#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lud s ALA 2 N 0.00 1.32 -0.16 2.41 0.00 0.22 0.15 121.76 125.71 1lud s ALA 2 Ca 0.00 -1.21 -0.07 0.00 0.00 0.00 0.00 51.96 50.68 1lud s ALA 2 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1lud s ALA 2 CO 0.00 0.07 0.08 -0.06 0.00 0.00 0.00 175.76 175.85 1lud s PHE 3 N -2.10 3.35 -0.39 0.00 0.40 0.21 0.16 117.98 119.60 1lud s PHE 3 Ca 0.06 0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.65 1lud s PHE 3 Cb -0.05 -2.02 0.13 0.00 0.51 0.00 0.00 43.02 41.60 1lud s PHE 3 CO 0.02 0.37 0.21 -1.17 0.70 0.00 0.00 175.22 175.35 1lud s LEU 4 N -0.16 2.09 0.39 -0.37 2.96 -0.88 0.12 118.68 122.83 1lud s LEU 4 Ca 0.08 -2.35 0.05 0.00 -0.22 0.00 0.00 54.13 51.70 1lud s LEU 4 Cb -0.12 -0.81 -0.02 0.00 0.50 0.00 0.00 46.19 45.73 1lud s LEU 4 CO 0.01 -0.30 0.20 -1.66 -1.32 0.00 0.00 176.35 173.27 1lud s TRP 5 N 0.75 1.77 -0.02 5.38 -2.14 -0.81 -4.59 118.94 119.28 1lud s TRP 5 Ca 0.17 -1.47 0.01 0.00 2.66 0.00 0.00 56.10 57.47 1lud s TRP 5 Cb -0.23 -0.98 0.01 0.00 -3.10 0.00 0.00 33.47 29.18 1lud s TRP 5 CO -0.03 -0.55 -0.03 0.00 -2.66 0.00 0.00 176.95 173.68 1lud s ALA 6 N -3.29 0.43 0.05 2.67 0.00 -1.26 -2.19 121.76 118.17 1lud s ALA 6 Ca 0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 1lud s ALA 6 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 1lud s ALA 6 CO 0.20 0.01 -0.04 1.14 0.00 0.00 0.00 175.76 177.07 1lud s GLN 7 N 0.55 0.60 0.00 0.00 -2.07 -0.42 -4.50 119.66 113.81 1lud s GLN 7 Ca -0.06 -1.11 0.00 0.00 -1.82 0.00 0.00 55.36 52.37 1lud s GLN 7 Cb -0.09 0.09 0.00 0.00 -1.09 0.00 0.00 33.01 31.92 1lud s GLN 7 CO -0.01 -0.07 0.00 -0.40 -1.32 0.00 0.00 175.29 173.49 1lud n ASP 8 N 0.40 0.00 -0.21 12.60 5.68 -1.18 -1.73 116.55 132.11 1lud n ASP 8 Ca -0.16 -0.60 -0.06 0.00 -0.50 0.00 0.00 54.79 53.47 1lud n ASP 8 Cb 0.60 0.00 0.04 0.00 -1.14 0.00 0.00 41.12 40.61 1lud n ASP 8 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1lud h ARG 9 N 0.00 0.81 -0.13 0.11 -0.00 -1.31 -2.37 114.38 111.50 1lud h ARG 9 Ca 0.00 -0.06 -0.12 0.00 -0.00 0.00 0.00 59.98 59.80 1lud h ARG 9 Cb 0.00 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.97 29.78 1lud h ARG 9 CO 0.00 0.55 -0.47 -0.44 -0.00 0.00 0.00 179.97 179.61 1lud h ASP 10 N 0.83 0.34 0.00 0.08 3.32 -1.91 -3.47 116.42 115.60 1lud h ASP 10 Ca 0.22 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1lud h ASP 10 Cb -0.07 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.38 1lud h ASP 10 CO -0.05 0.76 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 1lud n GLY 11 N -0.01 1.14 3.90 2.75 0.00 -0.89 -5.08 105.19 107.00 1lud n GLY 11 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1lud n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lud s LEU 12 N 0.00 4.15 0.14 0.99 2.96 -1.26 -3.37 118.68 122.28 1lud s LEU 12 Ca 0.00 0.64 0.00 0.00 -0.22 0.00 0.00 54.13 54.55 1lud s LEU 12 Cb 0.00 -3.43 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1lud s LEU 12 CO 0.00 -0.10 0.00 2.30 -1.32 0.00 0.00 176.35 177.23 1lud n ILE 13 N -0.60 0.44 -3.30 6.68 -5.35 -1.04 -3.11 119.36 113.07 1lud n ILE 13 Ca -0.02 0.14 -0.35 0.00 -0.27 0.00 0.00 62.75 62.25 1lud n ILE 13 Cb 0.53 -0.89 -0.06 0.00 -1.74 0.00 0.00 39.64 37.49 1lud n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1lud s GLY 14 N -4.17 2.46 -0.36 3.28 0.00 -1.14 -4.49 107.32 102.90 1lud s GLY 14 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.65 1lud s GLY 14 CO 0.00 0.20 0.24 1.25 0.00 0.00 0.00 173.10 174.79 1lud s LYS 15 N -2.11 0.59 -1.23 2.90 2.36 -1.21 -3.74 119.74 117.30 1lud s LYS 15 Ca 0.41 -1.34 -0.03 0.00 -2.55 0.00 0.00 55.97 52.45 1lud s LYS 15 Cb -0.15 -1.23 -0.01 0.00 -1.05 0.00 0.00 37.83 35.39 1lud s LYS 15 CO 0.20 -1.23 0.80 -0.25 1.55 0.00 0.00 175.35 176.42 1lud n ASP 16 N 3.96 -2.63 0.00 1.43 8.00 -1.26 -3.75 116.55 122.30 1lud n ASP 16 Ca 0.14 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1lud n ASP 16 Cb 0.39 -4.34 0.00 0.00 -0.02 0.00 0.00 41.12 37.15 1lud n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lud n GLY 17 N -1.46 1.58 3.78 0.44 0.00 -1.26 -4.94 105.19 103.33 1lud n GLY 17 Ca -0.24 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.12 1lud n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1lud s HIS 18 N 0.00 2.76 0.97 1.61 -3.43 -1.25 -4.99 115.29 110.96 1lud s HIS 18 Ca 0.00 1.54 -0.12 0.00 -0.80 0.00 0.00 55.06 55.68 1lud s HIS 18 Cb 0.00 -3.14 0.12 0.00 -1.43 0.00 0.00 32.58 28.14 1lud s HIS 18 CO 0.00 -1.45 0.83 1.28 -2.00 0.00 0.00 174.74 173.40 1lud n LEU 19 N -2.02 1.40 0.07 5.38 4.77 -1.26 -3.32 117.00 122.03 1lud n LEU 19 Ca 0.10 0.30 -0.11 0.00 -0.03 0.00 0.00 56.01 56.27 1lud n LEU 19 Cb 0.52 -1.34 -0.13 0.00 -2.33 0.00 0.00 43.42 40.14 1lud n LEU 19 CO 0.46 -2.80 0.01 1.55 -1.33 0.00 0.00 177.39 175.27 1lud h PRO 20 N -1.89 0.11 -6.61 3.23 0.14 -1.83 -3.45 132.00 121.71 1lud h PRO 20 Ca -0.46 -0.20 -0.70 0.00 0.14 0.00 0.00 66.00 64.79 1lud h PRO 20 Cb 1.28 0.07 -0.30 0.00 0.14 0.00 0.00 31.00 32.20 1lud h PRO 20 CO 0.39 1.06 -0.89 1.67 0.14 0.00 0.00 178.00 180.38 1lud s TRP 21 N -2.68 2.34 -0.58 1.56 -2.14 -1.26 -5.06 118.94 111.11 1lud s TRP 21 Ca -0.02 -0.43 -0.18 0.00 2.66 0.00 0.00 56.10 58.13 1lud s TRP 21 Cb 0.09 -1.50 0.11 0.00 -3.10 0.00 0.00 33.47 29.07 1lud s TRP 21 CO 0.85 -0.03 0.65 -1.58 -2.66 0.00 0.00 176.95 174.18 1lud s HIS 22 N -0.62 3.06 -0.26 1.66 2.46 -1.26 -5.00 115.29 115.33 1lud s HIS 22 Ca 0.10 -1.05 0.01 0.00 0.47 0.00 0.00 55.06 54.59 1lud s HIS 22 Cb -0.10 -3.96 0.07 0.00 -0.13 0.00 