.00 0.00 179.24 177.97 1pd2 h ASP 97 N 0.16 0.26 0.28 2.28 3.32 -1.01 -1.84 116.42 119.88 1pd2 h ASP 97 Ca -0.02 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1pd2 h ASP 97 Cb 1.25 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1pd2 h ASP 97 CO 0.11 0.19 -0.14 0.15 -1.72 0.00 0.00 179.24 177.83 1pd2 h PHE 98 N 0.37 -0.35 -0.13 4.55 3.57 -1.44 -3.01 116.94 120.49 1pd2 h PHE 98 Ca 0.16 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1pd2 h PHE 98 Cb 0.07 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1pd2 h PHE 98 CO -0.10 -0.07 0.13 0.52 -2.23 0.00 0.00 178.31 176.56 1pd2 h MET 99 N -0.62 0.00 0.00 1.11 2.86 -1.40 -0.56 114.93 116.32 1pd2 h MET 99 Ca -0.04 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1pd2 h MET 99 Cb 0.44 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 1pd2 h MET 99 CO 0.06 0.00 -0.13 0.77 1.06 0.00 0.00 176.91 178.68 1pd2 h SER 100 N 0.00 0.00 0.34 1.22 0.02 -1.19 -3.06 113.55 110.88 1pd2 h SER 100 Ca 0.06 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1pd2 h SER 100 Cb 0.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1pd2 h SER 100 CO -0.00 0.13 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.50 1pd2 h LEU 101 N 0.00 0.00 -9.31 5.07 3.38 -1.09 -3.43 115.31 109.93 1pd2 h LEU 101 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 1pd2 h LEU 101 Cb 0.73 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1pd2 h LEU 101 CO 0.02 0.24 1.01 -0.36 0.09 0.00 0.00 178.44 179.44 1pd2 s PHE 102 N -4.30 2.29 -1.28 1.13 0.40 -1.16 -4.91 117.98 110.15 1pd2 s PHE 102 Ca -0.03 0.39 -0.14 0.00 -0.60 0.00 0.00 56.93 56.55 1pd2 s PHE 102 Cb 0.14 -3.85 -0.04 0.00 0.51 0.00 0.00 43.02 39.78 1pd2 s PHE 102 CO 0.68 -3.45 2.30 -0.35 0.70 0.00 0.00 175.22 175.09 1pd2 n PRO 103 N 6.46 2.63 0.11 0.24 -0.04 -1.26 -4.74 135.00 138.40 1pd2 n PRO 103 Ca 0.16 -2.22 0.18 0.00 -0.04 0.00 0.00 63.50 61.58 1pd2 n PRO 103 Cb 0.43 -3.01 0.74 0.00 -0.04 0.00 0.00 33.50 31.61 1pd2 n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1pd2 h TRP 104 N 6.26 0.00 -0.07 0.54 4.06 -1.92 -1.26 115.95 123.56 1pd2 h TRP 104 Ca 0.59 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.54 1pd2 h TRP 104 Cb 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.68 1pd2 h TRP 104 CO 1.55 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 176.43 1pd2 n ALA 105 N -2.49 2.49 -1.62 1.49 0.00 -1.26 -4.98 120.51 114.14 1pd2 n ALA 105 Ca 0.05 -0.64 -0.52 0.00 0.00 0.00 0.00 53.44 52.32 1pd2 n ALA 105 Cb 0.45 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 1pd2 n ALA 105 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1pd2 n GLU 106 N 0.97 1.45 -0.05 0.00 4.07 -0.48 -4.88 120.64 121.73 1pd2 n GLU 106 Ca 0.16 0.50 -0.12 0.00 -0.06 0.00 0.00 57.16 57.64 1pd2 n GLU 106 Cb 0.51 -2.40 -0.07 0.00 -0.06 0.00 0.00 31.44 29.43 1pd2 n GLU 106 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1pd2 h GLU 107 N 9.59 0.28 -5.81 5.31 4.39 -1.93 -3.40 114.58 123.02 1pd2 h GLU 107 Ca -0.41 -0.12 -0.39 0.00 0.34 0.00 0.00 59.36 58.78 1pd2 h GLU 107 Cb 1.30 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.91 1pd2 h GLU 107 CO 0.98 0.60 1.08 1.21 -1.16 0.00 0.00 179.01 181.72 1pd2 s ASN 108 N -5.91 5.04 0.00 1.42 3.84 -1.26 -4.81 114.94 113.25 1pd2 s ASN 108 Ca -0.14 0.06 0.14 0.00 0.21 0.00 0.00 52.86 53.12 1pd2 s ASN 108 Cb 0.05 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 38.98 1pd2 s ASN 108 CO 0.73 -2.66 1.31 0.00 -2.79 0.00 0.00 177.10 173.69 1pd2 n GLN 109 N 9.03 0.31 -0.06 0.43 1.13 -1.26 -1.57 117.38 125.40 1pd2 n GLN 109 Ca 0.31 0.08 -0.04 0.00 -1.94 0.00 0.00 57.00 