#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 1.51 -0.18 2.41 0.00 0.22 0.18 121.76 125.91 1lud s ALA 2 Ca 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 51.96 50.66 1lud s ALA 2 Cb 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 22.95 1lud s ALA 2 CO 0.00 0.18 0.12 -0.06 0.00 0.00 0.00 175.76 176.00 1lud s PHE 3 N -1.69 3.41 -0.33 0.00 0.08 0.28 0.62 117.98 120.35 1lud s PHE 3 Ca 0.06 0.32 -0.01 0.00 0.12 0.00 0.00 56.93 57.43 1lud s PHE 3 Cb -0.07 -2.08 0.11 0.00 -0.57 0.00 0.00 43.02 40.40 1lud s PHE 3 CO 0.03 0.37 0.14 -1.17 -0.10 0.00 0.00 175.22 174.49 1lud s LEU 4 N 0.02 1.96 0.00 -0.37 2.96 -0.89 0.13 118.68 122.49 1lud s LEU 4 Ca 0.09 -1.81 0.07 0.00 -0.22 0.00 0.00 54.13 52.25 1lud s LEU 4 Cb -0.11 -0.78 -0.03 0.00 0.50 0.00 0.00 46.19 45.77 1lud s LEU 4 CO -0.00 -0.38 0.24 -2.67 -1.32 0.00 0.00 176.35 172.22 1lud n TRP 5 N 4.60 -0.58 -4.17 5.38 2.14 -0.54 -4.46 117.44 119.81 1lud n TRP 5 Ca 0.01 -2.66 -0.19 0.00 2.07 0.00 0.00 57.50 56.73 1lud n TRP 5 Cb 0.40 0.22 -0.16 0.00 -0.81 0.00 0.00 31.31 30.97 1lud n TRP 5 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1lud s ALA 6 N -3.25 0.60 0.04 -1.67 0.00 -1.26 -2.17 121.76 114.04 1lud s ALA 6 Ca 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.20 1lud s ALA 6 Cb 0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 1lud s ALA 6 CO 0.24 0.03 -0.02 1.14 0.00 0.00 0.00 175.76 177.16 1lud s GLN 7 N 0.61 0.52 0.00 0.00 -2.07 0.95 -4.56 119.66 115.11 1lud s GLN 7 Ca -0.08 -0.98 0.00 0.00 -1.82 0.00 0.00 55.36 52.48 1lud s GLN 7 Cb -0.11 0.18 0.00 0.00 -1.09 0.00 0.00 33.01 31.99 1lud s GLN 7 CO -0.00 -0.10 0.00 -0.40 -1.32 0.00 0.00 175.29 173.47 1lud n ASP 8 N 0.64 0.00 -0.34 12.60 5.75 -1.20 -1.65 116.55 132.34 1lud n ASP 8 Ca -0.18 -0.90 -0.03 0.00 -0.01 0.00 0.00 54.79 53.67 1lud n ASP 8 Cb 0.59 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.77 1lud n ASP 8 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1lud h ARG 9 N 0.00 1.20 -0.17 0.11 -0.00 -1.58 -2.28 114.38 111.66 1lud h ARG 9 Ca 0.00 -0.07 -0.14 0.00 -0.00 0.00 0.00 59.98 59.76 1lud h ARG 9 Cb 0.00 -0.27 -0.01 0.00 -0.00 0.00 0.00 29.97 29.69 1lud h ARG 9 CO 0.00 0.80 -0.50 -0.44 -0.00 0.00 0.00 179.97 179.83 1lud h ASP 10 N 1.24 0.50 0.00 0.08 3.32 -1.91 -3.47 116.42 116.18 1lud h ASP 10 Ca 0.33 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1lud h ASP 10 Cb -0.14 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.26 1lud h ASP 10 CO -0.07 0.91 0.00 0.61 -1.72 0.00 0.00 179.24 178.97 1lud n GLY 11 N 0.11 1.28 3.91 2.75 0.00 -0.86 -5.07 105.19 107.31 1lud n GLY 11 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 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 4.04 0.21 0.99 2.96 -1.26 -3.27 118.68 122.34 1lud s LEU 12 Ca 0.00 0.66 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1lud s LEU 12 Cb 0.00 -3.49 0.00 0.00 0.50 0.00 0.00 46.19 43.20 1lud s LEU 12 CO 0.00 -0.22 0.00 2.30 -1.32 0.00 0.00 176.35 177.11 1lud n ILE 13 N -1.13 0.28 -3.21 6.68 -5.35 -0.97 -3.28 119.36 112.39 1lud n ILE 13 Ca -0.02 0.09 -0.37 0.00 -0.27 0.00 0.00 62.75 62.18 1lud n ILE 13 Cb 0.54 -0.71 -0.06 0.00 -1.74 0.00 0.00 39.64 37.67 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 -4.57 2.62 -0.38 3.28 0.00 -1.14 -4.41 107.32 102.73 1lud s GLY 14 Ca 0.00 0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.80 1lud s GLY 14 CO 0.00 0.44 0.25 1.25 0.00 0.00 0.00 173.10 175.05 1lud s LYS 15 N -1.63 0.74 -1.15 2.90 2.20 -1.20 -3.96 119.74 117.64 1lud s LYS 15 Ca 0.37 -1.64 -0.13 0.00 -0.36 0.00 0.00 55.97 54.21 1lud s LYS 15 Cb -0.18 -1.46 -0.02 0.00 -1.51 0.00 0.00 37.83 34.66 1lud s LYS 15 CO 0.20 -1.26 0.80 -0.25 -0.36 0.00 0.00 175.35 174.49 1lud n ASP 16 N 3.63 -4.80 0.00 1.43 9.92 -1.26 -3.54 116.55 121.93 1lud n ASP 16 Ca 0.17 -0.91 0.00 0.00 -0.53 0.00 0.00 54.79 53.52 1lud n ASP 16 Cb 0.40 -3.95 0.00 0.00 -0.64 0.00 0.00 41.12 36.93 1lud n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1lud n GLY 17 N -1.56 2.16 3.80 0.44 0.00 -1.26 -4.91 105.19 103.85 1lud n GLY 17 Ca -0.13 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 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 2.97 0.95 1.61 -3.43 -1.23 -5.00 115.29 111.16 1lud s HIS 18 Ca 0.00 1.56 -0.12 0.00 -0.80 0.00 0.00 55.06 55.70 1lud s HIS 18 Cb 0.00 -3.07 0.09 0.00 -1.43 0.00 0.00 32.58 28.16 1lud s HIS 18 CO 0.00 -0.94 0.69 1.28 -2.00 0.00 0.00 174.74 173.77 1lud n LEU 19 N -1.19 1.05 0.08 5.38 4.77 -1.26 -3.26 117.00 122.57 1lud n LEU 19 Ca 0.09 0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 56.33 1lud n LEU 19 Cb 0.52 -1.31 -0.09 0.00 -2.33 0.00 0.00 43.42 40.22 1lud n LEU 19 CO 0.41 -3.06 0.14 1.55 -1.33 0.00 0.00 177.39 175.10 1lud h PRO 20 N -1.73 0.08 -6.12 3.23 0.14 -1.82 -3.45 132.00 122.33 1lud h PRO 20 Ca -0.44 -0.12 -0.61 0.00 0.14 0.00 0.00 66.00 64.97 1lud h PRO 20 Cb 1.28 0.04 -0.28 0.00 0.14 0.00 0.00 31.00 32.18 1lud h PRO 20 CO 0.37 1.01 -0.86 1.67 0.14 0.00 0.00 178.00 180.34 1lud s TRP 21 N -2.82 1.90 -0.60 1.56 -2.14 -1.26 -5.05 118.94 110.53 1lud s TRP 21 Ca -0.01 -0.37 -0.19 0.00 2.66 0.00 0.00 56.10 58.20 1lud s TRP 21 Cb 0.10 -1.19 0.10 0.00 -3.10 0.00 0.00 33.47 29.38 1lud s TRP 21 CO 0.83 0.01 0.71 -1.58 -2.66 0.00 0.00 176.95 174.26 1lud s HIS 22 N -0.60 2.99 -0.29 1.66 2.46 -1.26 -5.00 115.29 115.26 1lud s HIS 22 Ca 0.08 -0.96 0.02 0.00 0.47 0.00 0.00 55.06 54.67 1lud s HIS 22 Cb -0.08 -4.02 0.08 0.00 -0.13 0.00 0.00 32.58 28.42 1lud s HIS 22 CO 0.00 -1.30 -0.01 -1.17 -2.47 0.00 0.00 174.74 169.79 1lud s LEU 23 N 2.70 3.61 0.14 8.88 2.96 -1.26 -4.98 118.68 130.72 1lud s LEU 23 Ca 0.12 -1.66 -0.13 0.00 -0.22 0.00 0.00 54.13 52.24 1lud s LEU 23 Cb -0.24 -1.41 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 1lud s LEU 23 CO 0.06 -0.30 1.53 1.55 -1.32 0.00 0.00 176.35 177.87 1lud h PRO 24 N 7.79 0.85 0.00 0.98 0.14 -1.97 -2.73 132.00 137.06 1lud h PRO 24 Ca -0.12 -0.35 -0.01 0.00 0.14 0.00 0.00 66.00 65.66 1lud h PRO 24 Cb 1.04 -0.04 -0.00 0.00 0.14 0.00 0.00 31.00 32.14 1lud h PRO 24 CO 0.47 0.98 -0.03 0.22 0.14 0.00 0.00 178.00 179.78 1lud h ASP 25 N 0.68 0.00 0.36 1.44 3.58 -1.95 -1.73 116.42 118.79 1lud h ASP 25 Ca 0.10 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.25 1lud h ASP 25 Cb 0.69 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.77 1lud h ASP 25 CO 0.05 0.03 -1.32 -0.78 -2.88 0.00 0.00 179.24 174.34 1lud h ASP 26 N 0.00 0.70 -0.64 2.28 3.58 -1.89 -3.00 116.42 117.45 1lud h ASP 26 Ca -0.00 -0.71 0.03 0.00 0.42 0.00 0.00 57.03 56.77 1lud h ASP 26 Cb 0.09 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 1lud h ASP 26 CO 0.00 1.54 0.39 -0.07 -2.88 0.00 0.00 179.24 178.23 1lud h LEU 27 N 0.16 0.63 -0.86 2.28 3.38 -1.15 0.76 115.31 120.51 1lud h LEU 27 Ca -0.19 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1lud h LEU 27 Cb 2.02 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 42.60 1lud h LEU 27 CO 0.24 0.44 0.47 0.45 0.09 0.00 0.00 178.44 180.12 1lud h HIS 28 N 0.76 1.18 -0.58 1.13 3.86 -1.54 0.34 115.15 120.31 1lud h HIS 28 Ca 0.26 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.39 1lud h HIS 28 Cb 0.04 -0.38 -0.03 0.00 1.06 0.00 0.00 27.41 28.11 1lud h HIS 28 CO -0.05 0.82 0.14 -0.92 0.86 0.00 0.00 177.93 178.78 1lud h TYR 29 N 1.20 0.93 -0.12 2.45 3.20 -1.12 0.38 116.97 123.90 1lud h TYR 29 Ca 0.30 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1lud h TYR 29 Cb 0.04 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.03 1lud h TYR 29 CO 0.01 0.78 -0.03 0.35 -1.64 0.00 0.00 178.16 177.63 1lud h PHE 30 N 0.86 0.25 0.60 -3.82 3.57 0.04 -1.52 116.94 116.93 1lud h PHE 30 Ca 0.19 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1lud h PHE 30 Cb 0.32 -0.06 0.01 0.00 2.79 0.00 0.00 35.95 39.00 1lud h PHE 30 CO 0.02 0.52 -0.29 -0.09 -2.23 0.00 0.00 178.31 176.24 1lud h ARG 31 N -0.09 -0.78 -1.01 1.11 2.43 -0.75 -2.29 114.38 113.00 1lud h ARG 31 Ca 0.03 0.05 0.26 0.00 -0.81 0.00 0.00 59.98 59.51 1lud h ARG 31 Cb 0.44 0.18 -0.13 0.00 -0.42 0.00 0.00 29.97 30.04 1lud h ARG 31 CO 0.01 -0.52 0.60 0.00 -1.51 0.00 0.00 179.97 178.55 1lud h ALA 32 N -1.46 1.86 0.00 2.80 0.00 -1.02 0.82 119.26 122.27 1lud h ALA 32 Ca -0.08 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1lud h ALA 32 Cb 0.62 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1lud h ALA 32 CO 0.14 -0.36 0.00 1.96 0.00 0.00 0.00 179.25 180.99 1lud h GLN 33 N 0.52 0.00 0.00 0.00 1.08 -1.18 -3.14 115.11 112.38 1lud h GLN 33 Ca 0.66 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.85 1lud h GLN 33 Cb 1.34 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.74 1lud h GLN 33 CO -0.48 0.00 -0.52 0.25 -0.95 0.00 0.00 178.83 177.13 1lud n THR 34 N -2.41 2.01 -2.86 -0.54 -2.24 0.28 -4.93 114.28 103.59 1lud n THR 34 Ca 0.03 -3.01 -0.42 0.00 -2.27 0.00 0.00 64.05 58.38 1lud n THR 34 Cb 0.30 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.95 4.85 -0.12 2.28 -7.23 -0.57 -3.38 120.40 113.27 1lud s VAL 35 Ca 0.37 1.68 0.00 0.00 -1.81 0.00 0.00 61.98 62.22 1lud s VAL 35 Cb 0.37 -4.16 0.00 0.00 0.56 0.00 0.00 36.38 33.15 1lud s VAL 35 CO -0.07 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.31 1lud n GLY 36 N 3.49 0.46 3.58 2.32 0.00 -1.26 -5.01 105.19 108.77 1lud n GLY 36 Ca 0.06 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.94 1.95 -0.19 1.61 3.01 -1.22 -4.62 119.74 119.35 1lud s LYS 37 Ca 0.00 -1.77 -0.29 0.00 -1.01 0.00 0.00 55.97 52.90 1lud s LYS 37 Cb 0.00 -1.86 0.00 0.00 -1.01 0.00 0.00 37.83 34.96 1lud s LYS 37 CO 0.00 0.20 1.02 0.42 0.51 0.00 0.00 175.35 177.50 1lud s ILE 38 N -2.52 4.72 -0.38 2.17 1.01 -1.07 -3.48 121.20 121.65 1lud s ILE 38 Ca 0.33 2.02 -0.12 0.00 0.00 0.00 0.00 60.65 62.87 1lud s ILE 38 Cb -0.01 -4.30 0.02 0.00 0.01 0.00 0.00 42.46 38.18 1lud s ILE 38 CO 0.18 -0.11 0.23 -0.32 0.00 0.00 0.00 174.94 174.92 1lud s MET 39 N 2.76 2.91 -0.32 2.79 1.75 0.11 0.28 119.30 129.58 1lud s MET 39 Ca 0.45 -1.03 -0.20 0.00 -1.25 0.00 0.00 55.69 53.66 1lud s MET 39 Cb -0.16 -3.80 -0.01 0.00 2.84 0.00 0.00 34.83 33.70 1lud s MET 39 CO 0.10 -0.69 0.62 0.08 -0.65 0.00 0.00 175.02 174.48 1lud s VAL 40 N 1.60 4.93 0.52 10.11 1.01 0.24 0.99 120.40 139.80 1lud s VAL 40 Ca 0.03 0.73 0.01 0.00 0.00 0.00 0.00 61.98 62.75 1lud s VAL 40 Cb -0.19 -4.02 -0.00 0.00 0.00 0.00 0.00 36.38 32.17 1lud s VAL 40 CO 0.08 -0.20 0.03 0.68 0.00 0.00 0.00 175.10 175.69 1lud s VAL 41 N 2.62 1.13 0.01 2.92 -7.23 -0.10 0.44 120.40 120.19 1lud s VAL 41 Ca 0.24 -1.97 0.05 0.00 -1.81 0.00 0.00 61.98 58.50 1lud s VAL 41 Cb -0.15 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 1lud s VAL 41 CO 0.13 0.00 -0.12 -0.83 -0.31 0.00 0.00 175.10 173.97 1lud s GLY 42 N -3.92 1.66 0.61 2.32 0.00 0.93 -1.44 107.32 107.47 1lud s GLY 42 Ca 0.05 -1.08 0.27 0.00 0.00 0.00 0.00 44.72 43.96 1lud s GLY 42 CO 0.03 -0.95 1.55 -0.09 0.00 0.00 0.00 173.10 173.64 