0.00 32.58 28.46 1lud s HIS 22 CO -0.01 -1.23 -0.04 -1.17 -2.47 0.00 0.00 174.74 169.82 1lud s LEU 23 N 2.40 2.99 0.25 8.88 2.96 -1.26 -4.98 118.68 129.92 1lud s LEU 23 Ca 0.09 -1.37 -0.03 0.00 -0.22 0.00 0.00 54.13 52.61 1lud s LEU 23 Cb -0.26 -1.29 0.31 0.00 0.50 0.00 0.00 46.19 45.45 1lud s LEU 23 CO 0.05 -0.26 1.75 1.55 -1.32 0.00 0.00 176.35 178.13 1lud h PRO 24 N 7.88 0.83 0.00 0.98 0.14 -2.00 -2.42 132.00 137.41 1lud h PRO 24 Ca -0.16 -0.22 -0.05 0.00 0.14 0.00 0.00 66.00 65.70 1lud h PRO 24 Cb 1.05 -0.10 -0.01 0.00 0.14 0.00 0.00 31.00 32.09 1lud h PRO 24 CO 0.44 0.82 -0.26 0.22 0.14 0.00 0.00 178.00 179.36 1lud h ASP 25 N 0.78 0.00 -0.12 1.44 1.82 -1.99 -2.74 116.42 115.60 1lud h ASP 25 Ca 0.15 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.61 1lud h ASP 25 Cb 0.45 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.46 1lud h ASP 25 CO 0.02 0.26 -0.63 -0.78 -1.61 0.00 0.00 179.24 176.50 1lud h ASP 26 N 0.00 0.76 -0.23 2.28 3.58 -1.86 -2.95 116.42 118.00 1lud h ASP 26 Ca -0.00 -0.64 0.05 0.00 0.42 0.00 0.00 57.03 56.85 1lud h ASP 26 Cb 0.52 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 41.30 1lud h ASP 26 CO 0.03 1.28 -0.06 -0.07 -2.88 0.00 0.00 179.24 177.54 1lud h LEU 27 N 0.30 -0.23 -1.33 2.28 3.38 -1.31 0.32 115.31 118.73 1lud h LEU 27 Ca -0.04 0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.12 1lud h LEU 27 Cb 1.27 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 42.10 1lud h LEU 27 CO 0.13 -0.08 0.55 0.45 0.09 0.00 0.00 178.44 179.58 1lud h HIS 28 N -0.01 0.78 -0.61 1.13 3.86 -1.55 0.21 115.15 118.98 1lud h HIS 28 Ca 0.11 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.30 1lud h HIS 28 Cb 0.18 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 1lud h HIS 28 CO -0.24 0.32 0.20 -0.92 0.86 0.00 0.00 177.93 178.15 1lud h TYR 29 N 0.69 0.92 -0.08 2.45 3.20 -0.80 -0.25 116.97 123.11 1lud h TYR 29 Ca 0.41 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 62.20 1lud h TYR 29 Cb 0.63 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.62 1lud h TYR 29 CO -0.00 0.74 -0.02 0.35 -1.64 0.00 0.00 178.16 177.58 1lud h PHE 30 N 0.88 0.17 0.49 -3.82 3.57 0.47 -1.81 116.94 116.89 1lud h PHE 30 Ca 0.20 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1lud h PHE 30 Cb 0.24 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1lud h PHE 30 CO 0.02 0.49 -0.24 -0.09 -2.23 0.00 0.00 178.31 176.26 1lud h ARG 31 N -0.20 -0.64 -1.04 1.11 2.43 -1.04 -2.34 114.38 112.67 1lud h ARG 31 Ca 0.02 0.04 0.29 0.00 -0.81 0.00 0.00 59.98 59.53 1lud h ARG 31 Cb 0.43 0.14 -0.13 0.00 -0.42 0.00 0.00 29.97 30.00 1lud h ARG 31 CO 0.01 -0.42 0.63 0.00 -1.51 0.00 0.00 179.97 178.67 1lud h ALA 32 N -1.61 2.03 0.00 2.80 0.00 -1.15 0.79 119.26 122.12 1lud h ALA 32 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1lud h ALA 32 Cb 0.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1lud h ALA 32 CO 0.11 -0.55 0.00 1.96 0.00 0.00 0.00 179.25 180.77 1lud h GLN 33 N 0.41 0.00 -0.05 0.00 1.08 -1.21 -3.10 115.11 112.24 1lud h GLN 33 Ca 0.68 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.86 1lud h GLN 33 Cb 1.56 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.98 1lud h GLN 33 CO -0.48 0.00 -0.33 0.25 -0.95 0.00 0.00 178.83 177.32 1lud n THR 34 N -2.63 2.18 -2.56 -0.54 -2.24 0.27 -4.89 114.28 103.87 1lud n THR 34 Ca 0.02 -2.94 -0.43 0.00 -2.27 0.00 0.00 64.05 58.43 1lud n THR 34 Cb 0.32 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.28 1lud n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1lud s VAL 35 N -3.15 4.31 -0.20 2.28 -7.23 -0.69 -3.08 120.40 112.64 1lud s VAL 35 Ca 0.38 1.45 0.00 0.00 -1.81 0.00 0.00 61.98 62.00 1lud s VAL 35 Cb 0.35 -4.40 0.00 0.00 0.56 0.00 0.00 36.38 32.90 1lud s VAL 35 CO -0.04 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 174.73 1lud n GLY 36 N 4.30 0.53 3.65 2.32 0.00 -1.26 -5.02 105.19 109.70 1lud n GLY 36 Ca 0.13 -0.32 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 1lud n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lud s LYS 37 N -1.21 2.09 -0.24 1.61 1.02 -1.18 -4.44 119.74 117.40 1lud s LYS 37 Ca 0.00 -1.81 -0.27 0.00 0.02 0.00 0.00 55.97 53.91 1lud s LYS 37 Cb 0.00 -1.90 0.00 0.00 -0.52 0.00 0.00 37.83 35.41 1lud s LYS 37 CO 0.00 0.07 0.94 0.42 -0.92 0.00 0.00 175.35 175.86 1lud s ILE 38 N -2.55 4.75 -0.45 2.17 1.01 -1.00 -3.60 121.20 121.52 1lud s ILE 38 Ca 0.36 1.80 -0.15 0.00 0.00 0.00 0.00 60.65 62.66 1lud s ILE 38 Cb 0.02 -4.22 0.06 0.00 0.01 0.00 0.00 42.46 38.33 1lud s ILE 38 CO 0.20 -0.14 0.36 -0.32 0.00 0.00 0.00 174.94 175.04 1lud s MET 39 N 3.05 2.94 -0.29 2.79 1.75 -0.19 0.68 119.30 130.04 1lud s MET 39 Ca 0.40 -1.29 -0.20 0.00 -1.25 0.00 0.00 55.69 53.34 1lud s MET 39 Cb -0.15 -4.06 -0.01 0.00 2.84 0.00 0.00 34.83 33.44 1lud s MET 39 CO 0.07 -0.96 0.61 0.08 -0.65 0.00 0.00 175.02 174.17 1lud s VAL 40 N 1.63 4.97 0.45 10.11 1.01 0.29 0.53 120.40 139.38 1lud s VAL 40 Ca 0.04 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.95 1lud s VAL 40 Cb -0.23 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.19 1lud s VAL 40 CO 0.07 -0.07 0.01 1.33 0.00 0.00 0.00 175.10 176.44 1lud n VAL 41 N 5.31 0.00 -4.46 2.92 0.24 -0.30 0.45 118.33 122.48 1lud n VAL 41 Ca -0.01 -2.19 -0.30 0.00 -2.04 0.00 0.00 64.34 59.80 1lud n VAL 41 Cb 0.49 0.47 -0.12 0.00 -1.47 0.00 0.00 33.84 33.22 1lud n VAL 41 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1lud s GLY 42 N -3.52 1.66 0.60 7.63 0.00 0.90 -1.64 107.32 112.95 1lud s GLY 42 Ca 0.02 -1.24 0.28 0.00 0.00 0.00 0.00 