55.41 1pd2 n GLN 109 Cb 0.50 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.34 1pd2 n GLN 109 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1pd2 h ASP 110 N 0.00 0.00 -0.36 1.08 3.58 -1.95 -3.26 116.42 115.51 1pd2 h ASP 110 Ca 0.00 0.00 0.08 0.00 0.42 0.00 0.00 57.03 57.53 1pd2 h ASP 110 Cb 0.07 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.04 1pd2 h ASP 110 CO 0.00 0.65 -0.13 0.25 -2.88 0.00 0.00 179.24 177.13 1pd2 h LEU 111 N -0.87 -0.46 -0.14 2.28 5.85 -1.95 -1.54 115.31 118.48 1pd2 h LEU 111 Ca 0.00 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1pd2 h LEU 111 Cb 0.42 0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 1pd2 h LEU 111 CO 0.00 -0.16 -0.33 0.50 -0.34 0.00 0.00 178.44 178.11 1pd2 h LYS 112 N -0.06 -0.29 -0.34 1.25 3.64 -1.50 0.57 116.57 119.85 1pd2 h LYS 112 Ca 0.18 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.67 1pd2 h LYS 112 Cb 0.33 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1pd2 h LYS 112 CO -0.40 -0.19 0.35 1.49 -2.27 0.00 0.00 179.45 178.42 1pd2 h GLU 113 N -0.30 0.00 0.05 1.90 4.22 -1.53 0.14 114.58 119.05 1pd2 h GLU 113 Ca 0.03 0.00 -0.27 0.00 0.08 0.00 0.00 59.36 59.20 1pd2 h GLU 113 Cb 0.38 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1pd2 h GLU 113 CO -0.30 0.00 -1.42 0.00 -2.18 0.00 0.00 179.01 175.12 1pd2 h ARG 114 N 0.00 0.10 -0.07 1.92 3.08 0.04 -2.94 114.38 116.51 1pd2 h ARG 114 Ca 0.16 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 1pd2 h ARG 114 Cb 0.85 0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.97 1pd2 h ARG 114 CO -0.00 0.90 -0.45 1.15 -1.07 0.00 0.00 179.97 180.51 1pd2 h THR 115 N 0.03 1.40 -0.71 2.04 2.02 0.18 -2.65 112.91 115.23 1pd2 h THR 115 Ca -0.18 -1.84 0.12 0.00 0.77 0.00 0.00 66.41 65.28 1pd2 h THR 115 Cb 1.94 2.33 -0.09 0.00 -1.74 0.00 0.00 68.15 70.59 1pd2 h THR 115 CO 0.13 0.54 0.28 -0.26 0.37 0.00 0.00 175.52 176.57 1pd2 h PHE 116 N -0.04 0.48 -0.41 3.16 -1.00 -0.92 0.40 116.94 118.61 1pd2 h PHE 116 Ca -0.04 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.81 1pd2 h PHE 116 Cb 1.11 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 40.53 1pd2 h PHE 116 CO 0.13 0.08 0.21 -0.91 -1.61 0.00 0.00 178.31 176.21 1pd2 h ASN 117 N 0.44 0.32 0.48 2.17 2.35 -1.47 0.03 115.58 119.90 1pd2 h ASN 117 Ca 0.38 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.12 1pd2 h ASN 117 Cb 0.53 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1pd2 h ASN 117 CO -0.37 0.23 -0.23 -0.78 -1.65 0.00 0.00 177.43 174.63 1pd2 h ASP 118 N 0.43 -0.55 -0.18 5.81 3.58 -0.69 -1.93 116.42 122.89 1pd2 h ASP 118 Ca 0.17 -0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.64 1pd2 h ASP 118 Cb 0.06 0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.19 1pd2 h ASP 118 CO -0.11 -0.33 -0.50 -0.07 -2.88 0.00 0.00 179.24 175.35 1pd2 h LEU 119 N -0.73 -1.58 -2.45 2.28 4.07 -0.84 0.58 115.31 116.64 1pd2 h LEU 119 Ca -0.07 0.20 0.01 0.00 0.08 0.00 0.00 57.88 58.10 1pd2 h LEU 119 Cb 0.54 0.63 -0.00 0.00 1.08 0.00 0.00 40.66 42.91 1pd2 h LEU 119 CO 0.11 -0.45 0.05 -0.07 -1.08 0.00 0.00 178.44 176.99 1pd2 h LEU 120 N -0.52 0.00 0.00 1.67 -0.00 -0.97 -1.38 115.31 114.10 1pd2 h LEU 120 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 1pd2 h LEU 120 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.31 1pd2 h LEU 120 CO -0.45 0.00 -1.34 0.35 -0.00 0.00 0.00 178.44 177.00 1pd2 n THR 121 N -3.77 0.00 -0.09 0.22 -2.24 -0.73 -4.51 114.28 103.16 1pd2 n THR 121 Ca -0.02 -0.22 -0.18 0.00 -2.27 0.00 0.00 64.05 61.36 1pd2 n THR 121 Cb 0.13 0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 68.65 1pd2 n THR 121 