#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 2.76 -0.05 0.03 0.04 -1.26 -5.05 135.00 131.47 1pd2 s PRO 2 Ca 0.00 0.32 -0.18 0.00 0.04 0.00 0.00 61.00 61.18 1pd2 s PRO 2 Cb 0.00 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 1pd2 s PRO 2 CO 0.00 -1.04 0.48 1.21 0.04 0.00 0.00 177.00 177.69 1pd2 s ASN 3 N -4.38 6.79 0.01 6.66 2.47 -1.26 -4.93 114.94 120.31 1pd2 s ASN 3 Ca 0.58 0.94 0.08 0.00 0.42 0.00 0.00 52.86 54.88 1pd2 s ASN 3 Cb -0.11 -2.29 -0.02 0.00 -1.45 0.00 0.00 41.25 37.38 1pd2 s ASN 3 CO 0.50 0.14 -0.24 -0.31 -3.72 0.00 0.00 177.10 173.47 1pd2 s TYR 4 N -0.15 2.13 -0.22 0.43 2.02 -1.26 -3.84 117.35 116.45 1pd2 s TYR 4 Ca 0.26 -0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 56.56 1pd2 s TYR 4 Cb -0.16 -1.33 0.06 0.00 -0.40 0.00 0.00 41.96 40.13 1pd2 s TYR 4 CO 0.13 0.03 -0.01 0.15 -1.57 0.00 0.00 175.55 174.28 1pd2 s LYS 5 N -0.85 1.23 -0.05 -0.62 1.02 -0.56 -0.62 119.74 119.29 1pd2 s LYS 5 Ca 0.10 -0.80 -0.18 0.00 0.02 0.00 0.00 55.97 55.11 1pd2 s LYS 5 Cb -0.09 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.77 1pd2 s LYS 5 CO 0.00 -0.64 0.49 -1.17 -0.92 0.00 0.00 175.35 173.12 1pd2 s LEU 6 N 1.57 4.37 -0.12 3.17 0.20 -0.23 -0.36 118.68 127.27 1pd2 s LEU 6 Ca -0.03 0.96 0.01 0.00 0.69 0.00 0.00 54.13 55.76 1pd2 s LEU 6 Cb -0.18 -2.73 0.02 0.00 -0.43 0.00 0.00 46.19 42.86 1pd2 s LEU 6 CO -0.08 0.12 -0.15 -0.22 -0.29 0.00 0.00 176.35 175.73 1pd2 s LEU 7 N -0.06 1.74 0.00 -0.68 1.98 -0.56 -1.40 118.68 119.69 1pd2 s LEU 7 Ca 0.27 -0.46 -0.17 0.00 -2.89 0.00 0.00 54.13 50.87 1pd2 s LEU 7 Cb -0.16 -1.15 0.06 0.00 0.66 0.00 0.00 46.19 45.60 1pd2 s LEU 7 CO 0.13 -0.00 0.86 0.00 -1.89 0.00 0.00 176.35 175.45 1pd2 n TYR 8 N 4.39 -1.59 -1.70 5.38 9.36 -0.93 -2.53 117.16 129.55 1pd2 n TYR 8 Ca -0.18 -1.32 -0.31 0.00 3.32 0.00 0.00 57.90 59.41 1pd2 n TYR 8 Cb 0.51 0.65 0.05 0.00 -0.63 0.00 0.00 39.34 39.92 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 -2.61 3.20 -1.27 2.98 0.08 -1.26 -0.60 117.98 118.50 1pd2 s PHE 9 Ca 0.19 1.25 -0.19 0.00 0.12 0.00 0.00 56.93 58.30 1pd2 s PHE 9 Cb -0.03 -2.94 0.02 0.00 -0.57 0.00 0.00 43.02 39.50 1pd2 s PHE 9 CO 0.07 -1.23 1.85 -1.71 -0.10 0.00 0.00 175.22 174.10 1pd2 n ASN 10 N -3.09 4.28 -3.63 1.36 5.15 -1.03 -4.61 115.26 113.69 1pd2 n ASN 10 Ca 0.07 -2.85 -0.07 0.00 -0.60 0.00 0.00 54.58 51.13 1pd2 n ASN 10 Cb 0.55 -1.71 -0.02 0.00 -0.53 0.00 0.00 39.78 38.08 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 4.62 1.11 0.01 1.20 0.23 -1.26 -4.97 119.30 120.25 1pd2 s MET 11 Ca 0.56 -0.53 -0.19 0.00 -1.03 0.00 0.00 55.69 54.50 1pd2 s MET 11 Cb 0.05 0.43 -0.11 0.00 -1.53 0.00 0.00 34.83 33.68 1pd2 s MET 11 CO 0.07 -0.50 0.98 0.00 -2.03 0.00 0.00 175.02 173.54 1pd2 h ARG 12 N 2.00 -0.67 0.00 3.16 3.08 -1.24 -3.44 114.38 117.26 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 1.25 0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.45 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 -0.46 1.94 0.22 0.04 0.00 -1.25 -1.40 105.19 104.27 1pd2 n GLY 13 Ca -0.09 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.28 114.38 113.22 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 0.12 -0.55 0.00 0.56 0.00 0.00 179.97 180.10 1pd2 h ALA 15 N 1.88 0.66 -0.61 0.04 0.00 -1.82 -3.38 119.26 116.04 1pd2 h ALA 15 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 1pd2 h ALA 15 Cb 0.96 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1pd2 h ALA 15 CO 0.02 0.00 0.41 1.49 0.00 0.00 0.00 179.25 181.17 1pd2 h GLU 16 N 0.00 0.33 -0.49 0.00 4.57 -1.30 -0.91 114.58 116.79 1pd2 h GLU 16 Ca 0.00 -0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.08 1pd2 h GLU 16 Cb 0.81 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.31 1pd2 h GLU 16 CO 0.00 0.22 -0.01 0.97 -1.18 0.00 0.00 179.01 179.01 1pd2 h ILE 17 N 0.34 1.25 -0.39 2.32 6.09 -1.84 -1.01 117.51 124.28 1pd2 h ILE 17 Ca 0.29 -1.03 -0.06 0.00 -1.37 0.00 0.00 64.86 62.69 1pd2 h ILE 17 Cb 0.66 0.88 -0.01 0.00 0.47 0.00 0.00 36.82 38.82 1pd2 h ILE 17 CO -0.07 0.36 0.01 0.40 -3.07 0.00 0.00 178.15 175.78 1pd2 h ILE 18 N 0.76 1.26 -0.22 2.19 2.04 -1.45 -2.36 117.51 119.72 1pd2 h ILE 18 Ca 0.15 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 1pd2 h ILE 18 Cb 0.47 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1pd2 h ILE 18 CO 0.02 0.33 -0.01 0.03 0.00 0.00 0.00 178.15 178.53 1pd2 h ARG 19 N 0.51 0.33 -0.12 2.37 3.08 -1.08 -1.28 114.38 118.18 1pd2 h ARG 19 Ca 0.11 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1pd2 h ARG 19 Cb 0.46 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1pd2 h ARG 19 CO 0.02 0.37 -0.05 1.88 -1.07 0.00 0.00 179.97 181.11 1pd2 h TYR 20 N 0.32 0.29 -0.40 3.04 -1.99 -0.89 -2.32 116.97 115.03 1pd2 h TYR 20 Ca 0.07 -0.07 0.01 0.00 2.00 0.00 0.00 58.73 60.74 1pd2 h TYR 20 Cb 0.23 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 38.87 1pd2 h TYR 20 CO 0.01 0.59 0.26 0.82 -0.00 0.00 0.00 178.16 179.83 1pd2 h ILE 21 N -0.08 1.09 -0.34 -2.88 2.04 -1.18 0.07 117.51 116.23 1pd2 h ILE 21 Ca 0.03 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.71 1pd2 h ILE 21 Cb 0.51 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1pd2 h ILE 21 CO 0.02 0.10 0.22 -0.26 0.00 0.00 0.00 178.15 178.22 1pd2 h PHE 22 N 0.53 0.41 -0.23 1.37 0.04 -1.28 -0.57 116.94 117.22 1pd2 h PHE 22 Ca 0.15 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.96 1pd2 h PHE 22 Cb -0.05 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 37.93 1pd2 h PHE 22 CO -0.05 0.25 0.03 0.00 -0.60 0.00 0.00 178.31 177.94 1pd2 h ALA 23 N 1.14 0.22 -0.41 2.45 0.00 -1.00 0.16 119.26 121.82 1pd2 h ALA 23 Ca 0.13 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1pd2 h ALA 23 Cb -0.03 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1pd2 h ALA 23 CO -0.04 -0.39 0.18 -0.92 0.00 0.00 0.00 179.25 178.07 1pd2 h TYR 24 N 0.12 0.61 -0.02 0.00 3.20 -0.77 -1.92 116.97 118.19 1pd2 h TYR 24 Ca 0.10 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1pd2 h TYR 24 Cb 0.11 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.19 1pd2 h TYR 24 CO -0.16 0.53 0.00 1.28 -1.64 0.00 0.00 178.16 178.17 1pd2 n LEU 25 N -4.65 0.35 -3.65 2.82 4.77 -0.24 -4.91 117.00 111.49 1pd2 n LEU 25 Ca 0.00 -0.13 -0.27 0.00 -0.03 0.00 0.00 56.01 55.58 1pd2 n LEU 25 Cb 0.13 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1pd2 n LEU 25 CO 0.37 0.06 0.11 -0.67 -1.33 0.00 0.00 177.39 175.93 1pd2 n ASP 26 N -0.66 -5.27 -4.67 -1.43 2.03 0.38 -4.94 116.55 102.00 1pd2 n ASP 26 Ca 0.19 -0.61 -0.38 0.00 0.52 0.00 0.00 54.79 54.52 1pd2 n ASP 26 Cb 0.15 -4.20 -0.08 0.00 -0.72 0.00 0.00 41.12 36.26 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 -3.24 5.25 0.43 5.18 1.01 -0.24 -5.02 121.20 124.57 1pd2 s ILE 27 Ca 0.57 0.55 -0.23 0.00 0.00 0.00 0.00 60.65 61.54 1pd2 s ILE 27 Cb -0.28 -3.66 -0.08 0.00 0.01 0.00 0.00 42.46 38.45 1pd2 s ILE 27 CO 0.70 0.28 1.07 -0.54 0.00 0.00 0.00 174.94 176.45 1pd2 s LYS 28 N 1.24 3.98 0.13 2.79 1.02 -1.26 -4.65 119.74 122.99 1pd2 s LYS 28 Ca 0.16 1.54 -0.24 0.00 0.02 0.00 0.00 55.97 57.44 1pd2 s LYS 28 Cb -0.14 -2.40 0.07 0.00 -0.52 0.00 0.00 37.83 34.83 1pd2 s LYS 28 CO 0.07 -0.30 0.70 1.52 -0.92 0.00 0.00 175.35 176.41 1pd2 s TYR 29 N -1.71 -0.44 -0.23 3.18 1.13 -1.26 -4.36 117.35 113.66 1pd2 s TYR 29 Ca 0.61 0.22 -0.18 0.00 -1.41 0.00 0.00 57.07 56.32 1pd2 s TYR 29 Cb -0.22 0.57 -0.03 0.00 -1.10 0.00 0.00 41.96 41.18 1pd2 s TYR 29 CO 0.27 -0.81 0.49 -2.00 -2.51 0.00 0.00 175.55 170.99 1pd2 s GLU 30 N -3.59 4.13 -1.15 -3.49 2.12 0.21 -4.98 118.70 111.95 1pd2 s GLU 30 Ca 0.03 0.32 -0.12 0.00 0.36 0.00 0.00 54.97 55.57 1pd2 s GLU 30 Cb -0.01 -3.60 0.22 0.00 0.26 0.00 0.00 34.13 31.00 1pd2 s GLU 30 CO -0.10 -0.21 1.27 0.34 -0.54 0.00 0.00 175.26 176.02 1pd2 s ASP 31 N 1.30 7.17 -0.47 -1.70 2.15 -1.26 -1.07 116.67 122.80 1pd2 s ASP 31 Ca 0.22 -3.25 -0.29 0.00 0.43 0.00 0.00 52.55 49.66 1pd2 s ASP 31 Cb -0.15 -2.31 0.03 0.00 -0.30 0.00 0.00 42.92 40.18 1pd2 s ASP 31 CO 0.09 -0.54 1.20 -2.28 -0.17 0.00 0.00 175.17 173.48 1pd2 s HIS 32 N 0.28 2.71 -0.11 -5.34 5.65 -0.49 -5.01 115.29 112.97 1pd2 s HIS 32 Ca 0.37 0.69 -0.04 0.00 0.25 0.00 0.00 55.06 56.33 1pd2 s HIS 32 Cb -0.06 -4.42 -0.03 0.00 -1.18 0.00 0.00 32.58 26.88 1pd2 s HIS 32 CO -0.04 -1.45 0.03 1.03 -0.65 0.00 0.00 174.74 173.66 1pd2 s ARG 33 N 4.60 3.24 0.22 2.88 0.52 -1.26 -2.18 118.95 126.97 1pd2 s ARG 33 Ca 0.51 -0.36 0.12 0.00 -0.52 0.00 0.00 55.73 55.47 1pd2 s ARG 33 Cb -0.08 -2.92 -0.05 0.00 0.52 0.00 0.00 34.95 32.42 1pd2 s ARG 33 CO 0.32 0.62 -0.23 0.96 0.02 0.00 0.00 175.30 176.99 1pd2 s ILE 34 N -0.65 2.39 0.33 1.52 -4.36 0.24 -4.85 121.20 115.83 1pd2 s ILE 34 Ca 0.11 -2.13 -0.06 0.00 -0.26 0.00 0.00 60.65 58.30 1pd2 s ILE 34 Cb -0.12 -2.18 -0.05 0.00 1.25 0.00 0.00 42.46 41.36 1pd2 s ILE 34 CO 0.02 -0.19 0.62 -1.61 0.24 0.00 0.00 174.94 174.02 1pd2 s GLU 35 N -2.90 3.66 0.37 0.37 0.41 -1.26 -2.45 118.70 116.89 1pd2 s GLU 35 Ca 0.23 0.12 0.11 0.00 -0.41 0.00 0.00 54.97 55.02 1pd2 s GLU 35 Cb -0.07 -2.56 0.88 0.00 -1.78 0.00 0.00 34.13 30.60 1pd2 s GLU 35 CO 0.11 0.12 1.85 1.96 -0.49 0.00 0.00 175.26 178.82 1pd2 h GLN 36 N 1.42 0.60 0.00 1.61 1.08 -2.00 -0.11 115.11 117.71 1pd2 h GLN 36 Ca -0.48 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 56.69 1pd2 h GLN 36 Cb 1.19 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 28.49 1pd2 h GLN 36 CO 0.65 0.40 -0.00 0.00 -0.95 0.00 0.00 178.83 178.93 1pd2 h ALA 37 N 1.61 1.71 0.00 3.87 0.00 -2.06 -2.23 119.26 122.16 1pd2 h ALA 37 Ca 0.47 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.18 1pd2 h ALA 37 Cb 0.86 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1pd2 h ALA 37 CO -0.22 0.00 -1.23 -0.44 0.00 0.00 0.00 179.25 177.37 1pd2 h ASP 38 N 0.00 0.00 -0.86 0.00 3.32 -1.40 -3.40 116.42 114.09 1pd2 h ASP 38 Ca -0.00 0.00 0.18 0.00 0.02 0.00 0.00 57.03 57.23 1pd2 h ASP 38 Cb 0.00 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.39 1pd2 h ASP 38 CO 0.00 0.78 -0.18 -0.25 -1.72 0.00 0.00 179.24 177.87 1pd2 h TRP 39 N 0.00 -0.40 -0.88 4.55 -0.00 -1.26 -0.93 115.95 117.04 1pd2 h TRP 39 Ca -0.13 0.08 0.21 0.00 -0.00 0.00 0.00 58.89 59.04 1pd2 h TRP 39 Cb 1.71 0.31 -0.06 0.00 -0.00 0.00 0.00 29.16 31.12 1pd2 h TRP 39 CO 0.00 -0.36 0.59 -1.35 -0.00 0.00 0.00 178.44 177.32 1pd2 h PRO 40 N 0.01 0.33 0.02 2.65 0.11 -1.77 0.13 132.00 133.48 1pd2 h PRO 40 Ca 0.42 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.29 1pd2 h PRO 40 Cb 0.67 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 1pd2 h PRO 40 CO -0.87 0.22 -0.96 0.87 -0.21 0.00 0.00 178.00 177.05 1pd2 h LYS 41 N 0.34 0.31 0.09 1.05 1.79 -1.46 -3.37 116.57 115.32 1pd2 h LYS 41 Ca 0.45 -0.36 -0.17 0.00 -2.18 0.00 0.00 60.65 58.39 1pd2 h LYS 41 Cb 1.21 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1pd2 h LYS 41 CO -0.15 1.07 -0.82 0.82 -1.08 0.00 0.00 179.45 179.29 1pd2 h ILE 42 N 0.17 1.40 -0.75 1.86 2.04 -1.10 -3.41 117.51 117.72 1pd2 h ILE 42 Ca -0.07 -2.42 0.12 0.00 1.00 0.00 0.00 64.86 63.49 1pd2 h ILE 42 Cb 1.60 3.03 -0.13 0.00 -0.74 0.00 0.00 36.82 40.58 1pd2 h ILE 42 CO 0.16 0.65 -0.27 1.17 0.00 0.00 0.00 178.15 179.86 1pd2 n LYS 43 N -4.22 -0.15 0.00 2.37 4.81 0.32 -0.82 118.16 120.47 1pd2 n LYS 43 Ca -0.18 1.16 0.04 0.00 -0.87 0.00 0.00 58.31 58.46 1pd2 n LYS 43 Cb 0.75 -1.72 0.17 0.00 0.02 0.00 0.00 35.03 34.24 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 -5.13 0.02 0.07 1.64 -0.04 -1.26 -2.33 135.00 127.96 1pd2 n PRO 44 Ca 0.09 0.35 0.11 0.00 -0.04 0.00 0.00 63.50 64.01 1pd2 n PRO 44 Cb 0.32 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.46 0.43 -2.95 0.52 -2.24 -0.00 -4.93 114.28 103.64 1pd2 n THR 45 Ca 0.02 -0.44 -0.36 0.00 -2.27 0.00 0.00 64.05 61.00 1pd2 n THR 45 Cb 0.08 -0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.08 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 -4.83 4.31 0.01 3.22 1.43 -0.98 -5.01 118.68 116.83 1pd2 s LEU 46 Ca 0.01 1.60 -0.02 0.00 -1.03 0.00 0.00 54.13 54.69 1pd2 s LEU 46 Cb 0.11 -3.83 -0.00 0.00 0.03 0.00 0.00 46.19 42.50 1pd2 s LEU 46 CO 0.79 -0.04 1.03 1.55 0.23 0.00 0.00 176.35 179.91 1pd2 h PRO 47 N 3.19 -0.01 -0.78 1.29 0.13 -1.91 -1.72 132.00 132.20 1pd2 h PRO 47 Ca -0.47 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.33 1pd2 h PRO 47 Cb 1.19 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 1pd2 h PRO 47 CO 0.65 -0.01 0.37 1.19 -0.23 0.00 0.00 178.00 179.98 1pd2 n PHE 48 N -2.99 2.47 -2.11 1.56 3.01 -1.26 -4.93 117.46 113.21 1pd2 n PHE 48 Ca -0.00 -1.52 -0.16 0.00 1.01 0.00 0.00 57.45 56.78 1pd2 n PHE 48 Cb 0.01 -0.76 -0.03 0.00 -0.01 0.00 0.00 39.48 38.70 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 -0.72 0.17 3.14 1.37 0.00 -0.65 -4.97 105.19 103.54 1pd2 n GLY 49 Ca 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.40 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 -4.50 0.84 0.28 1.61 1.02 -1.26 -4.89 119.74 112.83 1pd2 s LYS 50 Ca 0.00 -1.37 0.06 0.00 0.02 0.00 0.00 55.97 54.68 1pd2 s LYS 50 Cb 0.00 0.12 -0.06 0.00 -0.52 0.00 0.00 37.83 37.37 1pd2 s LYS 50 CO 0.00 -0.17 -0.05 0.96 -0.92 0.00 0.00 175.35 175.18 1pd2 s ILE 51 N -3.91 1.59 0.78 2.17 -4.36 -1.26 -4.61 121.20 111.60 1pd2 s ILE 51 Ca 0.17 -2.11 -0.11 0.00 -0.26 0.00 0.00 60.65 58.34 1pd2 s ILE 51 Cb 0.07 -2.48 0.06 0.00 1.25 0.00 0.00 42.46 41.36 1pd2 s ILE 51 CO -0.03 -0.27 1.08 -2.16 0.24 0.00 0.00 174.94 173.80 1pd2 s PRO 52 N -3.75 2.20 0.04 0.37 0.04 -1.26 -4.97 135.00 127.68 1pd2 s PRO 52 Ca 0.30 0.89 0.01 0.00 0.04 0.00 0.00 61.00 62.24 1pd2 s PRO 52 Cb 0.04 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.65 1pd2 s PRO 52 CO 0.12 -1.60 -0.06 0.14 0.04 0.00 0.00 177.00 175.64 1pd2 s VAL 53 N -3.02 0.42 -0.17 -0.36 -7.23 -1.05 -3.82 120.40 105.18 1pd2 s VAL 53 Ca 0.61 -1.16 0.01 0.00 -1.81 0.00 0.00 61.98 59.62 1pd2 s VAL 53 Cb -0.16 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.13 1pd2 s VAL 53 CO 0.55 -0.50 -0.18 -0.22 -0.31 0.00 0.00 175.10 174.45 1pd2 s LEU 54 N -1.77 1.95 -0.36 1.32 2.96 -0.43 -1.50 118.68 120.85 1pd2 s LEU 54 Ca -0.08 -0.58 -0.22 0.00 -0.22 0.00 0.00 54.13 53.03 1pd2 s LEU 54 Cb -0.07 -1.36 0.01 0.00 0.50 0.00 0.00 46.19 45.26 1pd2 s LEU 54 CO -0.01 -0.02 0.70 -0.70 -1.32 0.00 0.00 176.35 175.00 1pd2 s GLU 55 N 1.37 3.72 -0.21 1.98 -6.30 0.52 -0.42 118.70 119.35 1pd2 s GLU 55 Ca 0.05 0.18 0.02 0.00 -2.50 0.00 0.00 54.97 52.71 1pd2 s GLU 55 Cb -0.13 -3.81 0.04 0.00 0.00 0.00 0.00 34.13 30.24 1pd2 s GLU 55 CO -0.12 -0.78 -0.13 0.08 0.02 0.00 0.00 175.26 174.33 1pd2 s VAL 56 N 2.87 1.95 -1.37 3.70 1.01 0.77 -1.49 120.40 127.83 1pd2 s VAL 56 Ca 0.27 -1.21 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 1pd2 s VAL 56 Cb -0.14 -1.95 0.09 0.00 0.00 0.00 0.00 36.38 34.38 1pd2 s VAL 56 CO 0.15 0.21 0.58 1.21 0.00 0.00 0.00 175.10 177.25 1pd2 n GLU 57 N 4.58 -3.47 -2.25 2.72 4.07 -1.25 -0.24 120.64 124.80 1pd2 n GLU 57 Ca -0.16 0.45 -0.05 0.00 -0.06 0.00 0.00 57.16 57.34 1pd2 n GLU 57 Cb 0.46 -5.18 0.00 0.00 -0.06 0.00 0.00 31.44 26.67 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 -1.24 0.27 3.00 8.31 0.00 -1.26 -5.04 105.19 109.23 1pd2 n GLY 58 Ca 0.01 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.68 1.60 -0.39 0.99 0.20 0.67 -5.11 118.68 114.96 1pd2 s LEU 59 Ca 0.03 -0.25 -0.15 0.00 0.69 0.00 0.00 54.13 54.45 1pd2 s LEU 59 Cb -0.01 -0.73 0.01 0.00 -0.43 0.00 0.00 46.19 45.03 1pd2 s LEU 59 CO 0.04 0.02 0.33 -0.89 -0.29 0.00 0.00 176.35 175.56 1pd2 s THR 60 N 0.65 5.22 0.27 3.68 2.01 -1.26 -0.16 115.64 126.04 1pd2 s THR 60 Ca -0.13 -0.43 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 1pd2 s THR 60 Cb -0.15 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 1pd2 s THR 60 CO 0.03 -0.26 0.50 -0.76 -0.69 0.00 0.00 174.62 173.44 1pd2 s LEU 61 N 1.83 4.11 0.21 4.42 1.43 0.44 -4.90 118.68 126.22 1pd2 s LEU 61 Ca 0.08 0.56 -0.00 0.00 -1.03 0.00 0.00 54.13 53.73 1pd2 s LEU 61 Cb -0.18 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.63 1pd2 s LEU 61 CO 0.11 -0.16 0.13 -1.38 0.23 0.00 0.00 176.35 175.28 1pd2 s HIS 62 N -2.05 1.22 -0.01 0.29 -3.43 -1.26 -1.31 115.29 108.74 1pd2 s HIS 62 Ca 0.41 -1.38 -0.01 0.00 -0.80 0.00 0.00 55.06 53.29 1pd2 s HIS 62 Cb -0.11 -0.60 0.00 0.00 -1.43 0.00 0.00 32.58 30.45 1pd2 s HIS 62 CO 0.31 -0.63 0.01 1.04 -2.00 0.00 0.00 174.74 173.47 1pd2 n GLN 63 N -0.31 -0.66 -0.25 -0.38 1.13 -1.25 -4.45 117.38 111.21 1pd2 n GLN 63 Ca 0.02 0.92 0.05 0.00 -1.94 0.00 0.00 57.00 56.05 1pd2 n GLN 63 Cb 0.66 -1.25 0.18 0.00 0.11 0.00 0.00 30.24 29.94 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 0.56 0.18 1.09 1.08 4.64 -1.87 -0.47 113.55 118.75 1pd2 h SER 64 Ca -0.03 0.12 -0.11 0.00 -0.47 0.00 0.00 61.79 61.30 1pd2 h SER 64 Cb 0.07 0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 1pd2 h SER 64 CO 0.00 0.05 -0.51 -0.07 -0.87 0.00 0.00 176.83 175.43 1pd2 h LEU 65 N 0.37 0.00 -0.31 5.97 3.38 -1.92 -0.29 115.31 122.51 1pd2 h LEU 65 Ca 0.40 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.22 1pd2 h LEU 65 Cb 0.64 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1pd2 h LEU 65 CO -0.43 0.51 -0.42 0.00 0.09 0.00 0.00 178.44 178.19 1pd2 h ALA 66 N 1.49 0.47 -0.38 1.53 0.00 -1.55 -1.78 119.26 119.04 1pd2 h ALA 66 Ca -0.01 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 54.29 1pd2 h ALA 66 Cb 1.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1pd2 h ALA 66 CO 0.07 0.59 -0.35 0.82 0.00 0.00 0.00 179.25 180.38 1pd2 h ILE 67 N 0.61 1.27 -0.51 0.00 2.04 -1.01 -2.17 117.51 117.74 1pd2 h ILE 67 Ca 0.04 -1.52 -0.05 0.00 1.00 0.00 0.00 64.86 64.32 1pd2 h ILE 67 Cb 1.02 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1pd2 h ILE 67 CO 0.10 0.51 0.11 0.00 0.00 0.00 0.00 178.15 178.86 1pd2 h ALA 68 N 0.86 0.68 -0.12 1.87 0.00 -1.01 -1.20 119.26 120.32 1pd2 h ALA 68 Ca 0.07 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1pd2 h ALA 68 Cb 0.93 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1pd2 h ALA 68 CO 0.09 0.39 -0.32 -0.09 0.00 0.00 0.00 179.25 179.32 1pd2 h ARG 69 N 0.72 0.23 -0.23 0.00 2.43 -1.28 -2.24 114.38 114.00 1pd2 h ARG 69 Ca 0.16 -0.09 -0.15 0.00 -0.81 0.00 0.00 59.98 59.09 1pd2 h ARG 69 Cb 0.36 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1pd2 h ARG 69 CO 0.01 0.53 -0.45 -0.92 -1.51 0.00 0.00 179.97 177.63 1pd2 h TYR 70 N 0.21 0.90 0.00 2.20 3.20 -1.05 -2.90 116.97 119.52 1pd2 h TYR 70 Ca 0.03 -0.32 -0.06 0.00 3.14 0.00 0.00 58.73 61.51 1pd2 h TYR 70 Cb 0.67 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1pd2 h TYR 70 CO 0.01 1.11 -0.30 -0.07 -1.64 0.00 0.00 178.16 177.27 1pd2 h LEU 71 N 0.44 0.00 -0.72 2.82 3.38 -1.10 -3.07 115.31 117.06 1pd2 h LEU 71 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pd2 h LEU 71 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1pd2 h LEU 71 CO 0.10 0.30 -0.30 0.35 0.09 0.00 0.00 178.44 178.99 1pd2 n THR 72 N -3.60 0.00 -1.84 0.22 -2.24 -0.85 -4.95 114.28 101.02 1pd2 n THR 72 Ca -0.01 -0.19 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 1pd2 n THR 72 Cb 0.43 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 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 -2.44 3.96 -1.36 -0.78 1.02 -1.10 -2.58 119.74 116.45 1pd2 s LYS 73 Ca 0.24 2.47 -0.09 0.00 0.02 0.00 0.00 55.97 58.61 1pd2 s LYS 73 Cb 0.19 -2.84 0.02 0.00 -0.52 0.00 0.00 37.83 34.67 1pd2 s LYS 73 CO 0.52 -0.62 1.14 0.09 -0.92 0.00 0.00 175.35 175.56 1pd2 n ASN 74 N 0.21 -5.77 -3.92 2.83 3.02 -1.26 -4.98 115.26 105.39 1pd2 n ASN 74 Ca 0.03 -0.58 -0.10 0.00 -0.03 0.00 0.00 54.58 53.90 1pd2 n ASN 74 Cb 0.41 -4.90 -0.10 0.00 -0.61 0.00 0.00 39.78 34.57 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 0.10 0.34 3.41 2.01 -1.06 -5.05 115.64 112.06 1pd2 s THR 75 Ca 0.54 -0.85 0.22 0.00 0.31 0.00 0.00 61.69 61.90 1pd2 s THR 75 Cb -0.24 -0.49 0.21 0.00 0.01 0.00 0.00 72.50 71.99 1pd2 s THR 75 CO 0.74 -0.47 1.94 0.44 -0.69 0.00 0.00 174.62 176.58 1pd2 h ASP 76 N 4.24 0.00 -0.43 3.53 3.32 -1.88 -3.15 116.42 122.05 1pd2 h ASP 76 Ca -0.32 0.00 0.12 0.00 0.02 0.00 0.00 57.03 56.86 1pd2 h ASP 76 Cb 1.20 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1pd2 h ASP 76 CO 0.43 0.23 0.35 -0.07 -1.72 