1lud h ARG 43 N 4.62 0.00 0.05 2.90 1.12 -0.62 0.52 114.38 122.96 1lud h ARG 43 Ca -0.48 0.00 -0.20 0.00 -1.11 0.00 0.00 59.98 58.19 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 0.51 0.00 -0.81 0.00 -3.11 0.00 0.00 179.97 176.56 1lud h ARG 44 N 0.00 0.46 0.02 0.20 2.47 -1.94 -2.71 114.38 112.90 1lud h ARG 44 Ca 0.34 -0.57 -0.00 0.00 -1.26 0.00 0.00 59.98 58.49 1lud h ARG 44 Cb 2.10 0.18 0.00 0.00 -1.65 0.00 0.00 29.97 30.60 1lud h ARG 44 CO -0.00 1.21 -0.01 1.15 0.56 0.00 0.00 179.97 182.87 1lud h THR 45 N -0.03 1.35 -0.95 2.04 2.02 -0.36 -2.24 112.91 114.74 1lud h THR 45 Ca -0.12 -1.19 0.12 0.00 0.77 0.00 0.00 66.41 66.00 1lud h THR 45 Cb 1.53 2.14 -0.09 0.00 -1.74 0.00 0.00 68.15 70.00 1lud h THR 45 CO 0.16 0.30 0.58 0.22 0.37 0.00 0.00 175.52 177.15 1lud h TYR 46 N -0.55 1.05 0.00 3.16 3.20 -1.31 0.98 116.97 123.49 1lud h TYR 46 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1lud h TYR 46 Cb 0.52 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1lud h TYR 46 CO 0.10 0.38 0.00 0.93 -1.64 0.00 0.00 178.16 177.94 1lud h GLU 47 N 0.90 0.00 0.00 1.82 5.08 -1.44 -2.45 114.58 118.49 1lud h GLU 47 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1lud h GLU 47 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1lud h GLU 47 CO -0.28 0.00 -1.45 0.45 -1.00 0.00 0.00 179.01 176.72 1lud n SER 48 N -3.03 0.43 -4.25 1.42 2.88 0.19 -4.98 113.62 106.28 1lud n SER 48 Ca 0.01 -0.20 -0.36 0.00 -1.33 0.00 0.00 58.87 56.98 1lud n SER 48 Cb 0.29 1.33 0.05 0.00 -0.75 0.00 0.00 64.21 65.14 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 -2.09 -2.85 -0.03 0.66 3.01 0.28 -4.96 117.46 111.49 1lud n PHE 49 Ca -0.01 0.24 -0.01 0.00 1.01 0.00 0.00 57.45 58.68 1lud n PHE 49 Cb 0.49 -1.69 -0.00 0.00 -0.01 0.00 0.00 39.48 38.27 1lud n PHE 49 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1lud h PRO 50 N -0.62 0.00 -4.11 -1.08 0.13 -1.90 -3.46 132.00 120.97 1lud h PRO 50 Ca -0.44 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.08 1lud h PRO 50 Cb 1.35 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.08 1lud h PRO 50 CO 0.35 0.00 -0.75 0.15 -0.23 0.00 0.00 178.00 177.52 1lud s LYS 51 N -1.52 1.15 0.03 0.86 -0.14 -1.26 -5.11 119.74 113.76 1lud s LYS 51 Ca -0.05 -1.32 0.08 0.00 -1.36 0.00 0.00 55.97 53.32 1lud s LYS 51 Cb 0.01 -2.53 -0.03 0.00 -1.68 0.00 0.00 37.83 33.60 1lud s LYS 51 CO 0.07 -0.89 -0.24 -0.98 -0.76 0.00 0.00 175.35 172.55 1lud s ARG 52 N 1.33 1.94 0.77 1.68 1.70 -1.26 -4.25 118.95 120.85 1lud s ARG 52 Ca 0.07 -1.04 -0.07 0.00 -0.47 0.00 0.00 55.73 54.22 1lud s ARG 52 Cb -0.18 -2.06 0.12 0.00 -0.57 0.00 0.00 34.95 32.26 1lud s ARG 52 CO -0.15 0.53 1.08 -1.25 -1.08 0.00 0.00 175.30 174.43 1lud s PRO 53 N -1.21 1.64 0.63 3.89 0.04 -1.26 -5.13 135.00 133.60 1lud s PRO 53 Ca 0.12 -0.57 -0.12 0.00 0.04 0.00 0.00 61.00 60.47 1lud s PRO 53 Cb -0.10 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 1lud s PRO 53 CO 0.03 -1.60 1.04 -0.51 0.04 0.00 0.00 177.00 175.99 1lud s LEU 54 N -5.37 3.25 -0.44 -3.56 1.43 -1.26 -4.95 118.68 107.78 1lud s LEU 54 Ca 0.66 1.50 -0.27 0.00 -1.03 0.00 0.00 54.13 54.99 1lud s LEU 54 Cb -0.07 -4.48 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 1lud s LEU 54 CO 0.47 -1.01 2.19 -2.84 0.23 0.00 0.00 176.35 175.39 1lud s PRO 55 N -5.00 2.54 -1.17 1.29 0.02 -1.26 -3.29 135.00 128.14 1lud s PRO 55 Ca 0.57 1.37 -0.05 0.00 0.02 0.00 0.00 61.00 62.90 1lud s PRO 55 Cb -0.12 -4.46 -0.03 0.00 0.02 0.00 0.00 34.50 29.91 1lud s PRO 55 CO 0.51 -2.78 0.86 0.39 -0.33 0.00 0.00 177.00 175.65 1lud n GLU 56 N 8.93 -3.82 -4.17 5.54 1.02 -1.26 -4.99 120.64 121.89 1lud n GLU 56 Ca 0.30 0.73 -0.16 0.00 -0.02 0.00 0.00 57.16 58.02 1lud n GLU 56 Cb 0.51 -5.40 -0.14 0.00 -0.02 0.00 0.00 31.44 26.39 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 -5.28 0.46 -0.36 3.49 3.00 -1.21 -4.21 118.95 114.84 1lud s ARG 57 Ca 0.23 -0.25 -0.23 0.00 0.00 0.00 0.00 55.73 55.48 1lud s ARG 57 Cb -0.05 -0.42 0.01 0.00 0.00 0.00 0.00 34.95 34.49 1lud s ARG 57 CO 0.78 0.11 0.76 0.99 0.00 0.00 0.00 175.30 177.93 1lud s THR 58 N -0.25 4.77 -0.01 0.02 2.01 -1.23 -4.71 115.64 116.23 1lud s THR 58 Ca 0.01 0.85 0.07 0.00 0.31 0.00 0.00 61.69 62.92 1lud s THR 58 Cb -0.03 -4.18 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 1lud s THR 58 CO -0.00 -0.40 -0.21 0.20 -0.69 0.00 0.00 174.62 173.52 1lud s ASN 59 N 1.82 2.52 -0.06 3.53 0.01 -1.26 0.05 114.94 121.54 1lud s ASN 59 Ca 0.30 -0.39 0.05 0.00 -0.71 0.00 0.00 52.86 52.11 1lud s ASN 59 Cb -0.13 -0.28 -0.00 0.00 0.41 0.00 0.00 41.25 41.24 1lud s ASN 59 CO 0.16 0.26 -0.22 -0.69 -1.51 0.00 0.00 177.10 175.10 1lud s VAL 60 N -0.51 1.85 0.05 1.60 1.01 0.28 -1.21 120.40 123.46 1lud s VAL 60 Ca 0.08 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1lud s VAL 60 Cb -0.08 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 1lud s VAL 60 CO -0.01 0.52 0.25 -0.69 0.00 0.00 0.00 175.10 175.17 1lud s VAL 61 N 0.05 5.33 -0.21 2.92 1.01 -0.93 -0.92 120.40 127.66 1lud s VAL 61 Ca -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 1lud s VAL 61 Cb -0.14 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1lud s VAL 61 CO 0.05 0.23 -0.10 -0.76 0.00 0.00 0.00 175.10 174.51 1lud s LEU 62 N -2.19 2.63 0.09 3.92 1.02 -0.52 -2.46 118.68 121.17 1lud s LEU 62 Ca 0.32 -0.52 -0.09 0.00 0.02 0.00 0.00 54.13 53.86 1lud s LEU 62 Cb -0.13 -1.64 -0.00 0.00 0.02 0.00 0.00 46.19 44.44 1lud s LEU 62 CO 0.22 -0.02 