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1pd2 n ARG 122 N -1.77 0.38 0.02 -0.78 5.12 0.19 -4.77 116.66 115.06 1pd2 n ARG 122 Ca -0.01 0.16 -0.21 0.00 -1.93 0.00 0.00 57.85 55.85 1pd2 n ARG 122 Cb 0.23 -1.16 -0.14 0.00 -1.16 0.00 0.00 32.46 30.23 1pd2 n ARG 122 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1pd2 h GLN 123 N -0.58 0.27 -0.78 5.56 7.50 -1.35 -3.39 115.11 122.33 1pd2 h GLN 123 Ca -0.45 -0.46 0.19 0.00 0.50 0.00 0.00 58.65 58.43 1pd2 h GLN 123 Cb 1.42 0.17 -0.13 0.00 0.05 0.00 0.00 27.48 28.99 1pd2 h GLN 123 CO -0.25 1.22 0.09 0.00 -1.50 0.00 0.00 178.83 178.39 1pd2 h ALA 124 N -0.01 0.94 -0.37 3.87 0.00 -1.56 0.26 119.26 122.40 1pd2 h ALA 124 Ca -0.27 0.22 0.11 0.00 0.00 0.00 0.00 54.91 54.98 1pd2 h ALA 124 Cb 1.76 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1pd2 h ALA 124 CO 0.09 -0.42 0.28 -1.35 0.00 0.00 0.00 179.25 177.85 1pd2 h PRO 125 N 0.16 0.00 -0.01 0.00 0.11 -1.84 0.18 132.00 130.60 1pd2 h PRO 125 Ca 0.45 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.33 1pd2 h PRO 125 Cb 0.82 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.95 1pd2 h PRO 125 CO -0.64 0.00 -0.89 0.45 -0.21 0.00 0.00 178.00 176.72 1pd2 h HIS 126 N 0.00 0.92 -0.19 0.65 3.86 -1.17 -1.80 115.15 117.42 1pd2 h HIS 126 Ca 0.17 -0.49 -0.02 0.00 -1.16 0.00 0.00 60.37 58.87 1pd2 h HIS 126 Cb 0.73 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 1pd2 h HIS 126 CO 0.00 1.32 0.04 1.25 0.86 0.00 0.00 177.93 181.40 1pd2 h LEU 127 N 0.25 0.30 -1.09 2.43 7.12 -1.01 -2.47 115.31 120.84 1pd2 h LEU 127 Ca -0.11 -0.25 -0.02 0.00 0.13 0.00 0.00 57.88 57.63 1pd2 h LEU 127 Cb 1.56 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 41.57 1pd2 h LEU 127 CO 0.18 0.48 0.39 -0.07 -0.13 0.00 0.00 178.44 179.28 1pd2 h LEU 128 N 0.11 0.91 -0.45 2.25 3.38 -0.74 0.03 115.31 120.81 1pd2 h LEU 128 Ca 0.06 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 1pd2 h LEU 128 Cb 0.30 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1pd2 h LEU 128 CO 0.00 0.75 -0.47 0.07 0.09 0.00 0.00 178.44 178.88 1pd2 h LYS 129 N 1.02 0.76 -0.39 1.13 -0.00 -1.24 0.69 116.57 118.55 1pd2 h LYS 129 Ca 0.26 -0.44 -0.10 0.00 -0.00 0.00 0.00 60.65 60.36 1pd2 h LYS 129 Cb 0.05 0.03 -0.01 0.00 -0.00 0.00 0.00 32.23 32.30 1pd2 h LYS 129 CO -0.04 1.07 -0.16 -0.44 -0.00 0.00 0.00 179.45 179.88 1pd2 h ASP 130 N 0.61 0.81 -0.51 7.07 3.32 -1.04 0.64 116.42 127.31 1pd2 h ASP 130 Ca 0.03 -0.39 -0.01 0.00 0.02 0.00 0.00 57.03 56.68 1pd2 h ASP 130 Cb 1.04 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 1pd2 h ASP 130 CO 0.10 1.02 0.27 0.25 -1.72 0.00 0.00 179.24 179.16 1pd2 h LEU 131 N 0.60 0.64 -0.36 1.55 5.85 -0.91 0.27 115.31 122.95 1pd2 h LEU 131 Ca 0.09 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1pd2 h LEU 131 Cb 0.70 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1pd2 h LEU 131 CO 0.05 0.56 0.16 -0.78 -0.34 0.00 0.00 178.44 178.09 1pd2 h ASP 132 N 0.67 0.48 -0.64 1.25 3.58 -0.70 -0.27 116.42 120.80 1pd2 h ASP 132 Ca 0.18 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 1pd2 h ASP 132 Cb 0.07 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 40.97 1pd2 h ASP 132 CO -0.03 0.49 0.35 0.74 -2.88 0.00 0.00 179.24 177.92 1pd2 h THR 133 N 0.43 1.20 0.13 2.25 2.02 -0.48 -0.65 112.91 117.81 1pd2 h THR 133 Ca 0.12 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1pd2 h THR 133 Cb 0.15 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1pd2 h THR 133 CO -0.01 0.22 -0.06 0.22 0.37 0.00 0.00 175.52 176.25 1pd2 h TYR 134 N 0.87 -0.16 -0.73 3.16 3.20 -0.06 -2.51 116.97 120.75 1pd2 h TYR 134 Ca 0.23 