0.00 0.00 179.24 178.46 1pd2 h LEU 77 N 0.00 0.00 0.00 1.55 3.38 -1.82 -0.57 115.31 117.84 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 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1pd2 h LEU 77 CO 0.03 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.47 1pd2 h ALA 78 N 1.70 0.94 0.00 1.53 0.00 -1.66 -0.69 119.26 121.09 1pd2 h ALA 78 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pd2 h ALA 78 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1pd2 h ALA 78 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1pd2 n GLY 79 N 1.29 2.89 0.18 0.00 0.00 -0.22 -4.06 105.19 105.27 1pd2 n GLY 79 Ca 0.05 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 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 0.55 -6.25 1.61 1.57 -1.87 -3.42 116.57 108.75 1pd2 h LYS 80 Ca 0.00 -0.34 -0.49 0.00 -1.87 0.00 0.00 60.65 57.95 1pd2 h LYS 80 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1pd2 h LYS 80 CO 0.00 0.94 -0.31 0.95 -0.57 0.00 0.00 179.45 180.46 1pd2 s THR 81 N -4.10 2.52 0.28 -0.16 -4.23 -1.26 -4.99 115.64 103.70 1pd2 s THR 81 Ca -0.13 -1.25 0.03 0.00 -1.18 0.00 0.00 61.69 59.16 1pd2 s THR 81 Cb 0.07 -2.78 0.05 0.00 1.34 0.00 0.00 72.50 71.18 1pd2 s THR 81 CO 0.81 0.00 1.70 -0.08 -0.54 0.00 0.00 174.62 176.51 1pd2 h GLU 82 N 0.81 0.42 -0.37 3.99 4.57 -1.99 -1.11 114.58 120.90 1pd2 h GLU 82 Ca -0.39 -0.18 -0.08 0.00 -1.18 0.00 0.00 59.36 57.53 1pd2 h GLU 82 Cb 1.28 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.84 1pd2 h GLU 82 CO 0.53 0.69 -0.10 -0.07 -1.18 0.00 0.00 179.01 178.88 1pd2 h LEU 83 N 0.36 0.72 -0.83 1.64 -0.00 -1.98 -2.25 115.31 112.97 1pd2 h LEU 83 Ca 0.05 -0.37 -0.12 0.00 -0.00 0.00 0.00 57.88 57.43 1pd2 h LEU 83 Cb 0.74 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 41.19 1pd2 h LEU 83 CO 0.06 0.93 -0.52 -0.33 -0.00 0.00 0.00 178.44 178.58 1pd2 h GLU 84 N 0.51 0.16 -0.58 1.13 5.08 -1.91 -2.21 114.58 116.76 1pd2 h GLU 84 Ca 0.09 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1pd2 h GLU 84 Cb 0.62 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1pd2 h GLU 84 CO 0.04 0.65 0.09 1.96 -1.00 0.00 0.00 179.01 180.74 1pd2 h GLN 85 N 0.13 0.94 -0.53 2.33 4.20 -1.07 -0.31 115.11 120.81 1pd2 h GLN 85 Ca 0.00 -0.23 -0.11 0.00 0.06 0.00 0.00 58.65 58.38 1pd2 h GLN 85 Cb 0.96 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 1pd2 h GLN 85 CO 0.08 0.87 -0.08 0.00 -0.67 0.00 0.00 178.83 179.03 1pd2 h GLN 87 N 0.86 0.46 -0.25 0.00 4.20 -1.06 0.49 115.11 119.80 1pd2 h GLN 87 Ca 0.14 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1pd2 h GLN 87 Cb 0.64 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1pd2 h GLN 87 CO 0.04 0.67 -0.15 0.28 -0.67 0.00 0.00 178.83 179.01 1pd2 h VAL 88 N 0.41 1.30 -0.26 -0.54 2.07 -0.87 -2.29 116.25 116.07 1pd2 h VAL 88 Ca 0.06 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1pd2 h VAL 88 Cb 0.64 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1pd2 h VAL 88 CO 0.05 0.39 0.16 0.44 0.02 0.00 0.00 177.57 178.63 1pd2 h ASP 89 N 0.27 0.31 -0.97 0.57 3.32 -1.05 -2.66 116.42 116.21 1pd2 h ASP 89 Ca 0.05 -0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.13 1pd2 h ASP 89 Cb 0.67 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 40.07 1pd2 h ASP 89 CO 0.04 0.25 0.63 0.00 -1.72 0.00 0.00 179.24 178.45 1pd2 h ALA 90 N 1.07 1.43 -0.34 3.45 0.00 -0.76 -0.93 119.26 123.17 1pd2 h ALA 90 Ca 0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1pd2 h ALA 90 Cb -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1pd2 h ALA 90 CO -0.02 0.43 -0.11 0.28 0.00 0.00 0.00 179.25 179.84 1pd2 h VAL 91 N 1.15 1.28 -0.65 0.00 2.07 -1.25 -0.55 116.25 118.30 1pd2 h VAL 91 Ca 0.41 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1pd2 h VAL 91 Cb 0.15 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1pd2 h VAL 91 CO -0.16 0.39 0.39 0.58 0.02 0.00 0.00 177.57 178.79 1pd2 h VAL 92 N 0.45 1.19 -0.48 2.57 2.07 -1.21 -1.53 116.25 119.31 1pd2 h VAL 92 Ca 0.08 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.11 1pd2 h VAL 92 Cb 0.62 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1pd2 h VAL 92 CO 0.04 0.19 -0.03 0.44 0.02 0.00 0.00 177.57 178.23 1pd2 h ASP 93 N 0.88 0.80 -0.50 0.57 3.32 -0.99 -0.47 116.42 120.03 1pd2 h ASP 93 Ca 0.23 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1pd2 h ASP 93 Cb -0.03 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1pd2 h ASP 93 CO -0.04 0.88 0.10 0.74 -1.72 0.00 0.00 179.24 179.20 1pd2 h THR 94 N 0.76 1.24 -0.24 0.35 2.02 -0.72 -1.04 112.91 115.29 1pd2 h THR 94 Ca 0.14 -0.89 -0.14 0.00 0.77 0.00 0.00 66.41 66.30 1pd2 h THR 94 Cb 0.50 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1pd2 h THR 94 CO 0.03 0.32 -0.43 -0.07 0.37 0.00 0.00 175.52 175.73 1pd2 h LEU 95 N 0.69 0.63 -0.56 2.58 3.38 -1.01 -3.00 115.31 118.02 1pd2 h LEU 95 Ca 0.15 -0.29 -0.16 0.00 0.09 0.00 0.00 57.88 57.67 1pd2 h LEU 95 Cb 0.36 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1pd2 h LEU 95 CO 0.01 0.98 -0.68 -0.78 0.09 0.00 0.00 178.44 178.06 1pd2 h ASP 96 N 0.48 0.26 -0.37 -0.43 3.58 -1.03 -2.50 116.42 116.40 1pd2 h ASP 96 Ca 0.03 -0.16 0.02 0.00 0.42 0.00 0.00 57.03 57.35 1pd2 h ASP 96 Cb 0.95 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.89 1pd2 h ASP 96 CO 0.08 0.86 0.20 0.44 -2.88 0.00 0.00 179.24 177.94 1pd2 h ASP 97 N 0.15 0.30 0.23 2.28 3.32 -1.07 -1.90 116.42 119.74 1pd2 h ASP 97 Ca -0.02 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1pd2 h ASP 97 Cb 1.21 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1pd2 h ASP 97 CO 0.10 0.22 -0.11 0.15 -1.72 0.00 0.00 179.24 177.88 1pd2 h PHE 98 N 0.40 -0.28 -0.09 4.55 3.57 -1.46 -2.99 116.94 120.64 1pd2 h PHE 98 Ca 0.15 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.67 1pd2 h PHE 98 Cb 0.04 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1pd2 h PHE 98 CO -0.09 -0.00 0.10 0.52 -2.23 0.00 0.00 178.31 176.61 1pd2 h MET 99 N -0.55 0.00 0.00 1.11 2.86 -1.43 -0.20 114.93 116.72 1pd2 h MET 99 Ca -0.03 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1pd2 h MET 99 Cb 0.41 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 1pd2 h MET 99 CO 0.05 0.00 -0.13 0.77 1.06 0.00 0.00 176.91 178.66 1pd2 h SER 100 N 0.00 0.00 0.35 1.22 0.02 -1.19 -3.10 113.55 110.86 1pd2 h SER 100 Ca 0.04 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1pd2 h SER 100 Cb 0.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1pd2 h SER 100 CO -0.00 0.13 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.55 1pd2 h LEU 101 N 0.00 0.00 -9.27 5.07 3.38 -1.00 -3.43 115.31 110.06 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 0.