44.72 43.79 1lud s GLY 42 CO 0.01 -1.17 1.56 -0.09 0.00 0.00 0.00 173.10 173.42 1lud h ARG 43 N 4.14 0.00 0.04 2.90 1.12 -1.10 0.56 114.38 122.04 1lud h ARG 43 Ca -0.49 0.00 -0.19 0.00 -1.11 0.00 0.00 59.98 58.20 1lud h ARG 43 Cb 1.16 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 31.14 1lud h ARG 43 CO 0.48 0.00 -0.76 0.00 -3.11 0.00 0.00 179.97 176.58 1lud h ARG 44 N 0.00 0.44 -0.01 0.20 2.47 -1.94 -2.53 114.38 113.02 1lud h ARG 44 Ca 0.39 -0.53 -0.01 0.00 -1.26 0.00 0.00 59.98 58.58 1lud h ARG 44 Cb 2.23 0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 30.71 1lud h ARG 44 CO -0.00 1.18 -0.01 1.15 0.56 0.00 0.00 179.97 182.84 1lud h THR 45 N -0.06 1.43 -0.91 2.04 2.02 -0.30 -2.13 112.91 115.00 1lud h THR 45 Ca -0.11 -1.29 0.15 0.00 0.77 0.00 0.00 66.41 65.93 1lud h THR 45 Cb 1.48 2.29 -0.07 0.00 -1.74 0.00 0.00 68.15 70.10 1lud h THR 45 CO 0.15 0.34 0.58 0.22 0.37 0.00 0.00 175.52 177.18 1lud h TYR 46 N -0.51 0.84 0.00 3.16 3.20 -1.11 0.81 116.97 123.37 1lud h TYR 46 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1lud h TYR 46 Cb 0.56 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1lud h TYR 46 CO 0.11 0.30 0.00 0.93 -1.64 0.00 0.00 178.16 177.86 1lud h GLU 47 N 0.70 0.00 0.00 1.82 5.08 -1.36 -3.09 114.58 117.73 1lud h GLU 47 Ca 0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1lud h GLU 47 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1lud h GLU 47 CO -0.22 0.00 -1.81 0.45 -1.00 0.00 0.00 179.01 176.43 1lud n SER 48 N -2.78 0.18 -4.45 1.42 2.88 0.20 -4.98 113.62 106.09 1lud n SER 48 Ca 0.03 -0.13 -0.34 0.00 -1.33 0.00 0.00 58.87 57.11 1lud n SER 48 Cb 0.39 1.79 0.11 0.00 -0.75 0.00 0.00 64.21 65.74 1lud n SER 48 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1lud n PHE 49 N -2.17 -1.04 -0.07 0.66 3.72 0.22 -4.96 117.46 113.83 1lud n PHE 49 Ca -0.03 0.28 -0.10 0.00 -0.05 0.00 0.00 57.45 57.55 1lud n PHE 49 Cb 0.53 -1.85 -0.07 0.00 -0.94 0.00 0.00 39.48 37.15 1lud n PHE 49 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1lud h PRO 50 N -1.20 0.00 -4.01 -1.08 0.14 -1.90 -3.44 132.00 120.50 1lud h PRO 50 Ca -0.44 0.00 -0.61 0.00 0.14 0.00 0.00 66.00 65.08 1lud h PRO 50 Cb 1.30 0.00 -0.40 0.00 0.14 0.00 0.00 31.00 32.04 1lud h PRO 50 CO 0.37 0.58 -0.74 0.21 0.14 0.00 0.00 178.00 178.56 1lud s LYS 51 N -2.06 1.02 -0.14 0.86 2.20 -1.26 -5.10 119.74 115.26 1lud s LYS 51 Ca -0.15 -1.40 -0.05 0.00 -0.36 0.00 0.00 55.97 54.02 1lud s LYS 51 Cb 0.00 -2.48 -0.04 0.00 -1.51 0.00 0.00 37.83 33.81 1lud s LYS 51 CO 0.41 -0.97 0.03 1.03 -0.36 0.00 0.00 175.35 175.50 1lud s ARG 52 N 1.33 3.57 0.81 4.03 3.00 -1.26 -3.82 118.95 126.61 1lud s ARG 52 Ca 0.10 -0.37 -0.06 0.00 0.00 0.00 0.00 55.73 55.40 1lud s ARG 52 Cb -0.18 -3.03 0.16 0.00 0.00 0.00 0.00 34.95 31.90 1lud s ARG 52 CO -0.18 0.45 1.11 -1.25 0.00 0.00 0.00 175.30 175.43 1lud s PRO 53 N -0.16 1.28 0.57 3.54 0.04 -1.26 -5.10 135.00 133.91 1lud s PRO 53 Ca 0.06 -0.94 -0.19 0.00 0.04 0.00 0.00 61.00 59.98 1lud s PRO 53 Cb -0.12 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1lud s PRO 53 CO 0.02 -1.80 1.13 -0.51 0.04 0.00 0.00 177.00 175.88 1lud s LEU 54 N -5.40 3.68 0.09 -3.56 1.43 -1.25 -4.96 118.68 108.71 1lud s LEU 54 Ca 0.69 2.16 -0.31 0.00 -1.03 0.00 0.00 54.13 55.65 1lud s LEU 54 Cb -0.04 -4.58 -0.08 0.00 0.03 0.00 0.00 46.19 41.52 1lud s LEU 54 CO 0.47 -1.32 1.47 -2.16 0.23 0.00 0.00 176.35 175.05 1lud s PRO 55 N -3.43 4.27 -1.66 1.29 0.04 -1.26 -3.27 135.00 130.98 1lud s PRO 55 Ca 0.72 2.15 -0.17 0.00 0.04 0.00 0.00 61.00 63.75 1lud s PRO 55 Cb -0.24 -3.36 0.14 0.00 0.04 0.00 0.00 34.50 31.08 1lud s PRO 55 CO 0.30 -0.55 0.81 0.39 0.04 0.00 0.00 177.00 177.99 1lud n GLU 56 N 4.55 -3.65 -3.86 4.56 1.02 -1.26 -4.94 120.64 117.06 1lud n GLU 56 Ca 0.13 0.42 -0.12 0.00 -0.02 0.00 0.00 57.16 57.57 1lud n GLU 56 Cb 0.42 -5.15 -0.12 0.00 -0.02 0.00 0.00 31.44 26.56 1lud n GLU 56 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1lud s ARG 57 N -6.85 0.23 -0.22 3.49 0.52 -1.20 -4.20 118.95 110.72 1lud s ARG 57 Ca 0.69 -0.05 -0.22 0.00 -0.52 0.00 0.00 55.73 55.63 1lud s ARG 57 Cb -0.37 0.10 -0.02 0.00 0.52 0.00 0.00 34.95 35.18 1lud s ARG 57 CO 0.91 -0.04 0.70 0.99 0.02 0.00 0.00 175.30 177.88 1lud s THR 58 N -0.44 4.95 -0.04 0.02 2.01 -1.24 -4.57 115.64 116.35 1lud s THR 58 Ca -0.05 1.32 0.07 0.00 0.31 0.00 0.00 61.69 63.34 1lud s THR 58 Cb -0.03 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 1lud s THR 58 CO 0.00 0.04 -0.24 0.20 -0.69 0.00 0.00 174.62 173.93 1lud s ASN 59 N 1.29 2.90 -0.09 3.53 0.01 -1.26 -1.02 114.94 120.30 1lud s ASN 59 Ca 0.31 -0.47 0.04 0.00 -0.71 0.00 0.00 52.86 52.04 1lud s ASN 59 Cb -0.16 -0.57 -0.00 0.00 0.41 0.00 0.00 41.25 40.93 1lud s ASN 59 CO 0.10 0.26 -0.24 -0.69 -1.51 0.00 0.00 177.10 175.02 1lud s VAL 60 N -0.34 2.04 0.12 1.60 1.01 0.19 -1.11 120.40 123.91 1lud s VAL 60 Ca 0.03 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.02 1lud s VAL 60 Cb -0.11 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 1lud s VAL 60 CO 0.01 0.56 0.17 -0.69 0.00 0.00 0.00 175.10 175.15 1lud s VAL 61 N 0.28 4.87 -0.14 2.92 1.01 -1.09 -1.15 120.40 127.09 1lud s VAL 61 Ca -0.17 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1lud s VAL 61 Cb -0.17 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1lud s VAL 61 CO 0.08 -0.01 -0.20 -0.76 0.00 0.00 0.00 175.10 174.22 1lud s LEU 62 N -2.88 2.24 0.07 3.92 1.02 -0.65 -1.58 118.68 120.83 1lud s LEU 62 Ca 0.32 -0.55 -0.09 0.00 0.02 0.00 0.00 54.13 53.83 1lud s LEU 62 Cb -0.11 -1.49 0.00 0.00 