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.11 1pd2 h TYR 134 Cb 0.04 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.32 1pd2 h TYR 134 CO -0.01 -0.08 0.48 1.25 -1.64 0.00 0.00 178.16 178.16 1pd2 h LEU 135 N -0.19 0.81 0.00 2.82 5.85 -0.81 -3.46 115.31 120.32 1pd2 h LEU 135 Ca -0.02 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1pd2 h LEU 135 Cb 0.15 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1pd2 h LEU 135 CO 0.03 0.58 0.00 0.61 -0.34 0.00 0.00 178.44 179.31 1pd2 n GLY 136 N -1.43 3.17 1.09 3.75 0.00 -0.27 -1.52 105.19 109.98 1pd2 n GLY 136 Ca 0.08 0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1pd2 n GLY 136 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pd2 n ASP 137 N 3.64 4.13 -4.72 1.61 8.00 -1.26 -4.99 116.55 122.96 1pd2 n ASP 137 Ca 0.00 -2.79 -0.30 0.00 0.71 0.00 0.00 54.79 52.41 1pd2 n ASP 137 Cb 0.00 -0.52 0.13 0.00 -0.02 0.00 0.00 41.12 40.71 1pd2 n ASP 137 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1pd2 s LYS 138 N -2.44 1.36 0.07 -1.24 1.02 -0.58 -4.94 119.74 112.99 1pd2 s LYS 138 Ca 0.42 0.86 -0.13 0.00 0.02 0.00 0.00 55.97 57.15 1pd2 s LYS 138 Cb 0.32 -1.82 -0.24 0.00 -0.52 0.00 0.00 37.83 35.57 1pd2 s LYS 138 CO 0.13 -2.18 1.16 0.93 -0.92 0.00 0.00 175.35 174.47 1pd2 h GLU 139 N -1.51 0.62 -4.98 1.68 5.08 -1.83 -3.47 114.58 110.18 1pd2 h GLU 139 Ca -0.49 -0.75 -0.38 0.00 -1.00 0.00 0.00 59.36 56.75 1pd2 h GLU 139 Cb 1.28 0.23 -0.14 0.00 0.50 0.00 0.00 28.75 30.62 1pd2 h GLU 139 CO 0.54 1.32 -0.62 -1.58 -1.00 0.00 0.00 179.01 177.68 1pd2 s TRP 140 N -3.14 1.62 0.21 4.33 0.52 -0.50 -4.91 118.94 117.08 1pd2 s TRP 140 Ca -0.09 -1.10 -0.12 0.00 0.02 0.00 0.00 56.10 54.82 1pd2 s TRP 140 Cb 0.07 -0.98 0.27 0.00 -1.15 0.00 0.00 33.47 31.68 1pd2 s TRP 140 CO 0.92 -0.22 1.65 0.74 0.02 0.00 0.00 176.95 180.06 1pd2 h PHE 141 N 2.35 -0.12 0.05 -1.98 0.04 -1.90 -2.61 116.94 112.76 1pd2 h PHE 141 Ca -0.39 0.05 -0.23 0.00 2.80 0.00 0.00 57.97 60.20 1pd2 h PHE 141 Cb 1.24 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.53 1pd2 h PHE 141 CO 0.50 -0.19 -1.06 0.97 -0.60 0.00 0.00 178.31 177.92 1pd2 h ILE 142 N 0.08 1.58 0.00 -0.55 6.09 -1.97 -3.45 117.51 119.29 1pd2 h ILE 142 Ca 0.31 -3.07 0.00 0.00 -1.37 0.00 0.00 64.86 60.73 1pd2 h ILE 142 Cb 0.50 2.79 0.00 0.00 0.47 0.00 0.00 36.82 40.58 1pd2 h ILE 142 CO -0.55 0.89 0.00 0.61 -3.07 0.00 0.00 178.15 176.02 1pd2 n GLY 143 N 1.29 -0.65 1.63 8.18 0.00 -0.99 -4.95 105.19 109.70 1pd2 n GLY 143 Ca -0.04 0.20 0.08 0.00 0.00 0.00 0.00 46.02 46.26 1pd2 n GLY 143 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pd2 n ASN 144 N 0.00 5.02 -3.90 1.61 2.04 -1.26 -1.41 115.26 117.36 1pd2 n ASN 144 Ca 0.00 -2.65 -0.11 0.00 -0.44 0.00 0.00 54.58 51.38 1pd2 n ASN 144 Cb 0.00 -0.61 -0.12 0.00 -2.53 0.00 0.00 39.78 36.52 1pd2 n ASN 144 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 1pd2 s TYR 145 N -2.23 0.06 0.28 -2.53 1.13 -1.26 -4.96 117.35 107.84 1pd2 s TYR 145 Ca 0.51 -0.12 -0.29 0.00 -1.41 0.00 0.00 57.07 55.76 1pd2 s TYR 145 Cb 0.36 -0.06 -0.10 0.00 -1.10 0.00 0.00 41.96 41.06 1pd2 s TYR 145 CO 0.20 -0.12 1.23 0.54 -2.51 0.00 0.00 175.55 174.89 1pd2 s VAL 146 N -0.67 3.11 0.30 -3.49 0.11 -1.26 -4.67 120.40 113.82 1pd2 s VAL 146 Ca -0.07 1.06 0.03 0.00 -2.93 0.00 0.00 61.98 60.07 1pd2 s VAL 146 Cb -0.05 -3.68 -0.06 0.00 -1.53 0.00 0.00 36.38 31.07 1pd2 s VAL 146 CO -0.00 0.23 0.05 0.42 -3.33 0.00 0.00 175.10 172.47 1pd2 s THR 147 N -0.87 1.07 -1.30 5.04 -4.23 -1.26 -4.34 115.64 109.75 1pd2 s THR 147 Ca 0.49 -2.01 0.13 0.00 -1.18 0.00 0.00 61.69 59.12 1pd2 s THR 147 Cb -0.36 -2.68 0.19 0.00 1.34 0.00 0.00 72.50 70.99 