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1pd2 h LEU 101 CO 0.02 0.20 1.03 -0.36 0.09 0.00 0.00 178.44 179.42 1pd2 s PHE 102 N -4.27 2.22 -1.26 1.13 0.08 -1.17 -4.90 117.98 109.80 1pd2 s PHE 102 Ca -0.03 0.38 -0.13 0.00 0.12 0.00 0.00 56.93 57.28 1pd2 s PHE 102 Cb 0.14 -3.83 -0.06 0.00 -0.57 0.00 0.00 43.02 38.70 1pd2 s PHE 102 CO 0.65 -3.39 2.37 -0.35 -0.10 0.00 0.00 175.22 174.39 1pd2 n PRO 103 N 6.79 2.68 -0.02 0.24 -0.04 -1.26 -4.75 135.00 138.65 1pd2 n PRO 103 Ca 0.16 -2.09 0.23 0.00 -0.04 0.00 0.00 63.50 61.76 1pd2 n PRO 103 Cb 0.43 -2.89 0.72 0.00 -0.04 0.00 0.00 33.50 31.72 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 6.13 0.00 -0.03 0.54 4.06 -1.93 -0.90 115.95 123.82 1pd2 h TRP 104 Ca 0.62 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.57 1pd2 h TRP 104 Cb 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 1pd2 h TRP 104 CO 1.65 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 176.53 1pd2 n ALA 105 N -2.54 2.50 -1.60 1.49 0.00 -1.26 -4.98 120.51 114.11 1pd2 n ALA 105 Ca 0.11 -0.62 -0.53 0.00 0.00 0.00 0.00 53.44 52.41 1pd2 n ALA 105 Cb 0.72 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 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 0.98 1.33 -0.07 0.00 4.07 -0.35 -4.88 120.64 121.72 1pd2 n GLU 106 Ca 0.16 0.45 -0.12 0.00 -0.06 0.00 0.00 57.16 57.58 1pd2 n GLU 106 Cb 0.52 -2.34 -0.06 0.00 -0.06 0.00 0.00 31.44 29.50 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 9.58 0.41 -5.84 5.31 4.39 -1.93 -3.39 114.58 123.10 1pd2 h GLU 107 Ca -0.39 -0.19 -0.40 0.00 0.34 0.00 0.00 59.36 58.72 1pd2 h GLU 107 Cb 1.31 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.91 1pd2 h GLU 107 CO 0.98 0.72 1.05 1.21 -1.16 0.00 0.00 179.01 181.82 1pd2 s ASN 108 N -6.10 5.18 0.00 1.42 3.84 -1.26 -4.81 114.94 113.21 1pd2 s ASN 108 Ca -0.14 -0.13 0.12 0.00 0.21 0.00 0.00 52.86 52.92 1pd2 s ASN 108 Cb 0.06 -2.54 0.73 0.00 -0.55 0.00 0.00 41.25 38.95 1pd2 s ASN 108 CO 0.76 -2.57 1.20 0.00 -2.79 0.00 0.00 177.10 173.69 1pd2 n GLN 109 N 9.03 0.36 -0.05 0.43 1.13 -1.26 -1.69 117.38 125.32 1pd2 n GLN 109 Ca 0.30 0.03 -0.03 0.00 -1.94 0.00 0.00 57.00 55.35 1pd2 n GLN 109 Cb 0.50 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.33 1pd2 n GLN 109 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1pd2 n ASP 110 N -1.05 1.23 -0.15 1.08 2.03 -1.26 -3.55 116.55 114.89 1pd2 n ASP 110 Ca 0.09 0.47 -0.04 0.00 0.52 0.00 0.00 54.79 55.83 1pd2 n ASP 110 Cb 0.05 -0.74 0.03 0.00 -0.72 0.00 0.00 41.12 39.74 1pd2 n ASP 110 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1pd2 h LEU 111 N -0.68 -0.52 -0.05 -2.67 5.85 -1.95 -1.23 115.31 114.06 1pd2 h LEU 111 Ca 0.00 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.89 1pd2 h LEU 111 Cb 0.39 0.32 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1pd2 h LEU 111 CO 0.00 -0.18 -0.35 0.50 -0.34 0.00 0.00 178.44 178.07 1pd2 h LYS 112 N -0.03 -0.38 -0.28 1.25 3.64 -1.54 0.56 116.57 119.79 1pd2 h LYS 112 Ca 0.22 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.71 1pd2 h LYS 112 Cb 0.38 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1pd2 h LYS 112 CO -0.50 -0.25 0.34 1.49 -2.27 0.00 0.00 179.45 178.26 1pd2 h GLU 113 N -0.39 0.00 0.01 1.90 4.22 -1.48 0.16 114.58 119.00 1pd2 h GLU 113 Ca 0.02 0.00 -0.27 0.00 0.08 0.00 0.00 59.36 59.19 1pd2 h GLU 113 Cb 0.44 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 1pd2 h GLU 113 CO -0.26 0.00 -1.46 0.00 -2.18 0.00 0.00 179.01 175.10 1pd2 h ARG 114 N 0.00 0.03 0.01 1.92 3.08 0.14 -2.91 114.38 116.65 1pd2 h ARG 114 Ca 0.13 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.97 1pd2 h ARG 114 Cb 0.81 0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.89 1pd2 h ARG 114 CO -0.00 0.73 -0.63 1.15 -1.07 0.00 0.00 179.97 180.15 1pd2 h THR 115 N 0.01 1.43 -0.69 2.04 2.02 0.26 -2.74 112.91 115.24 1pd2 h THR 115 Ca -0.19 -2.11 0.13 0.00 0.77 0.00 0.00 66.41 65.00 1pd2 h THR 115 Cb 1.93 2.63 -0.09 0.00 -1.74 0.00 0.00 68.15 70.89 1pd2 h THR 115 CO 0.10 0.61 0.24 -0.26 0.37 0.00 0.00 175.52 176.59 1pd2 h PHE 116 N -0.11 0.41 -0.47 3.16 -1.00 -0.96 0.38 116.94 118.35 1pd2 h PHE 116 Ca -0.08 0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.78 1pd2 h PHE 116 Cb 1.34 -0.08 -0.04 0.00 3.61 0.00 0.00 35.95 40.78 1pd2 h PHE 116 CO 0.15 0.05 0.23 -0.91 -1.61 0.00 0.00 178.31 176.22 1pd2 h ASN 117 N 0.39 0.33 0.47 2.17 2.35 -1.47 0.21 115.58 120.04 1pd2 h ASN 117 Ca 0.37 0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 56.13 1pd2 h ASN 117 Cb 0.54 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1pd2 h ASN 117 CO -0.39 0.23 -0.23 -0.78 -1.65 0.00 0.00 177.43 174.62 1pd2 h ASP 118 N 0.46 -0.54 -0.29 5.81 3.58 -0.78 -1.84 116.42 122.82 1pd2 h ASP 118 Ca 0.21 -0.05 0.06 0.00 0.42 0.00 0.00 57.03 57.67 1pd2 h ASP 118 Cb 0.12 0.14 -0.08 0.00 1.72 0.00 0.00 39.33 41.23 1pd2 h ASP 118 CO -0.15 -0.27 -0.37 -0.07 -2.88 0.00 0.00 179.24 175.50 1pd2 h LEU 119 N -0.79 -1.21 -2.15 2.28 4.07 -0.75 0.56 115.31 117.32 1pd2 h LEU 119 Ca -0.06 0.19 0.00 0.00 0.08 0.00 0.00 57.88 58.08 1pd2 h LEU 119 Cb 0.56 0.53 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 1pd2 h LEU 119 CO 0.11 -0.36 0.00 -0.07 -1.08 0.00 0.00 178.44 177.04 1pd2 h LEU 120 N -0.35 0.00 0.00 1.67 -0.00 -0.92 -1.29 115.31 114.42 1pd2 h LEU 120 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 1pd2 h LEU 120 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.23 1pd2 h LEU 120 CO -0.48 0.00 -1.45 0.35 -0.00 0.00 0.00 178.44 176.86 1pd2 n THR 121 N -4.31 0.00 -0.09 0.22 -2.24 -0.70 -4.49 114.28 102.67 1pd2 n THR 121 Ca -0.03 -0.26 -0.18 0.00 -2.27 0.00 0.00 64.05 61.31 1pd2 n THR 121 Cb 0.09 0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 68.56 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 -1.85 0.37 -0.02 -0.78 5.12 0.19 -4.78 116.66 114.92 1pd2 n ARG 122 Ca -0.02 0.16 -0.19 0.00 -1.93 0.00 0.00 57.85 55.87 1pd2 n ARG 122 Cb 0.29 -1.14 -0.13 0.00 -1.16 0.00 0.00 32.46 30.32 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 0.15 -0.87 5.56 7.50 -1.45 -3.39 115.11 122.03 1pd2 h GLN 123 Ca -0.44 -0.26 0.22 0.00 0.50 0.00 0.00 58.65 58.67 1pd2 h GLN 123 Cb 1.40 0.10 -0.15 0.00 0.05 0.00 0.00 27.48 28.88 1pd2 h GLN 123 CO -0.25 1.13 0.06 0.00 -1.50 0.00 0.00 178.83 178.26 1pd2 h ALA 124 N -0.07 1.03 -0.57 3.87 0.00 -1.49 0.14 119.26 122.17 1pd2 h ALA 124 Ca -0.19 0.27 0.15 0.00 0.00 0.00 0.00 54.91 55.15 1pd2 h ALA 124 Cb 1.45 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 19.68 1pd2 h ALA 124 CO 0.02 -0.48 0.40 -1.35 0.00 0.00 0.00 179.25 177.84 1pd2 h PRO 125 N 0.09 0.06 -0.04 0.00 0.11 -1.83 0.24 132.00 130.63 1pd2 h PRO 125 Ca 0.51 -0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.43 1pd2 h PRO 125 Cb 0.99 