0.20 0.28 0.02 0.00 0.00 176.35 177.04 1lud s THR 63 N 1.40 0.14 -2.38 5.49 -1.32 -1.13 0.18 115.64 118.02 1lud s THR 63 Ca 0.05 -1.14 0.21 0.00 -1.21 0.00 0.00 61.69 59.60 1lud s THR 63 Cb -0.14 -1.31 0.30 0.00 -1.51 0.00 0.00 72.50 69.84 1lud s THR 63 CO -0.07 -0.63 1.27 1.41 -2.21 0.00 0.00 174.62 174.39 1lud n HIS 64 N -0.03 0.28 -1.51 9.09 8.25 -1.26 -4.33 115.22 125.70 1lud n HIS 64 Ca -0.15 -0.16 -0.29 0.00 -0.26 0.00 0.00 57.72 56.86 1lud n HIS 64 Cb 0.62 -0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.91 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 -1.53 0.24 -0.05 -0.41 1.11 -1.26 -5.01 119.66 112.75 1lud s GLN 65 Ca 0.31 -0.04 0.05 0.00 0.01 0.00 0.00 55.36 55.69 1lud s GLN 65 Cb 0.19 -1.76 -0.07 0.00 -1.01 0.00 0.00 33.01 30.36 1lud s GLN 65 CO 0.28 -2.74 0.03 -0.85 0.01 0.00 0.00 175.29 172.01 1lud n GLU 66 N -4.08 2.76 -1.35 2.91 0.00 -1.26 -4.64 120.64 114.98 1lud n GLU 66 Ca 0.11 -0.01 -0.25 0.00 0.00 0.00 0.00 57.16 57.02 1lud n GLU 66 Cb 0.59 -1.13 0.11 0.00 0.00 0.00 0.00 31.44 31.01 1lud n GLU 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1lud n ASP 67 N -2.13 5.36 -4.61 -1.84 8.00 -1.26 -4.98 116.55 115.09 1lud n ASP 67 Ca -0.08 -3.75 -0.43 0.00 0.71 0.00 0.00 54.79 51.25 1lud n ASP 67 Cb 0.60 -0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 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 -3.57 1.30 -0.50 1.24 5.04 -1.26 -4.92 117.35 114.68 1lud s TYR 68 Ca 0.57 0.49 -0.16 0.00 -2.44 0.00 0.00 57.07 55.53 1lud s TYR 68 Cb 0.46 -3.98 0.09 0.00 0.35 0.00 0.00 41.96 38.88 1lud s TYR 68 CO 0.02 -3.97 0.44 -0.65 -1.34 0.00 0.00 175.55 170.06 1lud s GLN 69 N 6.07 2.99 -0.49 4.97 -1.52 -1.26 -4.98 119.66 125.44 1lud s GLN 69 Ca 0.96 -1.44 0.03 0.00 -1.95 0.00 0.00 55.36 52.96 1lud s GLN 69 Cb -0.32 -4.18 0.15 0.00 -0.22 0.00 0.00 33.01 28.44 1lud s GLN 69 CO 0.35 -1.14 0.31 0.00 -0.25 0.00 0.00 175.29 174.57 1lud s ALA 70 N 1.70 2.33 -0.13 6.09 0.00 -1.26 -5.09 121.76 125.40 1lud s ALA 70 Ca 0.04 -2.82 -0.29 0.00 0.00 0.00 0.00 51.96 48.89 1lud s ALA 70 Cb -0.26 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 1lud s ALA 70 CO 0.06 -2.05 1.29 -0.65 0.00 0.00 0.00 175.76 174.41 1lud s GLN 71 N -0.08 4.25 0.00 0.00 -0.21 -1.26 -2.95 119.66 119.41 1lud s GLN 71 Ca 0.22 1.73 0.00 0.00 0.02 0.00 0.00 55.36 57.33 1lud s GLN 71 Cb -0.14 -3.74 0.00 0.00 1.00 0.00 0.00 33.01 30.13 1lud s GLN 71 CO -0.07 -0.67 0.00 0.41 -2.12 0.00 0.00 175.29 172.84 1lud n GLY 72 N 3.62 1.97 3.52 3.09 0.00 -1.26 -4.97 105.19 111.15 1lud n GLY 72 Ca 0.14 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.66 2.78 0.94 4.61 0.00 -1.15 -4.88 121.76 122.40 1lud s ALA 73 Ca 0.00 -1.04 -0.10 0.00 0.00 0.00 0.00 51.96 50.82 1lud s ALA 73 Cb 0.00 -0.98 0.15 0.00 0.00 0.00 0.00 23.12 22.28 1lud s ALA 73 CO 0.00 0.58 1.09 0.28 0.00 0.00 0.00 175.76 177.71 1lud n VAL 74 N 1.88 0.00 -3.73 0.00 0.31 -0.35 -4.78 118.33 111.66 1lud n VAL 74 Ca -0.16 -0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 63.99 1lud n VAL 74 Cb 0.52 -0.97 -0.14 0.00 -0.91 0.00 0.00 33.84 32.34 1lud n VAL 74 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1lud s VAL 75 N -2.61 -0.10 0.13 2.52 1.01 -1.26 -2.18 120.40 117.91 1lud s VAL 75 Ca 0.66 0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.79 1lud s VAL 75 Cb -0.23 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.85 1lud s VAL 75 CO 0.59 0.09 0.20 0.68 0.00 0.00 0.00 175.10 176.65 1lud s VAL 76 N 1.42 0.10 -0.12 2.92 -7.23 -1.03 -4.95 120.40 111.52 1lud s VAL 76 Ca -0.07 -1.49 0.23 0.00 -1.81 0.00 0.00 61.98 58.84 1lud s VAL 76 Cb -0.11 -1.77 0.46 0.00 0.56 0.00 0.00 36.38 35.52 1lud s VAL 76 CO -0.06 -0.45 1.15 1.41 -0.31 0.00 0.00 175.10 176.84 1lud n HIS 77 N -0.14 0.56 -3.15 2.82 8.25 -1.26 -2.83 115.22 119.47 1lud n HIS 77 Ca -0.09 -1.21 0.04 0.00 -0.26 0.00 0.00 57.72 56.20 1lud n HIS 77 Cb 0.63 -0.19 -0.01 0.00 1.12 0.00 0.00 29.99 31.54 1lud n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1lud s ASP 78 N -2.78 -1.19 0.40 0.41 1.01 -1.26 -4.98 116.67 108.28 1lud s ASP 78 Ca 0.33 0.61 0.24 0.00 0.71 0.00 0.00 52.55 54.44 1lud s ASP 78 Cb 0.37 1.94 1.33 0.00 1.01 0.00 0.00 42.92 47.56 1lud s ASP 78 CO -0.11 -0.22 1.63 0.58 0.21 0.00 0.00 175.17 177.26 1lud h VAL 79 N 5.79 0.14 -0.70 -1.27 2.07 -1.97 0.84 116.25 121.15 1lud h VAL 79 Ca -0.17 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.33 1lud h VAL 79 Cb 1.17 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1lud h VAL 79 CO 0.15 0.02 0.46 0.00 0.02 0.00 0.00 177.57 178.22 1lud h ALA 80 N 1.74 1.56 -0.24 1.67 0.00 -1.99 -2.42 119.26 119.59 1lud h ALA 80 Ca 0.80 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.63 1lud h ALA 80 Cb 2.28 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.80 1lud h ALA 80 CO -0.53 0.39 -0.01 0.00 0.00 0.00 0.00 179.25 179.09 1lud h ALA 81 N 1.58 0.33 -0.91 0.00 0.00 0.30 -2.93 119.26 117.63 1lud h ALA 81 Ca 0.27 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1lud h ALA 81 Cb -0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1lud h ALA 81 CO -0.07 0.07 0.59 0.28 0.00 0.00 0.00 179.25 180.13 1lud h VAL 82 N 0.20 1.00 -0.85 0.00 2.07 -1.32 -1.58 116.25 115.77 1lud h VAL 82 Ca 0.07 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1lud h VAL 82 Cb 0.44 -0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1lud h VAL 82 CO 0.01 0.18 0.42 -0.26 0.02 0.00 0.00 177.57 177.94 1lud h PHE 