1pd2 s THR 147 CO 0.45 -0.06 1.35 -2.67 -0.54 0.00 0.00 174.62 173.16 1pd2 n TRP 148 N -0.60 0.00 -0.12 3.99 4.27 -0.28 -2.05 117.44 122.64 1pd2 n TRP 148 Ca -0.02 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.46 1pd2 n TRP 148 Cb 0.66 -0.35 -0.03 0.00 -1.36 0.00 0.00 31.31 30.23 1pd2 n TRP 148 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1pd2 h ALA 149 N 2.56 0.54 -0.53 -1.67 0.00 -1.85 -1.91 119.26 116.39 1pd2 h ALA 149 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 1pd2 h ALA 149 Cb 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1pd2 h ALA 149 CO 0.00 0.61 -0.01 -0.44 0.00 0.00 0.00 179.25 179.40 1pd2 h ASP 150 N 0.69 0.89 -0.50 0.00 3.32 -1.82 -1.15 116.42 117.85 1pd2 h ASP 150 Ca 0.06 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1pd2 h ASP 150 Cb 0.93 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1pd2 h ASP 150 CO 0.09 0.95 0.31 -0.26 -1.72 0.00 0.00 179.24 178.61 1pd2 h PHE 151 N 0.84 0.64 -0.60 4.55 -1.00 -1.53 -2.25 116.94 117.59 1pd2 h PHE 151 Ca 0.15 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.90 1pd2 h PHE 151 Cb 0.52 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.84 1pd2 h PHE 151 CO 0.03 0.43 0.21 -0.92 -1.61 0.00 0.00 178.31 176.46 1pd2 h TYR 152 N 0.67 0.90 -0.60 -0.55 3.20 -0.84 0.75 116.97 120.50 1pd2 h TYR 152 Ca 0.18 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 1pd2 h TYR 152 Cb -0.03 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 37.94 1pd2 h TYR 152 CO -0.03 0.71 0.09 2.35 -1.64 0.00 0.00 178.16 179.64 1pd2 h TRP 153 N 0.87 1.03 -0.49 -3.82 2.91 -0.92 0.10 115.95 115.63 1pd2 h TRP 153 Ca 0.20 -0.13 -0.10 0.00 1.13 0.00 0.00 58.89 59.99 1pd2 h TRP 153 Cb 0.21 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 28.56 1pd2 h TRP 153 CO 0.01 0.87 -0.10 0.22 -1.03 0.00 0.00 178.44 178.42 1pd2 h ASP 154 N 0.92 0.93 -0.40 2.65 3.58 -0.76 -0.78 116.42 122.56 1pd2 h ASP 154 Ca 0.19 -0.35 -0.04 0.00 0.42 0.00 0.00 57.03 57.25 1pd2 h ASP 154 Cb 0.40 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 1pd2 h ASP 154 CO 0.01 1.07 0.11 0.40 -2.88 0.00 0.00 179.24 177.94 1pd2 h ILE 155 N 0.79 1.22 -0.23 2.25 2.04 -0.47 -2.36 117.51 120.74 1pd2 h ILE 155 Ca 0.13 -0.76 -0.08 0.00 1.00 0.00 0.00 64.86 65.14 1pd2 h ILE 155 Cb 0.65 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1pd2 h ILE 155 CO 0.04 0.27 -0.18 0.00 0.00 0.00 0.00 178.15 178.28 1pd2 h SER 157 N 0.24 0.00 0.39 0.00 4.64 -1.16 -2.05 113.55 115.60 1pd2 h SER 157 Ca 0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1pd2 h SER 157 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1pd2 h SER 157 CO 0.05 0.22 -0.19 0.74 -0.87 0.00 0.00 176.83 176.78 1pd2 h THR 158 N 0.00 0.62 -0.46 2.95 2.02 -1.30 -0.49 112.91 116.25 1pd2 h THR 158 Ca -0.00 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1pd2 h THR 158 Cb 0.42 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1pd2 h THR 158 CO 0.03 0.03 0.26 0.74 0.37 0.00 0.00 175.52 176.95 1pd2 h THR 159 N -0.59 1.16 -0.66 3.16 2.02 -1.52 -2.58 112.91 113.90 1pd2 h THR 159 Ca -0.05 -0.40 0.06 0.00 0.77 0.00 0.00 66.41 66.78 1pd2 h THR 159 Cb 0.44 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 1pd2 h THR 159 CO 0.09 0.17 0.43 -0.07 0.37 0.00 0.00 175.52 176.51 1pd2 h LEU 160 N 0.61 0.60 -0.93 2.58 3.38 -1.21 0.21 115.31 120.56 1pd2 h LEU 160 Ca 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1pd2 h LEU 160 Cb 0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1pd2 h LEU 160 CO -0.03 0.39 -0.10 -0.07 0.09 0.00 0.00 178.44 178.73 1pd2 h LEU 161 N 0.69 0.00 -0.58 1.67 3.38 -0.71 0.14 115.31 119.89 1pd2 