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.10 1pd2 h PRO 125 CO -0.76 0.04 -0.70 0.45 -0.21 0.00 0.00 178.00 176.82 1pd2 h HIS 126 N 0.06 0.79 -0.06 0.65 3.86 -1.19 -1.82 115.15 117.43 1pd2 h HIS 126 Ca 0.27 -0.40 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1pd2 h HIS 126 Cb 0.99 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 29.36 1pd2 h HIS 126 CO -0.00 1.21 0.02 1.25 0.86 0.00 0.00 177.93 181.27 1pd2 h LEU 127 N 0.15 0.09 -1.27 2.43 7.12 -1.08 -2.32 115.31 120.42 1pd2 h LEU 127 Ca -0.08 -0.21 0.00 0.00 0.13 0.00 0.00 57.88 57.73 1pd2 h LEU 127 Cb 1.37 -0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 41.44 1pd2 h LEU 127 CO 0.14 0.28 0.45 -0.07 -0.13 0.00 0.00 178.44 179.11 1pd2 h LEU 128 N -0.10 0.82 -0.34 2.25 3.38 -0.62 0.15 115.31 120.85 1pd2 h LEU 128 Ca 0.02 -0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1pd2 h LEU 128 Cb 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1pd2 h LEU 128 CO -0.00 0.61 -0.65 0.07 0.09 0.00 0.00 178.44 178.57 1pd2 h LYS 129 N 0.97 0.67 -0.40 1.13 -0.00 -1.19 0.64 116.57 118.39 1pd2 h LYS 129 Ca 0.26 -0.48 -0.08 0.00 -0.00 0.00 0.00 60.65 60.34 1pd2 h LYS 129 Cb -0.08 0.08 -0.01 0.00 -0.00 0.00 0.00 32.23 32.21 1pd2 h LYS 129 CO -0.05 1.10 -0.07 -0.44 -0.00 0.00 0.00 179.45 179.99 1pd2 h ASP 130 N 0.49 0.76 -0.52 7.07 3.32 -1.01 0.36 116.42 126.90 1pd2 h ASP 130 Ca -0.01 -0.35 -0.01 0.00 0.02 0.00 0.00 57.03 56.68 1pd2 h ASP 130 Cb 1.24 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 1pd2 h ASP 130 CO 0.13 0.93 0.29 0.25 -1.72 0.00 0.00 179.24 179.11 1pd2 h LEU 131 N 0.58 0.64 -0.20 1.55 5.85 -0.90 0.19 115.31 123.02 1pd2 h LEU 131 Ca 0.11 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1pd2 h LEU 131 Cb 0.58 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1pd2 h LEU 131 CO 0.03 0.55 0.09 -0.78 -0.34 0.00 0.00 178.44 177.99 1pd2 h ASP 132 N 0.69 0.26 -0.65 1.25 3.58 -0.72 -0.81 116.42 120.03 1pd2 h ASP 132 Ca 0.18 -0.14 0.01 0.00 0.42 0.00 0.00 57.03 57.50 1pd2 h ASP 132 Cb 0.04 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 40.99 1pd2 h ASP 132 CO -0.03 0.33 0.42 0.74 -2.88 0.00 0.00 179.24 177.82 1pd2 h THR 133 N 0.18 1.17 0.13 2.25 2.02 -0.57 -0.73 112.91 117.37 1pd2 h THR 133 Ca 0.07 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1pd2 h THR 133 Cb 0.14 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1pd2 h THR 133 CO -0.01 0.16 -0.06 0.22 0.37 0.00 0.00 175.52 176.20 1pd2 h TYR 134 N 0.88 -0.17 -0.71 3.16 3.20 -0.41 -2.69 116.97 120.24 1pd2 h TYR 134 Ca 0.24 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1pd2 h TYR 134 Cb -0.09 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1pd2 h TYR 134 CO -0.03 -0.10 0.46 1.25 -1.64 0.00 0.00 178.16 178.10 1pd2 h LEU 135 N -0.18 0.82 0.00 2.82 5.85 -0.90 -3.47 115.31 120.25 1pd2 h LEU 135 Ca -0.02 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1pd2 h LEU 135 Cb 0.14 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1pd2 h LEU 135 CO 0.03 0.60 0.00 0.61 -0.34 0.00 0.00 178.44 179.34 1pd2 n GLY 136 N -1.40 3.24 1.03 3.75 0.00 -0.30 -1.42 105.19 110.09 1pd2 n GLY 136 Ca 0.07 0.02 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 3.98 4.07 -4.76 1.61 8.00 -1.26 -4.99 116.55 123.20 1pd2 n ASP 137 Ca 0.00 -2.88 -0.30 0.00 0.71 0.00 0.00 54.79 52.31 1pd2 n ASP 137 Cb 0.00 -0.53 0.10 0.00 -0.02 0.00 0.00 41.12 40.67 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 -2.60 1.97 0.12 -1.24 1.02 -0.50 -4.94 119.74 113.56 1pd2 s LYS 138 Ca 0.42 0.97 -0.08 0.00 0.02 0.00 0.00 55.97 57.30 1pd2 s LYS 138 Cb 0.33 -1.88 -0.11 0.00 -0.52 0.00 0.00 37.83 35.65 1pd2 s LYS 138 CO 0.11 -1.79 1.31 0.93 -0.92 0.00 0.00 175.35 175.00 1pd2 h GLU 139 N -1.22 0.61 -4.93 1.68 5.08 -1.82 -3.46 114.58 110.51 1pd2 h GLU 139 Ca -0.46 -0.55 -0.37 0.00 -1.00 0.00 0.00 59.36 56.98 1pd2 h GLU 139 Cb 1.25 0.13 -0.14 0.00 0.50 0.00 0.00 28.75 30.49 1pd2 h GLU 139 CO 0.54 1.17 -0.61 -1.58 -1.00 0.00 0.00 179.01 177.53 1pd2 s TRP 140 N -3.53 1.59 0.19 4.33 0.52 -0.54 -4.91 118.94 116.59 1pd2 s TRP 140 Ca -0.08 -1.18 -0.15 0.00 0.02 0.00 0.00 56.10 54.72 1pd2 s TRP 140 Cb 0.09 -0.94 0.18 0.00 -1.15 0.00 0.00 33.47 31.65 1pd2 s TRP 140 CO 0.89 -0.32 1.65 0.74 0.02 0.00 0.00 176.95 179.93 1pd2 h PHE 141 N 2.33 -0.22 0.02 -1.98 0.04 -1.90 -2.79 116.94 112.44 1pd2 h PHE 141 Ca -0.38 0.05 -0.20 0.00 2.80 0.00 0.00 57.97 60.23 1pd2 h PHE 141 Cb 1.25 0.18 -0.02 0.00 2.20 0.00 0.00 35.95 39.56 1pd2 h PHE 141 CO 0.54 -0.21 -0.94 0.97 -0.60 0.00 0.00 178.31 178.07 1pd2 h ILE 142 N 0.02 1.57 0.00 -0.55 6.09 -1.97 -3.45 117.51 119.23 1pd2 h ILE 142 Ca 0.26 -2.92 0.00 0.00 -1.37 0.00 0.00 64.86 60.83 1pd2 h ILE 142 Cb 0.39 2.63 0.00 0.00 0.47 0.00 0.00 36.82 40.32 1pd2 h ILE 142 CO -0.52 0.84 0.00 0.61 -3.07 0.00 0.00 178.15 176.01 1pd2 n GLY 143 N 1.06 -0.54 1.71 8.18 0.00 -1.05 -4.95 105.19 109.60 1pd2 n GLY 143 Ca -0.03 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.22 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 5.10 -3.91 1.61 2.04 -1.26 -1.46 115.26 117.38 1pd2 n ASN 144 Ca 0.00 -2.58 -0.11 0.00 -0.44 0.00 0.00 54.58 51.45 1pd2 n ASN 144 Cb 0.00 -0.62 -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 -2.10 0.10 0.28 -2.53 1.13 -1.26 -4.96 117.35 108.02 1pd2 s TYR 145 Ca 0.53 -0.21 -0.29 0.00 -1.41 0.00 0.00 57.07 55.68 1pd2 s TYR 145 Cb 0.36 -0.09 -0.10 0.00 -1.10 0.00 0.00 41.96 41.04 1pd2 s TYR 145 CO 0.23 -0.15 1.14 0.54 -2.51 0.00 0.00 175.55 174.79 1pd2 s VAL 146 N -0.92 3.36 0.28 -3.49 0.11 -1.26 -4.67 120.40 113.81 1pd2 s VAL 146 Ca -0.10 1.36 0.03 0.00 -2.93 0.00 0.00 61.98 60.34 1pd2 s VAL 146 Cb -0.06 -3.87 -0.06 0.00 -1.53 0.00 0.00 36.38 30.87 1pd2 s VAL 146 CO -0.00 0.32 0.07 0.42 -3.33 0.00 0.00 175.10 172.58 1pd2 s THR 147 N -1.10 0.90 -1.20 5.04 -4.23 -1.26 -4.31 115.64 109.47 1pd2 s THR 147 Ca 0.46 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.10 1pd2 s THR 147 Cb -0.33 -2.67 0.18 0.00 1.34 0.00 0.00 72.50 71.01 1pd2 s THR 147 CO 0.43 -0.04 1.41 -2.67 -0.54 0.00 0.00 174.62 173.21 1pd2 n TRP 148 N -0.56 0.00 -0.11 3.99 4.27 -0.26 -2.04 117.44 122.73 1pd2 n TRP 148 Ca -0.02 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.47 1pd2 n TRP 148 Cb 0.66 -0.40 -0.03 0.00 -1.36 0.00 0.00 31.31 30.18 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 2.57 0.49 -0.77 -1.67 0.00 -1.85 -1.65 119.26 116.37 1pd2 h ALA 149 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1pd2 h ALA 149 Cb 0.19 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1pd2 h ALA 149 CO 0.00 0.45 0.34 -0.44 0.00 0.00 0.00 179.25 179.60 1pd2 h ASP 150 N 0.53 1.03 -0.46 0.00 3.32 -1.81 -1.37 116.42 117.65 1pd2 h ASP 150 Ca 0.07 