83 N 0.96 1.21 0.31 1.57 0.04 -1.30 -3.00 116.94 116.73 1lud h PHE 83 Ca 0.41 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 61.13 1lud h PHE 83 Cb 0.33 -0.38 -0.03 0.00 2.20 0.00 0.00 35.95 38.08 1lud h PHE 83 CO -0.00 0.87 -0.36 0.00 -0.60 0.00 0.00 178.31 178.22 1lud h ALA 84 N 1.23 -0.74 -0.58 2.45 0.00 -1.14 -2.32 119.26 118.15 1lud h ALA 84 Ca 0.29 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.20 1lud h ALA 84 Cb 0.10 0.53 -0.11 0.00 0.00 0.00 0.00 17.79 18.31 1lud h ALA 84 CO -0.04 -0.96 -0.33 -0.92 0.00 0.00 0.00 179.25 177.00 1lud h TYR 85 N -0.71 -0.91 -0.55 0.00 3.20 -1.43 -0.27 116.97 116.28 1lud h TYR 85 Ca -0.01 0.07 0.08 0.00 3.14 0.00 0.00 58.73 62.01 1lud h TYR 85 Cb 0.66 0.49 -0.07 0.00 1.54 0.00 0.00 36.73 39.35 1lud h TYR 85 CO -0.23 -0.38 0.20 0.00 -1.64 0.00 0.00 178.16 176.11 1lud h ALA 86 N 0.99 0.69 0.00 1.82 0.00 -1.41 0.14 119.26 121.49 1lud h ALA 86 Ca 0.23 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1lud h ALA 86 Cb 0.55 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1lud h ALA 86 CO -0.67 -0.21 -0.09 0.87 0.00 0.00 0.00 179.25 179.15 1lud h LYS 87 N 0.38 0.00 0.00 0.00 1.57 -0.56 -2.44 116.57 115.52 1lud h LYS 87 Ca 0.27 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.87 1lud h LYS 87 Cb 0.32 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1lud h LYS 87 CO -0.28 0.09 -1.13 1.96 -0.57 0.00 0.00 179.45 179.53 1lud h GLN 88 N 0.00 0.00 -5.51 3.15 4.20 0.76 -3.44 115.11 114.28 1lud h GLN 88 Ca -0.00 0.00 -0.62 0.00 0.06 0.00 0.00 58.65 58.09 1lud h GLN 88 Cb 0.27 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.92 1lud h GLN 88 CO 0.01 0.57 0.16 -1.01 -0.67 0.00 0.00 178.83 177.88 1lud s HIS 89 N -2.81 3.18 -2.12 2.96 3.76 -0.23 -4.90 115.29 115.13 1lud s HIS 89 Ca -0.00 0.48 0.23 0.00 -0.15 0.00 0.00 55.06 55.62 1lud s HIS 89 Cb 0.09 -3.07 1.18 0.00 1.11 0.00 0.00 32.58 31.88 1lud s HIS 89 CO 0.80 -0.55 1.78 -0.35 -0.85 0.00 0.00 174.74 175.57 1lud n PRO 90 N 5.97 1.25 0.00 8.40 -0.04 -1.26 -3.49 135.00 145.83 1lud n PRO 90 Ca -0.01 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 1lud n PRO 90 Cb 0.49 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 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 -0.46 0.00 -3.50 3.54 2.03 -1.26 -5.02 116.55 111.87 1lud n ASP 91 Ca 0.17 -1.00 -0.20 0.00 0.52 0.00 0.00 54.79 54.28 1lud n ASP 91 Cb 0.17 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.43 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 0.18 0.00 -0.67 0.74 -1.23 -4.84 119.66 113.85 1lud s GLN 92 Ca 0.00 0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.49 1lud s GLN 92 Cb 0.00 -1.25 0.00 0.00 1.10 0.00 0.00 33.01 32.86 1lud s GLN 92 CO 0.00 -0.72 0.00 0.39 -0.55 0.00 0.00 175.29 174.41 1lud n GLU 93 N 5.31 1.50 -3.62 1.67 -0.58 -1.26 -4.43 120.64 119.23 1lud n GLU 93 Ca -0.05 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.29 1lud n GLU 93 Cb 0.49 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.24 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 4.28 -0.19 -4.62 2.96 -1.26 -2.60 118.68 117.26 1lud s LEU 94 Ca 0.00 -0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 53.34 1lud s LEU 94 Cb 0.00 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.64 1lud s LEU 94 CO 0.00 -0.23 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.02 1lud s VAL 95 N 1.64 3.07 0.27 1.68 1.01 0.14 0.70 120.40 128.91 1lud s VAL 95 Ca 0.05 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.20 1lud s VAL 95 Cb -0.17 -2.35 -0.09 0.00 0.00 0.00 0.00 36.38 33.77 1lud s VAL 95 CO 0.07 0.47 0.81 -0.63 0.00 0.00 0.00 175.10 175.82 1lud s ILE 96 N 1.12 4.44 0.00 2.22 -1.09 0.20 0.80 121.20 128.90 1lud s ILE 96 Ca 0.01 1.48 0.00 0.00 -2.23 0.00 0.00 60.65 59.91 1lud s ILE 96 Cb -0.14 -3.90 0.00 0.00 -1.58 0.00 0.00 42.46 36.83 1lud s ILE 96 CO -0.02 0.16 0.20 0.00 -1.23 0.00 0.00 174.94 174.05 1lud n ALA 97 N 0.61 1.60 0.00 9.38 0.00 0.17 -2.09 120.51 130.19 1lud n ALA 97 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1lud n ALA 97 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.31 -1.83 0.00 0.00 0.00 -1.18 -4.91 105.19 97.58 1lud n GLY 98 Ca 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.00 0.33 -0.02 0.00 -1.26 -0.05 105.19 103.19 1lud n GLY 99 Ca 0.00 -1.15 -0.05 0.00 0.00 0.00 0.00 46.02 44.82 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 1.02 -0.84 4.61 0.00 -1.93 -2.47 119.26 117.65 1lud h ALA 100 Ca 0.00 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.85 1lud h ALA 100 Cb 0.00 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.42 1lud h ALA 100 CO 0.00 0.56 0.55 0.37 0.00 0.00 0.00 179.25 180.73 1lud h GLN 101 N 1.12 0.86 0.00 0.00 4.15 -1.95 -1.19 115.11 118.09 1lud h GLN 101 Ca 0.28 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.57 1lud h GLN 101 Cb 0.08 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1lud h GLN 101 CO -0.04 0.57 -0.35 0.82 -1.93 0.00 0.00 178.83 177.90 1lud h ILE 102 N 0.89 0.68 0.00 2.39 1.08 -1.69 -3.10 117.51 117.75 1lud h ILE 102 Ca 0.37 -1.70 -0.09 0.00 -0.39 0.00 0.00 64.86 63.06 1lud h ILE 102 Cb 0.30 2.14 -0.01 0.00 -3.07 0.00 0.00 36.82 36.18 1lud h ILE 102 CO -0.14 0.35 -0.42 -0.26 -0.69 0.00 0.00 178.15 176.99 1lud h PHE 103 N 0.00 0.00 0.00 1.37 0.04 -0.95 -2.97 116.94 114.44 1lud h PHE 103 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 1lud h PHE 103 Cb 1.