h LEU 161 Ca 0.28 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.09 1pd2 h LEU 161 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1pd2 h LEU 161 CO -0.09 0.10 -0.63 0.58 0.09 0.00 0.00 178.44 178.49 1pd2 h VAL 162 N 0.00 1.39 0.17 1.22 2.07 -0.64 -2.71 116.25 117.75 1pd2 h VAL 162 Ca -0.00 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.48 1pd2 h VAL 162 Cb 0.75 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1pd2 h VAL 162 CO 0.01 0.60 -0.08 -0.07 0.02 0.00 0.00 177.57 178.05 1pd2 h LEU 163 N 0.21 -0.19 -7.04 2.57 4.07 -0.72 -3.42 115.31 110.78 1pd2 h LEU 163 Ca -0.01 0.01 -0.61 0.00 0.08 0.00 0.00 57.88 57.34 1pd2 h LEU 163 Cb 1.16 0.05 -0.40 0.00 1.08 0.00 0.00 40.66 42.55 1pd2 h LEU 163 CO 0.10 0.28 -0.72 -0.75 -1.08 0.00 0.00 178.44 176.27 1pd2 s LYS 164 N -2.28 1.39 0.48 1.13 2.20 0.41 -5.00 119.74 118.08 1pd2 s LYS 164 Ca -0.03 -2.10 0.35 0.00 -0.36 0.00 0.00 55.97 53.82 1pd2 s LYS 164 Cb 0.00 -2.48 1.48 0.00 -1.51 0.00 0.00 37.83 35.33 1pd2 s LYS 164 CO 0.10 -1.16 1.67 -1.35 -0.36 0.00 0.00 175.35 174.26 1pd2 h PRO 165 N 6.68 0.09 -0.69 4.03 0.11 -1.71 0.23 132.00 140.74 1pd2 h PRO 165 Ca -0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1pd2 h PRO 165 Cb 0.92 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1pd2 h PRO 165 CO 0.51 0.06 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 1pd2 n ASP 166 N -4.39 4.50 -0.35 -2.05 5.75 -1.26 -4.61 116.55 114.15 1pd2 n ASP 166 Ca 0.35 -2.29 0.09 0.00 -0.01 0.00 0.00 54.79 52.92 1pd2 n ASP 166 Cb 1.45 -0.55 0.28 0.00 -1.03 0.00 0.00 41.12 41.26 1pd2 n ASP 166 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1pd2 h LEU 167 N 4.20 0.86 -1.53 -2.12 5.85 -0.88 -2.57 115.31 119.12 1pd2 h LEU 167 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1pd2 h LEU 167 Cb 1.30 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1pd2 h LEU 167 CO 0.15 0.43 0.00 0.18 -0.34 0.00 0.00 178.44 178.86 1pd2 n LEU 168 N -4.63 2.33 -0.34 2.25 4.77 -1.26 -4.53 117.00 115.58 1pd2 n LEU 168 Ca 0.20 -0.91 0.26 0.00 -0.03 0.00 0.00 56.01 55.52 1pd2 n LEU 168 Cb 0.41 -0.10 0.54 0.00 -2.33 0.00 0.00 43.42 41.94 1pd2 n LEU 168 CO 0.27 0.46 1.22 1.23 -1.33 0.00 0.00 177.39 179.23 1pd2 h GLY 169 N 4.81 1.23 0.28 -0.72 0.00 -1.79 0.96 103.07 107.85 1pd2 h GLY 169 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1pd2 h GLY 169 CO 0.00 -0.19 -0.13 1.39 0.00 0.00 0.00 176.54 177.61 1pd2 n ILE 170 N -4.64 0.00 -3.73 2.60 2.08 -1.26 -4.55 119.36 109.85 1pd2 n ILE 170 Ca 0.28 -0.13 -0.28 0.00 0.56 0.00 0.00 62.75 63.18 1pd2 n ILE 170 Cb 0.99 0.23 -0.11 0.00 -0.75 0.00 0.00 39.64 39.99 1pd2 n ILE 170 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 1pd2 n TYR 171 N -0.53 2.82 -0.04 1.39 4.01 0.33 -4.93 117.16 120.21 1pd2 n TYR 171 Ca 0.15 -4.16 0.03 0.00 -0.16 0.00 0.00 57.90 53.76 1pd2 n TYR 171 Cb 0.31 -0.52 0.38 0.00 -0.31 0.00 0.00 39.34 39.21 1pd2 n TYR 171 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1pd2 h PRO 172 N 5.11 0.62 -0.63 -0.72 0.13 -1.80 -1.56 132.00 133.15 1pd2 h PRO 172 Ca 0.17 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 65.18 1pd2 h PRO 172 Cb 0.75 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.72 1pd2 h PRO 172 CO 0.70 0.43 0.10 0.00 -0.23 0.00 0.00 178.00 179.00 1pd2 h ARG 173 N 0.64 1.04 -0.07 0.86 3.08 -1.94 0.36 114.38 118.35 1pd2 h ARG 173 Ca 0.17 -0.28 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 1pd2 h ARG 173 Cb -0.04 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 1pd2 h ARG 173 CO -0.03 0.97 -0.48 -0.07 -1.07 0.00 0.00 179.97 179.29 1pd2 h LEU 174 N 0.95 0.18 -0.10 3.04 4.07 -1.81 -0.86 115.31 120.78 1pd2 h LEU 174 Ca 0.19 -0.08 -0.03 0.00 0.08 0.00 0.00 57.88 58.04 1pd2 h LEU 174 Cb 0.43 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.12 1pd2 h LEU 174 CO 0.01 0.63 -0.06 0.58 -1.08 0.00 0.00 178.44 178.52 1pd2 h VAL 175 N 0.13 1.33 -0.55 1.22 2.07 -0.64 -2.54 116.25 117.28 1pd2 h VAL 175 Ca 0.01 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.42 1pd2 h VAL 175 Cb 0.90 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 1pd2 h VAL 175 CO 0.07 0.32 0.36 0.77 0.02 0.00 0.00 177.57 179.11 1pd2 h SER 176 N -0.16 0.62 -0.35 0.57 4.64 -0.10 -1.31 113.55 117.45 1pd2 h SER 176 Ca 0.02 -0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.40 1pd2 h SER 176 Cb 0.53 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 1pd2 h SER 176 CO 0.02 0.45 -0.06 0.25 -0.87 0.00 0.00 176.83 176.61 1pd2 h LEU 177 N 0.73 -0.28 -1.16 5.97 5.85 -1.10 0.95 115.31 126.27 1pd2 h LEU 177 Ca 0.20 0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 1pd2 h LEU 177 Cb -0.07 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1pd2 h LEU 177 CO -0.05 -0.10 -0.38 0.08 -0.34 0.00 0.00 178.44 177.65 1pd2 h ARG 178 N 0.03 0.06 -0.41 1.25 0.11 -1.04 -1.72 114.38 112.65 1pd2 h ARG 178 Ca 0.17 -0.03 -0.04 0.00 0.10 0.00 0.00 59.98 60.18 1pd2 h ARG 178 Cb 0.25 -0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.32 1pd2 h ARG 178 CO -0.34 0.44 0.10 -0.91 0.10 0.00 0.00 179.97 179.36 1pd2 h ASN 179 N 0.05 0.63 -0.12 0.08 2.35 -0.35 -1.07 115.58 117.16 1pd2 h ASN 179 Ca 0.00 -0.23 0.01 0.00 -0.55 0.00 0.00 56.30 55.53 1pd2 h ASN 179 Cb 0.71 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 1pd2 h ASN 179 CO 0.05 0.69 0.04 0.11 -1.65 0.00 0.00 177.43 176.68 1pd2 h LYS 180 N 0.53 0.09 -0.88 0.81 1.57 -0.31 -0.67 116.57 117.71 1pd2 h LYS 180 Ca 0.13 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1pd2 h LYS 180 Cb 0.31 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 1pd2 h LYS 180 CO 0.00 0.06 0.54 0.28 -0.57 0.00 0.00 179.45 179.77 1pd2 h VAL 181 N 0.10 1.04 0.00 0.50 2.07 -1.21 -1.21 116.25 117.53 1pd2 h VAL 181 Ca 0.05 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1pd2 h VAL 181 Cb 0.03 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.76 1pd2 h VAL 181 CO -0.05 0.18 -0.09 1.56 0.02 0.00 0.00 177.57 179.19 1pd2 h GLN 182 N 0.98 0.00 0.00 1.57 4.20 -0.50 -2.93 115.11 118.43 1pd2 h GLN 182 Ca 0.38 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.09 1pd2 h GLN 182 Cb 0.19 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 1pd2 h GLN 182 CO -0.18 0.09 -0.04 0.00 -0.67 0.00 0.00 178.83 178.03 1pd2 h ALA 183 N 1.91 0.98 -2.25 3.87 0.00 0.12 -3.27 119.26 120.62 1pd2 h ALA 183 Ca -0.00 -0.02 -0.58 0.00 0.00 0.00 0.00 54.91 54.31 1pd2 h ALA 183 Cb 0.58 -0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.41 1pd2 h ALA 183 CO 0.01 0.02 1.00 -0.89 0.00 0.00 0.00 179.25 179.39 1pd2 n ILE 184 N -3.09 0.32 -0.22 0.00 5.41 -1.11 -4.76 119.36 115.91 1pd2 n ILE 184 Ca 0.04 -0.06 -0.02 0.00 1.00 0.00 0.00 62.75 63.71 1pd2 n ILE 184 Cb 0.54 -1.83 0.05 0.00 -0.71 0.00 0.00 39.64 37.69 1pd2 n ILE 184 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1pd2 h PRO 185 N 7.88 -0.06 -0.66 0.38 0.11 -1.90 0.75 132.00 138.49 1pd2 h PRO 185 Ca -0.47 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.66 1pd2 h PRO 185 Cb 1.25 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1pd2 h PRO 185 CO 0.93 -0.04 0.44 0.00 -0.21 0.00 0.00 178.00 179.11 1pd2 h ALA 186 N 1.42 1.56 -0.05 -0.75 0.00 -1.89 -1.41 119.26 118.14 1pd2 h ALA 186 Ca 0.29 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.05 