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 1pd2 h ASP 150 Cb 0.77 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 1pd2 h ASP 150 CO 0.06 0.89 0.28 -0.26 -1.72 0.00 0.00 179.24 178.49 1pd2 h PHE 151 N 1.11 0.60 -0.83 4.55 -1.00 -1.51 -2.28 116.94 117.58 1pd2 h PHE 151 Ca 0.26 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.02 1pd2 h PHE 151 Cb 0.16 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 39.48 1pd2 h PHE 151 CO 0.02 0.42 0.45 -0.92 -1.61 0.00 0.00 178.31 176.68 1pd2 h TYR 152 N 0.61 1.13 -0.73 -0.55 3.20 -0.76 -0.11 116.97 119.76 1pd2 h TYR 152 Ca 0.16 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 1pd2 h TYR 152 Cb -0.00 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 37.87 1pd2 h TYR 152 CO -0.03 0.78 0.27 2.35 -1.64 0.00 0.00 178.16 179.89 1pd2 h TRP 153 N 1.16 1.12 -0.46 -3.82 2.91 -0.93 0.18 115.95 116.11 1pd2 h TRP 153 Ca 0.29 -0.09 -0.12 0.00 1.13 0.00 0.00 58.89 60.11 1pd2 h TRP 153 Cb 0.03 -0.33 -0.02 0.00 -0.51 0.00 0.00 29.16 28.33 1pd2 h TRP 153 CO 0.01 0.86 -0.17 0.22 -1.03 0.00 0.00 178.44 178.32 1pd2 h ASP 154 N 1.07 0.92 -0.23 2.65 3.58 -0.80 -0.79 116.42 122.81 1pd2 h ASP 154 Ca 0.24 -0.32 -0.05 0.00 0.42 0.00 0.00 57.03 57.32 1pd2 h ASP 154 Cb 0.23 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 1pd2 h ASP 154 CO -0.02 1.07 -0.05 0.40 -2.88 0.00 0.00 179.24 177.77 1pd2 h ILE 155 N 0.80 1.28 -0.32 2.25 2.04 -0.52 -2.43 117.51 120.60 1pd2 h ILE 155 Ca 0.12 -1.03 -0.08 0.00 1.00 0.00 0.00 64.86 64.86 1pd2 h ILE 155 Cb 0.72 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1pd2 h ILE 155 CO 0.06 0.32 -0.12 0.00 0.00 0.00 0.00 178.15 178.40 1pd2 h SER 157 N 0.43 0.00 0.33 0.00 4.64 -1.18 -2.20 113.55 115.57 1pd2 h SER 157 Ca 0.08 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 1pd2 h SER 157 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1pd2 h SER 157 CO 0.04 0.25 -0.16 0.74 -0.87 0.00 0.00 176.83 176.84 1pd2 h THR 158 N 0.00 0.69 -0.45 2.95 2.02 -1.29 -0.78 112.91 116.05 1pd2 h THR 158 Ca -0.00 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1pd2 h THR 158 Cb 0.53 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1pd2 h THR 158 CO 0.03 0.04 0.25 0.74 0.37 0.00 0.00 175.52 176.95 1pd2 h THR 159 N -0.54 1.16 -0.68 3.16 2.02 -1.52 -2.61 112.91 113.90 1pd2 h THR 159 Ca -0.05 -0.41 0.06 0.00 0.77 0.00 0.00 66.41 66.79 1pd2 h THR 159 Cb 0.40 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 1pd2 h THR 159 CO 0.07 0.17 0.45 -0.07 0.37 0.00 0.00 175.52 176.51 1pd2 h LEU 160 N 0.59 0.60 -0.84 2.58 3.38 -1.25 0.63 115.31 121.01 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 0.05 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 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 -0.61 1.67 3.38 -0.78 0.12 115.31 119.77 1pd2 h LEU 161 Ca 0.29 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.11 1pd2 h LEU 161 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1pd2 h LEU 161 CO -0.09 0.10 -0.64 0.58 0.09 0.00 0.00 178.44 178.47 1pd2 h VAL 162 N 0.00 1.41 0.11 1.22 2.07 -0.59 -2.69 116.25 117.78 1pd2 h VAL 162 Ca -0.00 -2.09 -0.01 0.00 0.82 0.00 0.00 66.70 65.42 1pd2 h VAL 162 Cb 0.78 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1pd2 h VAL 162 CO 0.01 0.61 -0.05 -0.07 0.02 0.00 0.00 177.57 178.10 1pd2 h LEU 163 N 0.15 -0.12 -7.05 2.57 4.07 -0.67 -3.42 115.31 110.83 1pd2 h LEU 163 Ca -0.01 -0.02 -0.62 0.00 0.08 0.00 0.00 57.88 57.31 1pd2 h LEU 163 Cb 1.16 0.03 -0.40 0.00 1.08 0.00 0.00 40.66 42.53 1pd2 h LEU 163 CO 0.10 0.37 -0.72 -0.75 -1.08 0.00 0.00 178.44 176.36 1pd2 s LYS 164 N -2.04 1.42 0.50 1.13 2.20 0.34 -5.00 119.74 118.28 1pd2 s LYS 164 Ca -0.03 -2.12 0.37 0.00 -0.36 0.00 0.00 55.97 53.83 1pd2 s LYS 164 Cb 0.00 -2.51 1.53 0.00 -1.51 0.00 0.00 37.83 35.34 1pd2 s LYS 164 CO 0.08 -1.15 1.66 -1.35 -0.36 0.00 0.00 175.35 174.23 1pd2 h PRO 165 N 6.67 0.06 -0.70 4.03 0.11 -1.70 0.28 132.00 140.75 1pd2 h PRO 165 Ca -0.02 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1pd2 h PRO 165 Cb 0.92 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1pd2 h PRO 165 CO 0.52 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 1pd2 n ASP 166 N -4.32 4.36 -0.31 -2.05 5.75 -1.26 -4.61 116.55 114.10 1pd2 n ASP 166 Ca 0.36 -2.21 0.07 0.00 -0.01 0.00 0.00 54.79 52.99 1pd2 n ASP 166 Cb 1.54 -0.53 0.22 0.00 -1.03 0.00 0.00 41.12 41.32 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 0.67 -1.51 -2.12 5.85 -0.79 -2.76 115.31 118.86 1pd2 h LEU 167 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1pd2 h LEU 167 Cb 1.21 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1pd2 h LEU 167 CO 0.11 0.32 0.00 0.18 -0.34 0.00 0.00 178.44 178.71 1pd2 n LEU 168 N -4.78 2.27 -0.32 2.25 4.77 -1.26 -4.52 117.00 115.41 1pd2 n LEU 168 Ca 0.17 -0.96 0.21 0.00 -0.03 0.00 0.00 56.01 55.40 1pd2 n LEU 168 Cb 0.39 -0.15 0.48 0.00 -2.33 0.00 0.00 43.42 41.81 1pd2 n LEU 168 CO 0.24 0.48 1.21 1.23 -1.33 0.00 0.00 177.39 179.22 1pd2 h GLY 169 N 4.87 1.27 0.82 -0.72 0.00 -1.82 0.45 103.07 107.95 1pd2 h GLY 169 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1pd2 h GLY 169 CO 0.00 -0.12 -0.22 1.39 0.00 0.00 0.00 176.54 177.59 1pd2 n ILE 170 N -4.64 0.00 -3.66 2.60 2.08 -1.26 -4.53 119.36 109.95 1pd2 n ILE 170 Ca 0.25 -0.06 -0.29 0.00 0.56 0.00 0.00 62.75 63.20 1pd2 n ILE 170 Cb 0.82 0.08 -0.09 0.00 -0.75 0.00 0.00 39.64 39.70 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 -1.02 3.49 -0.12 1.39 4.01 0.15 -4.92 117.16 120.13 1pd2 n TYR 171 Ca 0.11 -4.18 0.05 0.00 -0.16 0.00 0.00 57.90 53.72 1pd2 n TYR 171 Cb 0.32 -0.67 0.37 0.00 -0.31 0.00 0.00 39.34 39.04 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 4.96 0.70 -0.66 -0.72 0.13 -1.80 -1.56 132.00 133.05 1pd2 h PRO 172 Ca 0.17 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.20 1pd2 h PRO 172 Cb 0.72 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1pd2 h PRO 172 CO 0.80 0.46 0.18 0.00 -0.23 0.00 0.00 178.00 179.22 1pd2 h ARG 173 N 0.72 1.04 -0.04 0.86 3.08 -1.94 0.30 114.38 118.41 1pd2 h ARG 173 Ca 0.25 -0.24 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 1pd2 h ARG 173 Cb 0.10 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1pd2 h ARG 173 CO -0.07 0.92 -0.51 -0.07 -1.07 0.00 0.00 179.97 179.17 1pd2 h LEU 174 N 0.97 0.12 -0.13 3.04 4.07 -1.79 -1.07 115.31 120.51 1pd2 h LEU 174 Ca 0.21 -0.06 -0.06 0.00 0.08 0.00 0.00 57.88 58.05 1pd2 h LEU 174 Cb 0.33 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 1pd2 h LEU 174 CO -0.00 0.61 -0.17 0.58 -1.08 0.00 0.00 178.44 178.37 1pd2 h VAL 175 N 0.09 1.36 -0.64 1.22 2.07 -0.54 -2.61 116.25 117.19 1pd2 h VAL 175 Ca 0.00 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.15 