0.02 0.00 0.00 46.19 44.61 1lud s LEU 62 CO 0.25 0.09 0.20 0.28 0.02 0.00 0.00 176.35 177.19 1lud s THR 63 N 0.77 0.13 -2.52 5.49 -1.32 -1.10 -0.43 115.64 116.66 1lud s THR 63 Ca -0.07 -1.06 0.23 0.00 -1.21 0.00 0.00 61.69 59.58 1lud s THR 63 Cb -0.16 -1.19 0.40 0.00 -1.51 0.00 0.00 72.50 70.04 1lud s THR 63 CO -0.00 -0.58 1.46 1.41 -2.21 0.00 0.00 174.62 174.70 1lud n HIS 64 N 0.17 0.25 -1.65 9.09 8.25 -1.26 -4.40 115.22 125.67 1lud n HIS 64 Ca -0.16 -0.12 -0.30 0.00 -0.26 0.00 0.00 57.72 56.87 1lud n HIS 64 Cb 0.61 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.92 1lud n HIS 64 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1lud s GLN 65 N -1.75 0.16 -0.02 -0.41 1.11 -1.26 -5.02 119.66 112.47 1lud s GLN 65 Ca 0.35 -0.24 0.03 0.00 0.01 0.00 0.00 55.36 55.50 1lud s GLN 65 Cb 0.20 -1.77 -0.04 0.00 -1.01 0.00 0.00 33.01 30.39 1lud s GLN 65 CO 0.30 -2.76 0.03 0.39 0.01 0.00 0.00 175.29 173.26 1lud n GLU 66 N -4.05 2.50 -1.46 2.91 -0.58 -1.26 -4.69 120.64 114.01 1lud n GLU 66 Ca 0.14 -0.01 -0.24 0.00 -0.42 0.00 0.00 57.16 56.63 1lud n GLU 66 Cb 0.59 -1.07 0.09 0.00 -0.57 0.00 0.00 31.44 30.48 1lud n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1lud n ASP 67 N -1.96 5.38 -4.64 1.62 8.00 -1.26 -5.00 116.55 118.69 1lud n ASP 67 Ca -0.03 -3.77 -0.42 0.00 0.71 0.00 0.00 54.79 51.28 1lud n ASP 67 Cb 0.44 -0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 40.83 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1lud s TYR 68 N -3.60 1.28 -0.42 1.24 5.04 -1.26 -4.93 117.35 114.70 1lud s TYR 68 Ca 0.55 -0.12 -0.14 0.00 -2.44 0.00 0.00 57.07 54.93 1lud s TYR 68 Cb 0.45 -4.14 0.04 0.00 0.35 0.00 0.00 41.96 38.67 1lud s TYR 68 CO 0.02 -5.02 0.30 -0.65 -1.34 0.00 0.00 175.55 168.86 1lud s GLN 69 N 5.03 2.90 -0.49 4.97 -1.52 -1.26 -4.99 119.66 124.31 1lud s GLN 69 Ca 0.91 -1.17 0.04 0.00 -1.95 0.00 0.00 55.36 53.19 1lud s GLN 69 Cb -0.39 -3.95 0.16 0.00 -0.22 0.00 0.00 33.01 28.61 1lud s GLN 69 CO 0.39 -0.84 0.36 0.00 -0.25 0.00 0.00 175.29 174.95 1lud s ALA 70 N 1.62 2.07 0.01 6.09 0.00 -1.26 -5.10 121.76 125.19 1lud s ALA 70 Ca 0.04 -2.78 -0.30 0.00 0.00 0.00 0.00 51.96 48.91 1lud s ALA 70 Cb -0.21 -1.78 -0.05 0.00 0.00 0.00 0.00 23.12 21.08 1lud s ALA 70 CO 0.08 -2.03 1.33 -0.65 0.00 0.00 0.00 175.76 174.49 1lud s GLN 71 N -0.22 4.32 0.00 0.00 -1.52 -1.26 -2.84 119.66 118.15 1lud s GLN 71 Ca 0.28 1.89 0.00 0.00 -1.95 0.00 0.00 55.36 55.58 1lud s GLN 71 Cb -0.04 -3.50 0.00 0.00 -0.22 0.00 0.00 33.01 29.26 1lud s GLN 71 CO -0.15 -0.49 0.00 0.41 -0.25 0.00 0.00 175.29 174.81 1lud n GLY 72 N 3.51 2.94 3.63 3.09 0.00 -1.26 -4.98 105.19 112.11 1lud n GLY 72 Ca 0.12 -0.68 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 1lud n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud s ALA 73 N -1.30 3.11 0.93 4.61 0.00 -1.13 -4.87 121.76 123.11 1lud s ALA 73 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 51.96 50.97 1lud s ALA 73 Cb 0.00 -1.30 0.16 0.00 0.00 0.00 0.00 23.12 21.98 1lud s ALA 73 CO 0.00 0.59 1.14 0.08 0.00 0.00 0.00 175.76 177.57 1lud s VAL 74 N -0.89 2.07 -0.07 0.00 1.01 -0.26 -4.74 120.40 117.51 1lud s VAL 74 Ca 0.14 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 1lud s VAL 74 Cb -0.11 -2.05 0.04 0.00 0.00 0.00 0.00 36.38 34.26 1lud s VAL 74 CO 0.04 -0.03 0.15 -0.69 0.00 0.00 0.00 175.10 174.57 1lud s VAL 75 N -2.64 -0.10 0.04 2.92 1.01 -1.26 -2.66 120.40 117.72 1lud s VAL 75 Ca 0.67 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.89 1lud s VAL 75 Cb -0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 1lud s VAL 75 CO 0.58 0.09 -0.08 0.68 0.00 0.00 0.00 175.10 176.37 1lud s VAL 76 N 1.43 0.56 -0.12 2.92 -7.23 -0.62 -4.93 120.40 112.41 1lud s VAL 76 Ca -0.07 -1.07 0.15 0.00 -1.81 0.00 0.00 61.98 59.18 1lud s VAL 76 Cb -0.12 -0.62 0.34 0.00 0.56 0.00 0.00 36.38 36.55 1lud s VAL 76 CO -0.06 -0.37 1.17 1.41 -0.31 0.00 0.00 175.10 176.94 1lud n HIS 77 N 1.48 0.00 -3.28 2.82 8.25 -1.26 -2.70 115.22 120.53 1lud n HIS 77 Ca -0.23 -1.01 0.03 0.00 -0.26 0.00 0.00 57.72 56.26 1lud n HIS 77 Cb 0.55 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.45 1lud n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1lud s ASP 78 N -2.65 -0.80 0.45 0.41 -1.08 -1.26 -4.92 116.67 106.82 1lud s ASP 78 Ca 0.32 0.73 0.33 0.00 -0.52 0.00 0.00 52.55 53.40 1lud s ASP 78 Cb 0.31 1.77 1.48 0.00 -1.46 0.00 0.00 42.92 45.02 1lud s ASP 78 CO -0.06 -0.15 1.60 0.58 0.52 0.00 0.00 175.17 177.66 1lud h VAL 79 N 5.62 0.07 -1.00 1.11 2.07 -1.98 0.86 116.25 123.00 1lud h VAL 79 Ca -0.17 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.37 1lud h VAL 79 Cb 1.14 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 1lud h VAL 79 CO 0.07 0.01 0.66 0.00 0.02 0.00 0.00 177.57 178.33 1lud h ALA 80 N 1.56 1.34 -0.25 1.67 0.00 -2.00 -2.34 119.26 119.24 1lud h ALA 80 Ca 0.85 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.68 1lud h ALA 80 Cb 2.77 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 20.20 1lud h ALA 80 CO -0.41 0.56 0.03 0.00 0.00 0.00 0.00 179.25 179.43 1lud h ALA 81 N 1.42 0.33 -1.01 0.00 0.00 0.36 -2.84 119.26 117.51 1lud h ALA 81 Ca 0.40 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.24 1lud h ALA 81 Cb 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.61 1lud h ALA 81 CO -0.12 0.02 0.63 0.28 0.00 0.00 0.00 179.25 180.06 1lud h VAL 82 N 0.21 0.91 -0.60 0.00 2.07 -1.32 -0.14 116.25 117.38 1lud h VAL 82 Ca 0.07 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1lud h VAL 82 Cb 0.36 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 