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.26 1lud h PHE 103 CO 0.00 0.42 -0.00 1.15 -0.60 0.00 0.00 178.31 179.28 1lud h THR 104 N 0.00 1.69 -0.12 -1.55 2.02 -1.39 -1.52 112.91 112.04 1lud h THR 104 Ca -0.00 -2.15 -0.01 0.00 0.77 0.00 0.00 66.41 65.02 1lud h THR 104 Cb 1.16 3.13 -0.01 0.00 -1.74 0.00 0.00 68.15 70.70 1lud h THR 104 CO 0.05 0.55 0.02 0.00 0.37 0.00 0.00 175.52 176.51 1lud h ALA 105 N 0.04 1.82 -0.01 6.16 0.00 -1.63 -1.57 119.26 124.07 1lud h ALA 105 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1lud h ALA 105 Cb 0.90 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1lud h ALA 105 CO 0.00 0.15 -0.47 1.19 0.00 0.00 0.00 179.25 180.11 1lud n PHE 106 N -4.46 0.00 -0.33 0.00 3.01 -1.12 -4.36 117.46 110.20 1lud n PHE 106 Ca -0.01 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.60 1lud n PHE 106 Cb 0.13 -0.12 0.34 0.00 -0.01 0.00 0.00 39.48 39.82 1lud n PHE 106 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1lud h LYS 107 N 0.86 0.53 -0.45 -1.08 2.10 -0.21 -0.68 116.57 117.63 1lud h LYS 107 Ca 0.00 -0.03 -0.10 0.00 -2.00 0.00 0.00 60.65 58.52 1lud h LYS 107 Cb 0.54 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.74 1lud h LYS 107 CO 0.00 0.35 -0.12 0.22 -2.00 0.00 0.00 179.45 177.90 1lud h ASP 108 N 0.55 0.83 -3.67 7.07 3.58 -1.76 -3.36 116.42 119.66 1lud h ASP 108 Ca 0.60 -0.26 -0.78 0.00 0.42 0.00 0.00 57.03 57.01 1lud h ASP 108 Cb 1.10 -0.22 -0.25 0.00 1.72 0.00 0.00 39.33 41.68 1lud h ASP 108 CO -0.47 0.96 0.20 -1.81 -2.88 0.00 0.00 179.24 175.24 1lud s ASP 109 N -6.69 6.81 0.01 2.28 1.11 -0.26 -5.02 116.67 114.91 1lud s ASP 109 Ca -0.10 -2.73 0.07 0.00 0.18 0.00 0.00 52.55 49.97 1lud s ASP 109 Cb 0.14 -2.23 -0.02 0.00 1.07 0.00 0.00 42.92 41.88 1lud s ASP 109 CO 0.83 -0.59 -0.21 -0.69 1.18 0.00 0.00 175.17 175.70 1lud s VAL 110 N 0.24 1.67 0.00 -1.27 1.01 -1.26 -4.71 120.40 116.08 1lud s VAL 110 Ca 0.21 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1lud s VAL 110 Cb -0.10 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.87 1lud s VAL 110 CO -0.09 0.34 0.00 0.47 0.00 0.00 0.00 175.10 175.82 1lud n ASP 111 N 2.20 2.02 -3.72 3.32 8.00 0.48 -4.79 116.55 124.06 1lud n ASP 111 Ca -0.16 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.19 1lud n ASP 111 Cb 0.53 0.15 -0.15 0.00 -0.02 0.00 0.00 41.12 41.63 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 -1.43 -0.12 -0.19 -3.53 2.01 -1.00 -2.37 115.64 109.01 1lud s THR 112 Ca 0.00 0.24 -0.07 0.00 0.31 0.00 0.00 61.69 62.17 1lud s THR 112 Cb 0.00 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 1lud s THR 112 CO 0.00 0.10 0.06 -0.76 -0.69 0.00 0.00 174.62 173.33 1lud s LEU 113 N 1.56 3.73 -0.31 4.42 1.43 -0.90 0.10 118.68 128.72 1lud s LEU 113 Ca -0.05 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1lud s LEU 113 Cb -0.12 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.24 1lud s LEU 113 CO -0.06 0.14 0.02 -0.76 0.23 0.00 0.00 176.35 175.92 1lud s LEU 114 N 0.55 3.90 -0.08 1.79 1.43 0.36 -0.29 118.68 126.34 1lud s LEU 114 Ca 0.03 -1.83 0.02 0.00 -1.03 0.00 0.00 54.13 51.32 1lud s LEU 114 Cb -0.13 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.62 1lud s LEU 114 CO 0.01 -0.34 -0.15 0.54 0.23 0.00 0.00 176.35 176.65 1lud s VAL 115 N 1.10 2.98 -0.37 -1.59 0.11 -0.72 -1.46 120.40 120.45 1lud s VAL 115 Ca 0.05 -0.73 -0.07 0.00 -2.93 0.00 0.00 61.98 58.31 1lud s VAL 115 Cb -0.19 -2.19 0.06 0.00 -1.53 0.00 0.00 36.38 32.53 1lud s VAL 115 CO -0.10 0.57 0.16 -0.89 -3.33 0.00 0.00 175.10 171.51 1lud s THR 116 N -0.30 3.83 -0.33 5.04 2.01 -0.92 -1.21 115.64 123.76 1lud s THR 116 Ca 0.02 -1.32 -0.16 0.00 0.31 0.00 0.00 61.69 60.54 1lud s THR 116 Cb -0.13 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 1lud s THR 116 CO 0.03 -0.33 0.43 -0.13 -0.69 0.00 0.00 174.62 173.93 1lud s ARG 117 N 1.38 3.67 0.53 4.92 0.52 -0.69 -0.04 118.95 129.24 1lud s ARG 117 Ca 0.01 -0.22 -0.10 0.00 -0.52 0.00 0.00 55.73 54.90 1lud s ARG 117 Cb -0.21 -3.78 -0.05 0.00 0.52 0.00 0.00 34.95 31.43 1lud s ARG 117 CO 0.02 -0.54 0.90 -0.51 0.02 0.00 0.00 175.30 175.19 1lud s LEU 118 N 2.19 3.51 0.14 2.53 1.02 -0.66 -1.50 118.68 125.92 1lud s LEU 118 Ca 0.15 1.23 0.09 0.00 0.02 0.00 0.00 54.13 55.62 1lud s LEU 118 Cb -0.16 -4.20 -0.16 0.00 0.02 0.00 0.00 46.19 41.68 1lud s LEU 118 CO 0.12 -0.66 1.28 0.00 0.02 0.00 0.00 176.35 177.11 1lud h ALA 119 N 0.27 0.43 -2.43 4.21 0.00 -0.88 -3.18 119.26 117.69 1lud h ALA 119 Ca -0.46 -0.86 -0.48 0.00 0.00 0.00 0.00 54.91 53.11 1lud h ALA 119 Cb 1.19 -0.11 0.12 0.00 0.00 0.00 0.00 17.79 18.99 1lud h ALA 119 CO 0.62 1.16 0.32 0.20 0.00 0.00 0.00 179.25 181.55 1lud s GLY 120 N -4.69 1.61 -0.17 0.00 0.00 -1.18 -4.77 107.32 98.12 1lud s GLY 120 Ca 0.01 -0.27 0.01 0.00 0.00 0.00 0.00 44.72 44.47 1lud s GLY 120 CO 0.81 0.19 -0.15 -1.35 0.00 0.00 0.00 173.10 172.59 1lud s SER 121 N -3.91 3.04 0.31 1.64 1.04 -1.26 -3.49 113.70 111.07 1lud s SER 121 Ca 0.62 -0.65 0.09 0.00 0.48 0.00 0.00 55.95 56.48 1lud s SER 121 Cb -0.15 -1.31 -0.04 0.00 0.10 0.00 0.00 66.02 64.62 1lud s SER 121 CO 0.54 -0.06 0.07 -0.36 0.98 0.00 0.00 173.24 174.41 1lud s PHE 122 N 1.39 2.69 0.35 5.02 0.40 -1.26 -5.06 117.98 121.52 1lud s PHE 122 Ca 0.03 -0.32 0.08 0.00 -0.60 0.00 0.00 56.93 56.12 1lud s PHE 122 Cb -0.14 -1.45 -0.05 0.00 0.51 0.00 0.00 43.02 41.89 1lud s PHE 122 CO -0.11 0.47 0.07 -1.21 0.70 0.00 0.00 175.22 175.14 1lud s GLU 123 N -3.76 2.16 0.00 0.44 8.01 -1.26 -4.83 