1pd2 h ALA 186 Cb 0.53 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1pd2 h ALA 186 CO -0.70 0.39 -0.41 0.82 0.00 0.00 0.00 179.25 179.35 1pd2 h ILE 187 N 0.86 1.43 -0.79 0.00 1.08 -1.44 -2.66 117.51 115.99 1pd2 h ILE 187 Ca 0.25 -1.85 0.11 0.00 -0.39 0.00 0.00 64.86 62.98 1pd2 h ILE 187 Cb -0.05 2.40 -0.08 0.00 -3.07 0.00 0.00 36.82 36.03 1pd2 h ILE 187 CO -0.06 0.53 0.41 0.28 -0.69 0.00 0.00 178.15 178.63 1pd2 h SER 188 N -0.12 0.55 -0.39 1.72 0.02 -0.57 0.19 113.55 114.95 1pd2 h SER 188 Ca -0.04 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 1pd2 h SER 188 Cb 1.08 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 1pd2 h SER 188 CO 0.08 0.29 0.08 0.00 -1.14 0.00 0.00 176.83 176.14 1pd2 h ALA 189 N 1.48 0.51 0.16 3.77 0.00 -1.27 -1.70 119.26 122.21 1pd2 h ALA 189 Ca 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1pd2 h ALA 189 Cb 0.45 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1pd2 h ALA 189 CO -0.29 0.20 -0.08 2.35 0.00 0.00 0.00 179.25 181.44 1pd2 h TRP 190 N 0.49 -0.20 -0.82 0.00 -0.00 -0.92 -1.01 115.95 113.49 1pd2 h TRP 190 Ca 0.12 -0.00 0.14 0.00 -0.00 0.00 0.00 58.89 59.15 1pd2 h TRP 190 Cb 0.33 0.07 -0.09 0.00 -0.00 0.00 0.00 29.16 29.47 1pd2 h TRP 190 CO 0.02 -0.08 0.40 0.82 -0.00 0.00 0.00 178.44 179.61 1pd2 h ILE 191 N -0.28 0.73 -0.37 2.65 2.04 -0.57 0.39 117.51 122.09 1pd2 h ILE 191 Ca -0.02 -0.20 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 1pd2 h ILE 191 Cb 0.21 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1pd2 h ILE 191 CO 0.04 0.11 -0.32 -0.07 0.00 0.00 0.00 178.15 177.90 1pd2 h LEU 192 N 0.59 0.87 0.00 1.44 3.38 -0.97 -3.25 115.31 117.36 1pd2 h LEU 192 Ca 0.44 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1pd2 h LEU 192 Cb 0.62 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1pd2 h LEU 192 CO -0.36 1.12 -0.62 0.07 0.09 0.00 0.00 178.44 178.74 1pd2 h LYS 193 N 0.70 0.00 -6.90 1.13 2.10 -0.47 -3.48 116.57 109.66 1pd2 h LYS 193 Ca 0.07 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 58.19 1pd2 h LYS 193 Cb 0.88 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.30 1pd2 h LYS 193 CO 0.08 0.00 0.75 0.50 -2.00 0.00 0.00 179.45 178.78 1pd2 s ARG 194 N -3.30 4.19 0.15 0.07 3.52 0.13 -4.91 118.95 118.80 1pd2 s ARG 194 Ca 0.02 2.46 -0.34 0.00 -0.13 0.00 0.00 55.73 57.75 1pd2 s ARG 194 Cb 0.08 -3.01 -0.14 0.00 -1.56 0.00 0.00 34.95 30.32 1pd2 s ARG 194 CO 0.74 -0.44 1.61 -2.30 -0.81 0.00 0.00 175.30 174.10 1pd2 n PRO 195 N 0.87 2.21 -2.17 5.12 -0.02 -1.26 -4.90 135.00 134.85 1pd2 n PRO 195 Ca 0.02 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 1pd2 n PRO 195 Cb 0.40 -2.58 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 1pd2 n PRO 195 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1pd2 s GLN 196 N 1.17 4.23 0.04 -0.52 -0.21 -1.26 -4.96 119.66 118.15 1pd2 s GLN 196 Ca 0.79 2.00 -0.11 0.00 0.02 0.00 0.00 55.36 58.07 1pd2 s GLN 196 Cb -0.66 -3.78 0.01 0.00 1.00 0.00 0.00 33.01 29.57 1pd2 s GLN 196 CO 0.38 -0.72 0.23 -0.08 -2.12 0.00 0.00 175.29 172.98 1pd2 s THR 197 N 3.32 0.10 -0.02 -0.19 -1.32 -1.26 -5.09 115.64 111.18 1pd2 s THR 197 Ca 0.66 -0.85 -0.23 0.00 -1.21 0.00 0.00 61.69 60.07 1pd2 s THR 197 Cb -0.30 -0.95 -0.23 0.00 -1.51 0.00 0.00 72.50 69.51 1pd2 s THR 197 CO 0.25 -0.47 1.08 0.50 -2.21 0.00 0.00 174.62 173.78 1pd2 h LYS 198 N 3.33 0.26 -0.00 7.08 3.64 -1.93 -3.48 116.57 125.47 1pd2 h LYS 198 Ca -0.32 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1pd2 h LYS 198 Cb 1.19 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1pd2 h LYS 198 CO 0.48 0.96 0.00 1.28 -2.27 0.00 0.00 179.45 179.90