1lud h VAL 82 CO 0.01 0.18 0.29 -0.26 0.02 0.00 0.00 177.57 177.81 1lud h PHE 83 N 0.99 0.83 0.79 1.57 0.04 -1.21 -3.05 116.94 116.90 1lud h PHE 83 Ca 0.50 -0.02 -0.04 0.00 2.80 0.00 0.00 57.97 61.21 1lud h PHE 83 Cb 0.51 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 1lud h PHE 83 CO -0.00 0.61 -0.45 0.00 -0.60 0.00 0.00 178.31 177.87 1lud h ALA 84 N 1.48 -1.18 -0.50 2.45 0.00 -0.85 -2.41 119.26 118.24 1lud h ALA 84 Ca 0.21 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.97 1lud h ALA 84 Cb 0.08 0.53 -0.10 0.00 0.00 0.00 0.00 17.79 18.30 1lud h ALA 84 CO -0.03 -1.18 -0.30 -0.92 0.00 0.00 0.00 179.25 176.83 1lud h TYR 85 N -1.15 -0.80 -0.58 0.00 3.20 -1.43 -0.37 116.97 115.83 1lud h TYR 85 Ca -0.11 0.06 0.10 0.00 3.14 0.00 0.00 58.73 61.93 1lud h TYR 85 Cb 0.91 0.43 -0.08 0.00 1.54 0.00 0.00 36.73 39.53 1lud h TYR 85 CO -0.07 -0.36 0.15 0.00 -1.64 0.00 0.00 178.16 176.23 1lud h ALA 86 N 1.00 0.69 0.00 1.82 0.00 -1.47 0.43 119.26 121.73 1lud h ALA 86 Ca 0.21 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1lud h ALA 86 Cb 0.53 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1lud h ALA 86 CO -0.60 -0.28 -0.05 -0.22 0.00 0.00 0.00 179.25 178.10 1lud h LYS 87 N 0.29 0.00 0.13 0.00 3.64 -0.60 -2.83 116.57 117.20 1lud h LYS 87 Ca 0.30 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.33 1lud h LYS 87 Cb 0.41 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1lud h LYS 87 CO -0.36 0.05 -1.81 0.37 -2.27 0.00 0.00 179.45 175.43 1lud h GLN 88 N 0.00 0.28 -5.63 1.90 4.15 0.11 -3.44 115.11 112.48 1lud h GLN 88 Ca -0.00 -0.49 -0.62 0.00 0.77 0.00 0.00 58.65 58.32 1lud h GLN 88 Cb 0.22 0.18 -0.12 0.00 0.21 0.00 0.00 27.48 27.97 1lud h GLN 88 CO 0.01 1.17 0.26 -1.01 -1.93 0.00 0.00 178.83 177.33 1lud s HIS 89 N -2.58 3.18 -2.01 3.99 3.76 0.39 -4.90 115.29 117.12 1lud s HIS 89 Ca -0.16 0.60 0.07 0.00 -0.15 0.00 0.00 55.06 55.42 1lud s HIS 89 Cb 0.06 -3.15 0.21 0.00 1.11 0.00 0.00 32.58 30.81 1lud s HIS 89 CO 0.82 -0.57 1.17 -0.35 -0.85 0.00 0.00 174.74 174.96 1lud n PRO 90 N 6.10 1.50 0.00 8.40 -0.04 -1.26 -3.55 135.00 146.14 1lud n PRO 90 Ca 0.01 -0.77 0.00 0.00 -0.04 0.00 0.00 63.50 62.70 1lud n PRO 90 Cb 0.48 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 1lud n PRO 90 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1lud n ASP 91 N 0.12 0.00 -3.44 3.54 2.03 -1.26 -5.00 116.55 112.54 1lud n ASP 91 Ca 0.07 -1.00 -0.21 0.00 0.52 0.00 0.00 54.79 54.17 1lud n ASP 91 Cb 0.18 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.47 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1lud s GLN 92 N 0.00 0.29 0.00 -0.67 0.74 -1.23 -4.77 119.66 114.02 1lud s GLN 92 Ca 0.00 -0.29 0.00 0.00 0.05 0.00 0.00 55.36 55.12 1lud s GLN 92 Cb 0.00 -0.82 0.00 0.00 1.10 0.00 0.00 33.01 33.29 1lud s GLN 92 CO 0.00 -1.03 0.00 0.39 -0.55 0.00 0.00 175.29 174.10 1lud n GLU 93 N 5.26 0.78 -3.65 1.67 -0.58 -1.26 -4.62 120.64 118.23 1lud n GLU 93 Ca -0.03 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.33 1lud n GLU 93 Cb 0.45 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 31.20 1lud n GLU 93 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1lud s LEU 94 N 0.00 4.09 -0.18 -4.62 2.96 -1.26 -2.38 118.68 117.29 1lud s LEU 94 Ca 0.00 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1lud s LEU 94 Cb 0.00 -2.01 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 1lud s LEU 94 CO 0.00 -0.18 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.05 1lud s VAL 95 N 1.63 2.92 0.31 1.68 1.01 0.22 0.71 120.40 128.88 1lud s VAL 95 Ca 0.05 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 1lud s VAL 95 Cb -0.17 -2.28 -0.09 0.00 0.00 0.00 0.00 36.38 33.84 1lud s VAL 95 CO 0.07 0.48 0.80 -0.63 0.00 0.00 0.00 175.10 175.82 1lud s ILE 96 N 1.08 4.53 0.00 2.22 -1.09 0.42 0.10 121.20 128.46 1lud s ILE 96 Ca 0.00 1.28 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 1lud s ILE 96 Cb -0.15 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 1lud s ILE 96 CO -0.03 -0.04 0.14 0.00 -1.23 0.00 0.00 174.94 173.79 1lud n ALA 97 N 0.07 1.16 0.00 9.38 0.00 0.17 -2.07 120.51 129.22 1lud n ALA 97 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1lud n ALA 97 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1lud n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lud n GLY 98 N 0.22 -1.46 0.00 0.00 0.00 -1.19 -4.93 105.19 97.84 1lud n GLY 98 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1lud n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lud n GLY 99 N 0.00 -1.28 0.29 -0.02 0.00 -1.26 -0.07 105.19 102.85 1lud n GLY 99 Ca 0.00 -1.11 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 1lud n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud h ALA 100 N -2.00 0.89 -0.79 4.61 0.00 -1.92 -2.46 119.26 117.59 1lud h ALA 100 Ca 0.00 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 54.88 1lud h ALA 100 Cb 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 1lud h ALA 100 CO 0.00 0.43 0.52 1.96 0.00 0.00 0.00 179.25 182.16 1lud h GLN 101 N 0.95 0.69 0.00 0.00 4.20 -1.98 -1.13 115.11 117.84 1lud h GLN 101 Ca 0.24 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.77 1lud h GLN 101 Cb 0.09 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1lud h GLN 101 CO -0.03 0.45 -0.65 0.82 -0.67 0.00 0.00 178.83 178.75 1lud h ILE 102 N 0.71 1.20 0.00 2.54 1.08 -1.69 -3.10 117.51 118.24 1lud h ILE 102 Ca 0.37 -2.48 -0.07 0.00 -0.39 0.00 0.00 64.86 62.29 1lud h ILE 102 Cb 0.47 2.45 -0.01 0.00 -3.07 0.00 0.00 36.82 36.66 1lud h