118.70 119.46 1lud s GLU 123 Ca 0.35 -1.73 0.00 0.00 0.01 0.00 0.00 54.97 53.60 1lud s GLU 123 Cb -0.04 -1.98 0.00 0.00 -4.31 0.00 0.00 34.13 27.80 1lud s GLU 123 CO 0.21 0.08 0.00 0.41 0.01 0.00 0.00 175.26 175.97 1lud n GLY 124 N -1.05 -0.73 0.00 -1.39 0.00 -1.26 -4.93 105.19 95.84 1lud n GLY 124 Ca -0.03 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1lud n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1lud n ASP 125 N 0.00 0.00 -4.29 1.61 -0.08 -1.26 -5.05 116.55 107.48 1lud n ASP 125 Ca 0.00 -0.02 -0.34 0.00 -1.51 0.00 0.00 54.79 52.92 1lud n ASP 125 Cb 0.00 0.05 -0.15 0.00 2.34 0.00 0.00 41.12 43.36 1lud n ASP 125 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1lud s THR 126 N -0.05 2.93 0.28 5.18 2.01 -1.25 -5.08 115.64 119.65 1lud s THR 126 Ca 0.00 -0.67 0.03 0.00 0.31 0.00 0.00 61.69 61.35 1lud s THR 126 Cb 0.00 -2.27 -0.06 0.00 0.01 0.00 0.00 72.50 70.19 1lud s THR 126 CO 0.00 0.49 0.06 -0.54 -0.69 0.00 0.00 174.62 173.94 1lud s LYS 127 N 0.94 1.48 0.70 4.92 3.01 -1.26 -2.29 119.74 127.24 1lud s LYS 127 Ca -0.02 -1.80 -0.16 0.00 -1.01 0.00 0.00 55.97 52.98 1lud s LYS 127 Cb -0.15 -0.56 0.02 0.00 -1.01 0.00 0.00 37.83 36.13 1lud s LYS 127 CO -0.01 -0.21 1.21 1.41 0.51 0.00 0.00 175.35 178.25 1lud s MET 128 N -3.95 2.34 0.90 1.68 1.75 -1.20 -4.87 119.30 115.96 1lud s MET 128 Ca 0.35 1.76 -0.12 0.00 -1.25 0.00 0.00 55.69 56.44 1lud s MET 128 Cb 0.08 -1.86 0.13 0.00 2.84 0.00 0.00 34.83 36.02 1lud s MET 128 CO 0.13 -1.68 1.11 0.96 -0.65 0.00 0.00 175.02 174.89 1lud s ILE 129 N -1.91 2.36 -0.62 10.11 -4.36 -1.26 -4.93 121.20 120.59 1lud s ILE 129 Ca 0.75 0.12 -0.27 0.00 -0.26 0.00 0.00 60.65 60.99 1lud s ILE 129 Cb -0.29 -2.77 -0.00 0.00 1.25 0.00 0.00 42.46 40.64 1lud s ILE 129 CO 0.43 -0.15 1.66 -2.16 0.24 0.00 0.00 174.94 174.96 1lud s PRO 130 N -5.13 2.88 0.32 0.37 0.05 -1.26 -5.01 135.00 127.23 1lud s PRO 130 Ca 0.63 0.43 -0.07 0.00 0.05 0.00 0.00 61.00 62.04 1lud s PRO 130 Cb -0.16 -4.29 -0.06 0.00 0.05 0.00 0.00 34.50 30.04 1lud s PRO 130 CO 0.55 -2.45 0.62 -0.51 0.05 0.00 0.00 177.00 175.27 1lud s LEU 131 N 7.79 4.00 -1.23 -3.56 1.43 -1.26 -4.99 118.68 120.85 1lud s LEU 131 Ca 0.58 0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 54.47 1lud s LEU 131 Cb -0.12 -3.70 0.20 0.00 0.03 0.00 0.00 46.19 42.60 1lud s LEU 131 CO 0.21 -0.25 1.79 -3.20 0.23 0.00 0.00 176.35 175.13 1lud n ASN 132 N -0.98 5.45 -0.15 2.29 5.15 -1.26 -4.78 115.26 120.98 1lud n ASN 132 Ca -0.00 -3.19 0.27 0.00 -0.60 0.00 0.00 54.58 51.06 1lud n ASN 132 Cb 0.54 -1.42 0.72 0.00 -0.53 0.00 0.00 39.78 39.08 1lud n ASN 132 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1lud h TRP 133 N 5.64 0.00 0.00 1.20 4.06 -1.94 0.45 115.95 125.36 1lud h TRP 133 Ca 0.35 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.28 1lud h TRP 133 Cb 0.62 -0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.77 1lud h TRP 133 CO 1.20 0.00 -0.13 0.22 -3.56 0.00 0.00 178.44 176.18 1lud h ASP 134 N 0.00 0.00 0.28 -3.49 1.82 -2.04 -1.65 116.42 111.33 1lud h ASP 134 Ca 0.39 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.03 1lud h ASP 134 Cb 1.57 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.58 1lud h ASP 134 CO -0.01 0.13 -0.60 -0.67 -1.61 0.00 0.00 179.24 176.48 1lud n ASP 135 N -3.83 0.85 -4.62 2.28 2.03 0.15 -4.92 116.55 108.49 1lud n ASP 135 Ca -0.02 -0.67 -0.24 0.00 0.52 0.00 0.00 54.79 54.38 1lud n ASP 135 Cb 0.23 0.46 -0.08 0.00 -0.72 0.00 0.00 41.12 41.00 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 -2.87 2.57 -0.03 -0.67 0.40 -0.62 -3.82 117.98 112.93 1lud s PHE 136 Ca 0.13 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.11 1lud s PHE 136 Cb 0.17 -1.37 0.02 0.00 0.51 0.00 0.00 43.02 42.36 1lud s PHE 136 CO 0.71 0.53 -0.03 0.99 0.70 0.00 0.00 175.22 178.12 1lud s THR 137 N -2.46 0.40 -0.10 0.64 2.01 -1.11 -4.86 115.64 110.16 1lud s THR 137 Ca 0.34 -0.07 -0.29 0.00 0.31 0.00 0.00 61.69 61.97 1lud s THR 137 Cb -0.03 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 1lud s THR 137 CO 0.19 0.18 1.49 -0.75 -0.69 0.00 0.00 174.62 175.05 1lud s LYS 138 N 0.80 4.20 -0.08 4.92 2.20 -1.26 -1.66 119.74 128.86 1lud s LYS 138 Ca -0.10 1.97 0.19 0.00 -0.36 0.00 0.00 55.97 57.68 1lud s LYS 138 Cb -0.13 -3.90 -0.26 0.00 -1.51 0.00 0.00 37.83 32.04 1lud s LYS 138 CO -0.00 -0.79 0.38 1.33 -0.36 0.00 0.00 175.35 175.91 1lud n VAL 139 N 5.44 0.79 -3.80 4.02 0.24 0.12 -4.94 118.33 120.19 1lud n VAL 139 Ca 0.16 -0.68 -0.13 0.00 -2.04 0.00 0.00 64.34 61.65 1lud n VAL 139 Cb 0.44 -0.32 -0.12 0.00 -1.47 0.00 0.00 33.84 32.36 1lud n VAL 139 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1lud s SER 140 N -5.15 -0.21 -0.10 -1.34 0.15 -1.00 -5.01 113.70 101.04 1lud s SER 140 Ca -0.08 0.41 -0.06 0.00 0.70 0.00 0.00 55.95 56.92 1lud s SER 140 Cb 0.10 0.41 0.04 0.00 -1.71 0.00 0.00 66.02 64.86 1lud s SER 140 CO 0.86 -0.07 0.24 -0.94 1.20 0.00 0.00 173.24 174.53 1lud s SER 141 N 0.13 -0.26 -0.10 5.45 1.04 -1.26 0.71 113.70 119.42 1lud s SER 141 Ca -0.00 0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.96 1lud s SER 141 Cb -0.02 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.53 1lud s SER 141 CO 0.00 -0.15 -0.15 -0.60 0.98 0.00 0.00 173.24 173.32 1lud s ARG 142 N 1.07 2.11 -0.18 4.02 6.06 -0.16 -4.95 118.95 126.91 1lud s ARG 142 Ca -0.08 -0.53 -0.06 0.00 -2.50 0.00 0.00 55.73 52.57 1lud s ARG 142 Cb -0.09 -1.80 -0.03 0.00 0.06 0.00 0.00 34.95 33.09 1lud s ARG 142 CO -0.07 -0.05 0.03 0.99 -2.50 0.00 0.00 175.30 173.69 1lud s THR 143 N 0.95 4.37 -0.08 4.11 2.01 -1.26 -0.03 115.64 125.71 1lud s THR 143 Ca -0.08 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 61.77 1lud s THR 143 Cb -0.15 -2.96 0.01 0.00 0.01 0.00 0.00 72.50 69.41 1lud s THR 143 CO -0.01 0.45 -0.15 0.54 -0.69 0.00 0.00 174.62 174.77 1lud s VAL 144 N 0.56 1.36 0.47 3.82 0.11 -0.92 -5.01 120.40 120.78 1lud s VAL 144 Ca 0.01 -0.59 -0.04 0.00 -2.93 0.00 0.00 61.98 58.43 1lud s VAL 144 Cb -0.13 -1.23 -0.02 0.00 -1.53 0.00 0.00 36.38 33.47 1lud s VAL 144 CO 0.02 0.41 0.75 -1.61 -3.33 0.00 0.00 175.10 171.33 1lud s GLU 145 N 0.71 3.35 0.05 1.54 2.02 -1.26 -2.88 118.70 122.23 1lud s GLU 145 Ca -0.13 -0.03 -0.00 0.00 0.02 0.00 0.00 54.97 54.83 1lud s GLU 145 Cb -0.16 -2.