1pd2 h VAL 175 Cb 0.93 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 32.62 1pd2 h VAL 175 CO 0.07 0.40 0.41 0.77 0.02 0.00 0.00 177.57 179.24 1pd2 h SER 176 N -0.04 0.75 -0.19 0.57 4.64 -0.19 -1.78 113.55 117.30 1pd2 h SER 176 Ca 0.02 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1pd2 h SER 176 Cb 0.72 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 62.58 1pd2 h SER 176 CO 0.04 0.56 -0.09 0.25 -0.87 0.00 0.00 176.83 176.72 1pd2 h LEU 177 N 0.87 -0.31 -1.22 5.97 5.85 -1.17 0.89 115.31 126.19 1pd2 h LEU 177 Ca 0.23 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.95 1pd2 h LEU 177 Cb -0.07 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1pd2 h LEU 177 CO -0.05 -0.12 -0.30 0.08 -0.34 0.00 0.00 178.44 177.71 1pd2 h ARG 178 N -0.07 0.15 -0.45 1.25 0.11 -1.24 -1.65 114.38 112.48 1pd2 h ARG 178 Ca 0.11 -0.05 -0.07 0.00 0.10 0.00 0.00 59.98 60.07 1pd2 h ARG 178 Cb 0.23 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.28 1pd2 h ARG 178 CO -0.24 0.44 0.02 -0.91 0.10 0.00 0.00 179.97 179.38 1pd2 h ASN 179 N 0.13 0.76 -0.08 0.08 2.35 -0.74 -1.46 115.58 116.63 1pd2 h ASN 179 Ca 0.02 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1pd2 h ASN 179 Cb 0.60 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.76 1pd2 h ASN 179 CO 0.04 0.87 0.05 0.11 -1.65 0.00 0.00 177.43 176.85 1pd2 h LYS 180 N 0.64 0.11 -0.90 0.81 1.57 -0.32 -1.07 116.57 117.40 1pd2 h LYS 180 Ca 0.13 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 59.00 1pd2 h LYS 180 Cb 0.46 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.67 1pd2 h LYS 180 CO 0.02 0.10 0.54 0.28 -0.57 0.00 0.00 179.45 179.82 1pd2 h VAL 181 N 0.08 0.94 0.00 0.50 2.07 -1.21 -0.13 116.25 118.50 1pd2 h VAL 181 Ca 0.03 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1pd2 h VAL 181 Cb 0.02 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.74 1pd2 h VAL 181 CO -0.01 0.16 -0.12 1.56 0.02 0.00 0.00 177.57 179.19 1pd2 h GLN 182 N 0.90 0.00 0.00 1.57 4.20 -0.83 -2.88 115.11 118.06 1pd2 h GLN 182 Ca 0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.14 1pd2 h GLN 182 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1pd2 h GLN 182 CO -0.24 0.12 -0.05 0.00 -0.67 0.00 0.00 178.83 177.99 1pd2 h ALA 183 N 1.88 0.97 -2.32 3.87 0.00 0.29 -3.27 119.26 120.68 1pd2 h ALA 183 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1pd2 h ALA 183 Cb 0.66 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.49 1pd2 h ALA 183 CO 0.02 0.00 1.05 -0.89 0.00 0.00 0.00 179.25 179.42 1pd2 n ILE 184 N -2.82 0.36 -0.24 0.00 5.41 -1.08 -4.76 119.36 116.23 1pd2 n ILE 184 Ca 0.04 -0.07 -0.02 0.00 1.00 0.00 0.00 62.75 63.71 1pd2 n ILE 184 Cb 0.50 -1.95 0.05 0.00 -0.71 0.00 0.00 39.64 37.53 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 8.27 -0.07 -0.57 0.38 0.11 -1.90 0.18 132.00 138.39 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 1.24 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1pd2 h PRO 185 CO 0.93 -0.04 0.38 0.00 -0.21 0.00 0.00 178.00 179.06 1pd2 h ALA 186 N 1.40 1.63 -0.00 -0.75 0.00 -1.89 -0.86 119.26 118.79 1pd2 h ALA 186 Ca 0.30 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 1pd2 h ALA 186 Cb 0.55 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.13 1pd2 h ALA 186 CO -0.74 0.33 -0.46 0.82 0.00 0.00 0.00 179.25 179.19 1pd2 h ILE 187 N 0.74 1.47 -0.77 0.00 1.08 -1.39 -2.77 117.51 115.87 1pd2 h ILE 187 Ca 0.22 -2.02 0.11 0.00 -0.39 0.00 0.00 64.86 62.78 1pd2 h ILE 187 Cb -0.03 2.65 -0.08 0.00 -3.07 0.00 0.00 36.82 36.30 1pd2 h ILE 187 CO -0.05 0.57 0.40 0.28 -0.69 0.00 0.00 178.15 178.66 1pd2 h SER 188 N -0.25 0.52 -0.51 1.72 0.02 -0.35 0.20 113.55 114.89 1pd2 h SER 188 Ca -0.06 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 1pd2 h SER 188 Cb 1.19 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 1pd2 h SER 188 CO 0.09 0.28 0.13 0.00 -1.14 0.00 0.00 176.83 176.18 1pd2 h ALA 189 N 1.47 0.67 0.02 3.77 0.00 -1.23 -1.90 119.26 122.07 1pd2 h ALA 189 Ca 0.39 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1pd2 h ALA 189 Cb 0.44 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1pd2 h ALA 189 CO -0.29 0.37 -0.01 2.35 0.00 0.00 0.00 179.25 181.66 1pd2 h TRP 190 N 0.71 -0.03 -0.80 0.00 -0.00 -0.95 -1.49 115.95 113.39 1pd2 h TRP 190 Ca 0.16 -0.00 0.12 0.00 -0.00 0.00 0.00 58.89 59.17 1pd2 h TRP 190 Cb 0.33 0.01 -0.09 0.00 -0.00 0.00 0.00 29.16 29.41 1pd2 h TRP 190 CO 0.02 0.10 0.40 0.82 -0.00 0.00 0.00 178.44 179.78 1pd2 h ILE 191 N -0.15 0.78 -0.38 2.65 2.04 -0.57 0.45 117.51 122.33 1pd2 h ILE 191 Ca -0.00 -0.21 -0.15 0.00 1.00 0.00 0.00 64.86 65.50 1pd2 h ILE 191 Cb 0.14 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1pd2 h ILE 191 CO 0.01 0.11 -0.35 -0.07 0.00 0.00 0.00 178.15 177.85 1pd2 h LEU 192 N 0.62 0.91 0.00 1.44 3.38 -1.14 -3.25 115.31 117.27 1pd2 h LEU 192 Ca 0.42 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1pd2 h LEU 192 Cb 0.53 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1pd2 h LEU 192 CO -0.33 1.16 -0.67 0.07 0.09 0.00 0.00 178.44 178.76 1pd2 h LYS 193 N 0.72 0.00 -6.89 1.13 2.10 -0.48 -3.47 116.57 109.67 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 0.91 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.33 1pd2 h LYS 193 CO 0.08 0.00 0.74 0.50 -2.00 0.00 0.00 179.45 178.78 1pd2 s ARG 194 N -3.30 4.20 0.14 0.07 3.52 0.15 -4.92 118.95 118.82 1pd2 s ARG 194 Ca 0.02 2.43 -0.33 0.00 -0.13 0.00 0.00 55.73 57.73 1pd2 s ARG 194 Cb 0.09 -3.02 -0.13 0.00 -1.56 0.00 0.00 34.95 30.33 1pd2 s ARG 194 CO 0.75 -0.42 1.69 -2.30 -0.81 0.00 0.00 175.30 174.21 1pd2 n PRO 195 N 0.89 2.43 -2.05 5.12 -0.02 -1.26 -4.91 135.00 135.20 1pd2 n PRO 195 Ca 0.02 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 61.96 1pd2 n PRO 195 Cb 0.40 -2.70 -0.03 0.00 -0.02 0.00 0.00 33.50 31.15 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 1.61 4.22 0.05 -0.52 -0.21 -1.26 -4.95 119.66 118.59 1pd2 s GLN 196 Ca 0.80 2.17 -0.10 0.00 0.02 0.00 0.00 55.36 58.24 1pd2 s GLN 196 Cb -0.60 -3.72 0.01 0.00 1.00 0.00 0.00 33.01 29.70 1pd2 s GLN 196 CO 0.38 -0.72 0.22 -0.08 -2.12 0.00 0.00 175.29 172.96 1pd2 s THR 197 N 3.03 0.11 -0.05 -0.19 -1.32 -1.26 -5.09 115.64 110.87 1pd2 s THR 197 Ca 0.70 -0.89 -0.25 0.00 -1.21 0.00 0.00 61.69 60.05 1pd2 s THR 197 Cb -0.35 -0.99 -0.23 0.00 -1.51 0.00 0.00 72.50 69.42 1pd2 s THR 197 CO 0.29 -0.49 1.05 0.50 -2.21 0.00 0.00 174.62 173.76 1pd2 h LYS 198 N 3.27 0.13 -0.00 7.08 3.64 -1.93 -3.48 116.57 125.27 1pd2 h LYS 198 Ca -0.32 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1pd2 h LYS 198 Cb 1.20 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1pd2 h LYS 198 CO 0.49 0.85 0.00 1.28 -2.27 0.00 0.00 179.45 179.80