ILE 102 CO -0.14 0.64 -0.34 -0.26 -0.69 0.00 0.00 178.15 177.35 1lud h PHE 103 N 0.00 0.00 0.00 1.37 0.04 -0.87 -2.94 116.94 114.54 1lud h PHE 103 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1lud h PHE 103 Cb 1.39 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.54 1lud h PHE 103 CO 0.00 0.34 -0.00 1.15 -0.60 0.00 0.00 178.31 179.20 1lud h THR 104 N 0.00 1.65 0.00 -1.55 2.02 -1.41 -1.06 112.91 112.56 1lud h THR 104 Ca -0.00 -2.09 -0.02 0.00 0.77 0.00 0.00 66.41 65.07 1lud h THR 104 Cb 0.97 3.04 -0.00 0.00 -1.74 0.00 0.00 68.15 70.41 1lud h THR 104 CO 0.04 0.53 -0.08 0.00 0.37 0.00 0.00 175.52 176.38 1lud h ALA 105 N 0.03 1.71 -0.02 6.16 0.00 -1.61 -2.04 119.26 123.49 1lud h ALA 105 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1lud h ALA 105 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1lud h ALA 105 CO 0.00 0.10 -0.39 1.19 0.00 0.00 0.00 179.25 180.16 1lud n PHE 106 N -4.22 0.00 -0.23 0.00 3.72 -1.11 -4.41 117.46 111.21 1lud n PHE 106 Ca -0.03 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.40 1lud n PHE 106 Cb 0.16 -0.00 0.27 0.00 -0.94 0.00 0.00 39.48 38.97 1lud n PHE 106 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1lud h LYS 107 N 2.80 0.94 -0.41 -1.08 2.10 -0.41 -2.32 116.57 118.19 1lud h LYS 107 Ca 0.00 -0.06 -0.10 0.00 -2.00 0.00 0.00 60.65 58.50 1lud h LYS 107 Cb 0.79 -0.21 -0.02 0.00 -0.90 0.00 0.00 32.23 31.89 1lud h LYS 107 CO 0.00 0.62 -0.14 0.22 -2.00 0.00 0.00 179.45 178.15 1lud h ASP 108 N 0.97 0.75 -3.78 7.07 3.58 -1.77 -3.35 116.42 119.88 1lud h ASP 108 Ca 0.31 -0.23 -0.71 0.00 0.42 0.00 0.00 57.03 56.82 1lud h ASP 108 Cb 0.04 -0.20 -0.34 0.00 1.72 0.00 0.00 39.33 40.54 1lud h ASP 108 CO -0.09 0.90 -0.18 -1.81 -2.88 0.00 0.00 179.24 175.17 1lud s ASP 109 N -6.71 5.75 0.19 2.28 1.11 -0.87 -5.06 116.67 113.36 1lud s ASP 109 Ca -0.09 -3.24 0.11 0.00 0.18 0.00 0.00 52.55 49.51 1lud s ASP 109 Cb 0.14 -1.92 -0.04 0.00 1.07 0.00 0.00 42.92 42.16 1lud s ASP 109 CO 0.82 -0.30 -0.21 -0.69 1.18 0.00 0.00 175.17 175.96 1lud s VAL 110 N -0.63 2.52 0.00 -1.27 1.01 -1.25 -4.80 120.40 115.98 1lud s VAL 110 Ca 0.22 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.25 1lud s VAL 110 Cb -0.13 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.03 1lud s VAL 110 CO -0.08 -0.11 0.00 0.47 0.00 0.00 0.00 175.10 175.38 1lud n ASP 111 N 0.23 2.48 -3.73 3.32 8.00 0.39 -4.81 116.55 122.43 1lud n ASP 111 Ca -0.12 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.25 1lud n ASP 111 Cb 0.56 0.16 -0.14 0.00 -0.02 0.00 0.00 41.12 41.69 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lud s THR 112 N -1.54 -0.05 -0.15 -3.53 2.01 -0.96 -2.63 115.64 108.80 1lud s THR 112 Ca 0.00 0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.13 1lud s THR 112 Cb 0.00 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.16 1lud s THR 112 CO 0.00 0.07 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.20 1lud s LEU 113 N 1.24 3.26 -0.40 4.42 1.43 -0.55 0.64 118.68 128.72 1lud s LEU 113 Ca -0.09 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 1lud s LEU 113 Cb -0.11 -1.78 0.12 0.00 0.03 0.00 0.00 46.19 44.45 1lud s LEU 113 CO -0.07 0.19 0.17 -0.76 0.23 0.00 0.00 176.35 176.11 1lud s LEU 114 N 0.25 3.11 0.02 1.79 1.43 0.33 -0.10 118.68 125.51 1lud s LEU 114 Ca -0.03 -2.34 0.05 0.00 -1.03 0.00 0.00 54.13 50.78 1lud s LEU 114 Cb -0.14 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 1lud s LEU 114 CO 0.03 -0.32 -0.12 0.54 0.23 0.00 0.00 176.35 176.71 1lud s VAL 115 N 0.69 3.27 -0.26 -1.59 0.11 -0.73 -1.92 120.40 119.97 1lud s VAL 115 Ca 0.14 -0.96 -0.08 0.00 -2.93 0.00 0.00 61.98 58.16 1lud s VAL 115 Cb -0.22 -2.41 -0.03 0.00 -1.53 0.00 0.00 36.38 32.20 1lud s VAL 115 CO -0.08 0.37 0.10 -0.89 -3.33 0.00 0.00 175.10 171.27 1lud s THR 116 N -0.97 4.51 -0.41 5.04 2.01 -0.93 -0.98 115.64 123.91 1lud s THR 116 Ca 0.16 -0.16 -0.18 0.00 0.31 0.00 0.00 61.69 61.82 1lud s THR 116 Cb -0.11 -3.15 0.02 0.00 0.01 0.00 0.00 72.50 69.27 1lud s THR 116 CO 0.07 0.28 0.47 -0.13 -0.69 0.00 0.00 174.62 174.62 1lud s ARG 117 N 1.64 3.21 0.42 4.92 1.81 -0.17 -1.31 118.95 129.48 1lud s ARG 117 Ca 0.06 -0.61 -0.11 0.00 -1.72 0.00 0.00 55.73 53.35 1lud s ARG 117 Cb -0.16 -3.94 -0.07 0.00 -0.45 0.00 0.00 34.95 30.34 1lud s ARG 117 CO 0.05 -0.83 0.80 -0.51 -0.68 0.00 0.00 175.30 174.13 1lud s LEU 118 N 2.27 3.80 0.15 2.53 1.02 -0.70 -1.45 118.68 126.29 1lud s LEU 118 Ca 0.14 1.20 0.16 0.00 0.02 0.00 0.00 54.13 55.66 1lud s LEU 118 Cb -0.16 -4.09 -0.06 0.00 0.02 0.00 0.00 46.19 41.90 1lud s LEU 118 CO 0.14 -0.43 1.08 0.00 0.02 0.00 0.00 176.35 177.16 1lud h ALA 119 N 1.20 0.65 -2.54 4.21 0.00 -1.01 -2.92 119.26 118.86 1lud h ALA 119 Ca -0.47 -0.67 -0.46 0.00 0.00 0.00 0.00 54.91 53.30 1lud h ALA 119 Cb 1.19 0.12 0.12 0.00 0.00 0.00 0.00 17.79 19.22 1lud h ALA 119 CO 0.63 0.79 0.35 0.20 0.00 0.00 0.00 179.25 181.22 1lud s GLY 120 N -4.65 1.58 -0.18 0.00 0.00 -1.03 -4.69 107.32 98.36 1lud s GLY 120 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.14 1lud s GLY 120 CO 0.79 -0.05 -0.09 -0.45 0.00 0.00 0.00 173.10 173.29 1lud s SER 121 N -4.26 3.07 0.28 1.64 0.15 -1.26 -2.72 113.70 110.59 1lud s SER 121 Ca 0.63 -0.74 0.08 0.00 0.70 0.00 0.00 55.95 56.63 1lud s SER 121 Cb -0.13 -1.12 -0.04 0.00 -1.71 0.00 0.00 66.02 63.02 1lud s SER 121 CO 0.52 -0.14 0.13 -0.36 1.20 0.00 0.00 173.24 174.59 1lud s PHE 122 N 1.49 2.90 0.17 3.44 0.40 -1.26 -5.05 117.98 120.06 1lud s PHE 122 Ca 0.01 -0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.20 1lud s PHE 122 Cb -0.15 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.94 1lud s PHE 122 CO -0.08 0.50 0.06 -2.00 0.70 0.00 0.00 175.22 174.39 1lud s GLU 123 N -3.80 2.62 0.00 0.44 2.12 -1.26 -4.84 118.70 113.98 1lud s GLU 123 Ca 0.34 -1.00 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1lud s GLU 123 Cb -0.06 -2.49 0.00 0.00 0.26 0.00 0.00 34.13 31.84 1lud s GLU 123 CO 0.23 0.47 0.00 0.41 -0.54 0.00 0.00 175.26 175.83 1lud n GLY 124 N -0.21 1.45 0.00 -1.50 0.00 -1.26 -4.91 105.19 98.76 1lud n GLY 124 Ca -0.09 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1lud n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lud n ASP 125 N 0.00 0.24 -4.40 1.61 9.92 -1.26 -5.02 116.55 117.65 1lud n ASP 125 Ca 0.00 -0.11 -0.37 0.00 -0.53 0.00 0.00 54.79 53.78 1lud n ASP 125 Cb 0.00 0.26 -0.12 0.00 -0.64 0.00 0.00 41.12 40.62 1lud n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1lud s THR 126 N -0.31 4.24 0.22 -3.53 2.01 -1.25 -5.07 115.64 111.96 1lud s THR 126 Ca 0.00 -0.49 0.12 0.00 0.31 0.00 0.00 61.69 61.63 1lud s THR 126 Cb 0.00 -3.13 -0.05 0.00 0.01 0.00 0.00 72.50 69.33 1lud s THR 126 CO 0.00 0.14 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.31 1lud s LYS 127 N 1.56 1.60 0.70 4.92 1.02 -1.26 -2.51 119.74 125.78 1lud s LYS 127 Ca 0.04 -1.60 -0.16 0.00 0.02 0.00 0.00 55.97 54.27 1lud s LYS 127 Cb -0.17 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.34 1lud s LYS 127 CO 0.04 0.38 1.23 1.41 -0.92 0.00 0.00 175.35 177.49 1lud s MET 128 N -2.98 2.27 0.57 1.68 1.75 -1.22 -4.89 119.30 116.48 1lud s MET 128 Ca 0.24 1.85 -0.16 0.00 -1.25 0.00 0.00 55.69 56.37 1lud s MET 128 Cb -0.07 -1.84 -0.05 0.00 2.84 0.00 0.00 34.83 35.72 1lud s MET 128 CO 0.12 -1.76 1.05 0.96 -0.65 0.00 0.00 175.02 174.74 1lud s ILE 129 N -1.80 3.89 -0.54 10.11 -4.36 -1.26 -4.91 121.20 122.33 1lud s ILE 129 Ca 0.77 0.93 -0.26 0.00 -0.26 0.00 0.00 60.65 61.83 1lud s ILE 129 Cb -0.32 -3.43 -0.08 0.00 1.25 0.00 0.00 42.46 39.88 1lud s ILE 129 CO 0.43 -0.49 2.43 -0.81 0.24 0.00 0.00 174.94 176.75 1lud n PRO 130 N -1.84 0.94 -3.06 0.37 -0.04 -1.26 -4.96 135.00 125.16 1lud n PRO 130 Ca 0.09 -0.07 -0.29 0.00 -0.04 0.00 0.00 63.50 63.19 1lud n PRO 130 Cb 0.53 -3.36 -0.03 0.00 -0.04 0.00 0.00 33.50 30.61 1lud n PRO 130 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1lud s LEU 131 N 12.24 3.91 -1.19 1.53 1.43 -1.26 -5.00 118.68 130.35 1lud s LEU 131 Ca 1.00 0.90 -0.06 0.00 -1.03 0.00 0.00 54.13 54.94 1lud s LEU 131 Cb -0.23 -3.77 0.23 0.00 0.03 0.00 0.00 46.19 42.45 1lud s LEU 131 CO 0.26 -0.33 1.76 -3.20 0.23 0.00 0.00 176.35 175.08 1lud n ASN 132 N -1.27 6.00 -0.14 2.29 4.05 -1.26 -4.78 115.26 120.16 1lud n ASN 132 Ca 0.00 -3.27 0.25 0.00 0.45 0.00 0.00 54.58 52.01 1lud n ASN 132 Cb 0.54 -1.37 0.70 0.00 1.23 0.00 0.00 39.78 40.88 1lud n ASN 132 CO 0.00 0.00 0.00 -0.50 -3.05 0.00 0.00 177.26 173.71 1lud h TRP 133 N 5.42 0.05 0.00 1.20 4.06 -1.94 0.39 115.95 125.13 1lud h TRP 133 Ca 0.35 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.27 1lud h TRP 133 Cb 0.58 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.71 1lud h TRP 133 CO 1.19 0.01 -0.17 0.22 -3.56 0.00 0.00 178.44 176.14 1lud h ASP 134 N 0.04 0.00 0.54 -3.49 3.58 -2.04 -1.23 116.42 113.81 1lud h ASP 134 Ca 0.38 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.83 1lud h ASP 134 Cb 1.47 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.52 1lud h ASP 134 CO -0.02 0.17 -0.37 -0.67 -2.88 0.00 0.00 179.24 175.47 1lud n ASP 135 N -4.23 0.48 -4.62 2.28 2.03 0.13 -4.88 116.55 107.75 1lud n ASP 135 Ca -0.02 -0.23 -0.25 0.00 0.52 0.00 0.00 54.79 54.81 1lud n ASP 135 Cb 0.24 0.10 -0.09 0.00 -0.72 0.00 0.00 41.12 40.65 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1lud s PHE 136 N -2.91 2.52 -0.02 -0.67 0.08 -0.47 -3.68 117.98 112.83 1lud s PHE 136 Ca 0.14 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.72 1lud s PHE 136 Cb 0.18 -1.52 0.01 0.00 -0.57 0.00 0.00 43.02 41.12 1lud s PHE 136 CO 0.64 0.48 -0.03 0.99 -0.10 0.00 0.00 175.22 177.20 1lud s THR 137 N -2.56 0.36 -0.17 0.64 2.01 -1.09 -4.86 115.64 109.96 1lud s THR 137 Ca 0.35 -0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.97 1lud s THR 137 Cb 0.02 -0.37 -0.03 0.00 0.01 0.00 0.00 72.50 72.13 1lud s THR 137 CO 0.19 0.15 1.48 -0.75 -0.69 0.00 0.00 174.62 175.00 1lud s LYS 138 N 0.53 4.04 -0.06 4.92 2.36 -1.26 -1.53 119.74 128.74 1lud s LYS 138 Ca -0.06 1.75 0.20 0.00 -2.55 0.00 0.00 55.97 55.31 1lud s LYS 138 Cb -0.09 -3.92 -0.26 0.00 -1.05 0.00 0.00 37.83 32.51 1lud s LYS 138 CO -0.01 -0.98 0.43 1.33 1.55 0.00 0.00 175.35 177.68 1lud n VAL 139 N 5.83 0.71 -3.80 4.02 0.24 0.91 -4.94 118.33 121.30 1lud n VAL 139 Ca 0.16 -0.66 -0.13 0.00 -2.04 0.00 0.00 64.34 61.68 1lud n VAL 139 Cb 0.45 -0.30 -0.13 0.00 -1.47 0.00 0.00 33.84 32.39 1lud n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1lud s SER 140 N -5.11 -0.17 -0.14 -1.34 0.01 -1.17 -5.03 113.70 100.75 1lud s SER 140 Ca -0.07 0.35 -0.10 0.00 1.31 0.00 0.00 55.95 57.43 1lud s SER 140 Cb 0.10 0.32 0.04 0.00 0.21 0.00 0.00 66.02 66.70 1lud s SER 140 CO 0.86 -0.08 0.34 -0.44 0.41 0.00 0.00 173.24 174.33 1lud s SER 141 N 0.35 -0.39 -0.07 2.44 0.01 -1.26 -0.80 113.70 113.99 1lud s SER 141 Ca -0.02 0.72 0.02 0.00 1.31 0.00 0.00 55.95 57.98 1lud s SER 141 Cb -0.04 0.66 0.01 0.00 0.21 0.00 0.00 66.02 66.87 1lud s SER 141 CO -0.01 -0.15 -0.12 -0.60 0.41 0.00 0.00 173.24 172.76 1lud s ARG 142 N 0.75 1.75 -0.21 12.44 3.52 -0.97 -4.96 118.95 131.27 1lud s ARG 142 Ca -0.05 -0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.05 1lud s ARG 142 Cb -0.06 -1.45 -0.04 0.00 -1.56 0.00 0.00 34.95 31.84 1lud s ARG 142 CO -0.05 0.01 0.09 0.99 -0.81 0.00 0.00 175.30 175.53 1lud s THR 143 N 0.71 4.81 -0.10 4.11 2.01 -1.26 -1.23 115.64 124.68 1lud s THR 143 Ca -0.14 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.87 1lud s THR 143 Cb -0.16 -3.20 0.01 0.00 0.01 0.00 0.00 72.50 69.16 1lud s THR 143 CO 0.03 0.41 -0.16 0.54 -0.69 0.00 0.00 174.62 174.75 1lud s VAL 144 N 0.79 1.53 0.49 3.82 0.11 -0.94 -5.03 120.40 121.17 1lud s VAL 144 Ca 0.04 -0.67 -0.04 0.00 -2.93 0.00 0.00 61.98 58.39 1lud s VAL 144 Cb -0.13 -1.39 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 1lud s VAL 144 CO 0.02 0.45 0.78 -1.61 -3.33 0.00 0.00 175.10 171.40 1lud s GLU 145 N 0.90 3.28 0.04 1.54 2.02 -1.26 -2.85 118.70 122.37 1lud s GLU 145 Ca -0.08 -0.03 -0.01 0.00 0.02 0.00 0.00 54.97 54.87 1lud s GLU 145 Cb -0.15 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.64 1lud s GLU 145 CO -0.00 -0.32 -0.03 0.34 0.02 0.00 0.00 175.26 175.27 1lud s ASP 146 N -4.18 0.43 0.62 -0.19 2.15 -1.26 -4.93 116.67 109.32 1lud s ASP 146 Ca 0.49 -0.90 0.35 0.00 0.43 0.00 0.00 52.55 52.92 1lud s ASP 146 Cb -0.10 0.18 2.03 0.00 -0.30 0.00 0.00 42.92 44.73 1lud s ASP 146 CO 0.43 -0.54 2.27 0.71 -0.17 0.00 0.00 175.17 177.87 1lud h THR 147 N 3.43 0.30 -3.72 1.71 1.35 -1.99 -3.38 112.91 110.62 1lud h THR 147 Ca -0.34 0.00 -0.65 0.00 -0.55 0.00 0.00 66.41 64.87 1lud h THR 147 Cb 1.15 0.97 -0.16 0.00 -1.73 0.00 0.00 68.15 68.38 1lud h THR 147 CO 0.61 0.00 -0.31 0.21 -0.25 0.00 0.00 175.52 175.78 1lud s ASN 148 N -5.67 6.17 0.28 5.36 2.47 -1.26 -4.96 114.94 117.33 1lud s ASN 148 Ca -0.05 -0.06 0.01 0.00 0.42 0.00 0.00 52.86 53.18 1lud s ASN 148 Cb 0.14 -2.19 0.67 0.00 -1.45 0.00 0.00 41.25 38.42 1lud s ASN 148 CO 0.48 -0.25 1.66 -0.65 -3.72 0.00 0.00 177.10 174.62 1lud h PRO 149 N 8.37 0.24 0.07 0.43 0.10 -2.00 0.56 132.00 139.77 1lud h PRO 149 Ca -0.31 -0.01 -0.24 0.00 0.10 0.00 0.00 66.00 65.53 1lud h PRO 149 Cb 1.16 -0.05 -0.01 0.00 0.10 0.00 0.00 31.00 32.19 1lud h PRO 149 CO 0.66 0.16 -1.11 0.00 0.10 0.00 0.00 178.00 177.81 1lud h ALA 150 N 1.74 0.24 0.00 -0.75 0.00 -1.93 -3.19 119.26 115.37 1lud h ALA 150 Ca 0.53 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1lud h ALA 150 Cb 1.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1lud h ALA 150 CO -0.61 1.07 0.00 1.28 0.00 0.00 0.00 179.25 180.98 1lud n LEU 151 N -3.48 0.00 -4.77 0.00 4.77 0.15 -2.47 117.00 111.20 1lud n LEU 151 Ca -0.05 0.03 -0.39 0.00 -0.03 0.00 0.00 56.01 55.57 1lud n LEU 151 Cb 0.97 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1lud n LEU 151 CO 0.51 -0.02 0.96 -0.89 -1.33 0.00 0.00 177.39 176.62 1lud s THR 152 N -2.07 2.59 0.16 -5.08 2.01 -0.97 -4.69 115.64 107.59 1lud s THR 152 Ca 0.23 0.52 -0.21 0.00 0.31 0.00 0.00 61.69 62.55 1lud s THR 152 Cb 0.11 -3.30 0.05 0.00 0.01 0.00 0.00 72.50 69.37 1lud s THR 152 CO 0.19 0.07 0.54 -1.38 -0.69 0.00 0.00 174.62 173.35 1lud s HIS 153 N -1.27 -0.40 0.09 4.92 -3.43 -1.13 -0.76 115.29 113.30 1lud s HIS 153 Ca 0.58 0.14 0.05 0.00 -0.80 0.00 0.00 55.06 55.02 1lud s HIS 153 Cb -0.38 0.47 -0.03 0.00 -1.43 0.00 0.00 32.58 31.21 1lud s HIS 153 CO 0.49 -0.83 -0.12 0.99 -2.00 0.00 0.00 174.74 173.26 1lud s THR 154 N -3.78 1.05 -0.24 -5.38 2.01 -0.53 -2.23 115.64 106.54 1lud s THR 154 Ca 0.03 -1.47 -0.07 0.00 0.31 0.00 0.00 61.69 60.48 1lud s THR 154 Cb -0.00 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 1lud s THR 154 CO -0.11 -0.38 0.07 -0.31 -0.69 0.00 0.00 174.62 173.19 1lud s TYR 155 N -1.83 3.11 -0.20 4.92 2.02 -0.37 -0.99 117.35 124.01 1lud s TYR 155 Ca 0.02 -0.34 -0.02 0.00 -0.37 0.00 0.00 57.07 56.36 1lud s TYR 155 Cb -0.07 -2.21 -0.00 0.00 -0.40 0.00 0.00 41.96 39.28 1lud s TYR 155 CO 0.02 -0.27 -0.08 -1.21 -1.57 0.00 0.00 175.55 172.43 1lud s GLU 156 N 1.40 3.31 -0.18 -0.62 2.02 -0.15 -2.28 118.70 122.19 1lud s GLU 156 Ca 0.05 -0.67 -0.03 0.00 0.02 0.00 0.00 54.97 54.34 1lud s GLU 156 Cb -0.15 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.19 1lud s GLU 156 CO 0.04 -0.14 -0.06 0.08 0.02 0.00 0.00 175.26 175.19 1lud s VAL 157 N 1.29 3.47 0.30 2.63 1.01 0.02 -1.77 120.40 127.35 1lud s VAL 157 Ca 0.03 -0.48 0.10 0.00 0.00 0.00 0.00 61.98 61.63 1lud s VAL 157 Cb -0.14 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 1lud s VAL 157 CO -0.04 0.46 -0.03 0.26 0.00 0.00 0.00 175.10 175.76 1lud s TRP 158 N 0.90 2.56 0.01 5.22 0.52 0.86 -0.06 118.94 128.95 1lud s TRP 158 Ca -0.01 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.78 1lud s TRP 158 Cb -0.15 -1.30 -0.01 0.00 -1.15 0.00 0.00 33.47 30.86 1lud s TRP 158 CO 0.01 0.56 -0.03 -0.65 0.02 0.00 0.00 176.95 176.86 1lud s GLN 159 N -3.67 0.25 -0.03 4.98 -0.21 -0.58 -1.49 119.66 118.91 1lud s GLN 159 Ca 0.33 -0.33 -0.30 0.00 0.02 0.00 0.00 55.36 55.08 1lud s GLN 159 Cb -0.03 -0.09 -0.06 0.00 1.00 0.00 0.00 33.01 33.83 1lud s GLN 159 CO 0.19 0.01 1.56 0.21 -2.12 0.00 0.00 175.29 175.15 1lud s LYS 160 N -0.68 4.21 0.58 2.91 2.20 -1.08 -2.68 119.74 125.20 1lud s LYS 160 Ca -0.06 2.12 -0.04 0.00 -0.36 0.00 0.00 55.97 57.63 1lud s LYS 160 Cb -0.05 -3.81 0.02 0.00 -1.51 0.00 0.00 37.83 32.48 1lud s LYS 160 CO -0.00 -0.75 0.87 0.15 -0.36 0.00 0.00 175.35 175.25 1lud s LYS 161 N 3.38 2.81 0.00 4.03 -0.14 -1.24 -5.00 119.74 123.59 1lud s LYS 161 Ca 0.70 -0.19 0.00 0.00 -1.36 0.00 0.00 55.97 55.12 1lud s LYS 161 Cb -0.33 -2.33 0.00 0.00 -1.68 0.00 0.00 37.83 33.49 1lud s LYS 161 CO 0.28 -0.70 0.34 0.00 -0.76 0.00 0.00 175.35 174.51