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 1lud s GLU 145 CO 0.03 -0.24 -0.04 0.34 0.02 0.00 0.00 175.26 175.37 1lud s ASP 146 N -4.15 0.52 0.33 -0.19 2.15 -1.26 -4.94 116.67 109.13 1lud s ASP 146 Ca 0.47 -0.88 0.23 0.00 0.43 0.00 0.00 52.55 52.80 1lud s ASP 146 Cb -0.10 0.16 1.20 0.00 -0.30 0.00 0.00 42.92 43.88 1lud s ASP 146 CO 0.42 -0.51 1.69 0.35 -0.17 0.00 0.00 175.17 176.96 1lud n THR 147 N 0.45 0.98 -3.76 1.71 -2.24 -1.26 -4.38 114.28 105.78 1lud n THR 147 Ca -0.16 0.68 -0.36 0.00 -2.27 0.00 0.00 64.05 61.94 1lud n THR 147 Cb 0.60 -1.68 -0.11 0.00 -2.10 0.00 0.00 70.33 67.03 1lud n THR 147 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1lud s ASN 148 N -4.10 5.55 0.19 3.42 -0.87 -1.26 -4.99 114.94 112.88 1lud s ASN 148 Ca -0.02 -0.07 -0.18 0.00 -1.57 0.00 0.00 52.86 51.03 1lud s ASN 148 Cb 0.07 -2.00 0.16 0.00 -0.02 0.00 0.00 41.25 39.46 1lud s ASN 148 CO 0.23 0.01 1.60 -0.65 -2.57 0.00 0.00 177.10 175.73 1lud h PRO 149 N 7.88 -0.11 0.00 -0.60 0.10 -1.99 -1.01 132.00 136.27 1lud h PRO 149 Ca -0.37 0.01 -0.15 0.00 0.10 0.00 0.00 66.00 65.59 1lud h PRO 149 Cb 1.18 0.02 -0.02 0.00 0.10 0.00 0.00 31.00 32.28 1lud h PRO 149 CO 0.60 -0.07 -0.73 0.00 0.10 0.00 0.00 178.00 177.90 1lud h ALA 150 N 1.22 0.56 0.00 -0.75 0.00 -1.94 -3.17 119.26 115.18 1lud h ALA 150 Ca 0.25 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1lud h ALA 150 Cb 0.52 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1lud h ALA 150 CO -0.64 0.91 0.00 1.28 0.00 0.00 0.00 179.25 180.79 1lud n LEU 151 N -3.33 0.00 -4.79 0.00 4.77 -0.42 -3.12 117.00 110.11 1lud n LEU 151 Ca 0.01 0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.70 1lud n LEU 151 Cb 0.81 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.82 1lud n LEU 151 CO 0.43 -0.02 0.74 -0.89 -1.33 0.00 0.00 177.39 176.32 1lud s THR 152 N -2.12 3.53 0.16 -5.08 2.01 -0.96 -4.67 115.64 108.50 1lud s THR 152 Ca 0.27 0.96 -0.25 0.00 0.31 0.00 0.00 61.69 62.98 1lud s THR 152 Cb 0.13 -3.39 0.06 0.00 0.01 0.00 0.00 72.50 69.31 1lud s THR 152 CO 0.24 -0.20 0.94 -1.38 -0.69 0.00 0.00 174.62 173.53 1lud s HIS 153 N -1.88 -0.14 0.09 4.92 -3.43 -1.14 -0.51 115.29 113.20 1lud s HIS 153 Ca 0.69 -0.17 0.04 0.00 -0.80 0.00 0.00 55.06 54.83 1lud s HIS 153 Cb -0.20 0.64 -0.03 0.00 -1.43 0.00 0.00 32.58 31.56 1lud s HIS 153 CO 0.23 -0.85 -0.12 0.99 -2.00 0.00 0.00 174.74 172.99 1lud s THR 154 N -3.33 1.04 -0.17 -5.38 2.01 -0.56 -2.17 115.64 107.08 1lud s THR 154 Ca 0.12 -1.49 -0.02 0.00 0.31 0.00 0.00 61.69 60.60 1lud s THR 154 Cb -0.02 -1.23 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 1lud s THR 154 CO 0.02 -0.40 -0.07 -0.31 -0.69 0.00 0.00 174.62 173.17 1lud s TYR 155 N -1.89 2.92 -0.15 4.92 2.02 0.95 -1.70 117.35 124.43 1lud s TYR 155 Ca 0.02 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 56.09 1lud s TYR 155 Cb -0.06 -1.97 0.00 0.00 -0.40 0.00 0.00 41.96 39.53 1lud s TYR 155 CO 0.01 -0.27 -0.18 -1.21 -1.57 0.00 0.00 175.55 172.34 1lud s GLU 156 N 0.73 3.16 -0.18 -0.62 2.02 -0.35 -0.99 118.70 122.47 1lud s GLU 156 Ca -0.03 -0.78 -0.03 0.00 0.02 0.00 0.00 54.97 54.14 1lud s GLU 156 Cb -0.15 -2.55 -0.01 0.00 0.10 0.00 0.00 34.13 31.52 1lud s GLU 156 CO 0.02 0.03 -0.07 0.08 0.02 0.00 0.00 175.26 175.34 1lud s VAL 157 N 0.77 3.37 0.34 2.63 1.01 0.22 -1.76 120.40 126.97 1lud s VAL 157 Ca -0.07 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.48 1lud s VAL 157 Cb -0.16 -2.49 -0.05 0.00 0.00 0.00 0.00 36.38 33.68 1lud s VAL 157 CO 0.00 0.47 0.04 0.26 0.00 0.00 0.00 175.10 175.87 1lud s TRP 158 N 0.96 2.59 0.01 5.22 0.52 0.60 0.12 118.94 128.95 1lud s TRP 158 Ca -0.01 -0.43 0.01 0.00 0.02 0.00 0.00 56.10 55.70 1lud s TRP 158 Cb -0.15 -1.53 -0.01 0.00 -1.15 0.00 0.00 33.47 30.63 1lud s TRP 158 CO 0.00 0.44 -0.04 -0.65 0.02 0.00 0.00 176.95 176.73 1lud s GLN 159 N -3.75 0.28 0.01 4.98 -0.21 -0.66 -2.11 119.66 118.20 1lud s GLN 159 Ca 0.35 -0.27 -0.30 0.00 0.02 0.00 0.00 55.36 55.16 1lud s GLN 159 Cb -0.01 -0.18 -0.05 0.00 1.00 0.00 0.00 33.01 33.78 1lud s GLN 159 CO 0.20 0.04 1.24 0.21 -2.12 0.00 0.00 175.29 174.87 1lud s LYS 160 N -0.50 4.37 0.54 2.91 2.20 -1.00 -2.76 119.74 125.50 1lud s LYS 160 Ca -0.03 1.78 0.03 0.00 -0.36 0.00 0.00 55.97 57.40 1lud s LYS 160 Cb -0.04 -3.46 0.05 0.00 -1.51 0.00 0.00 37.83 32.87 1lud s LYS 160 CO -0.00 -0.39 0.76 0.15 -0.36 0.00 0.00 175.35 175.51 1lud s LYS 161 N 1.70 2.47 0.00 4.03 -0.14 -1.25 -5.00 119.74 121.55 1lud s LYS 161 Ca 0.59 -1.02 0.07 0.00 -1.36 0.00 0.00 55.97 54.25 1lud s LYS 161 Cb -0.28 -2.55 0.05 0.00 -1.68 0.00 0.00 37.83 33.37 1lud s LYS 161 CO 0.26 -0.72 0.72 0.00 -0.76 0.00 0.00 175.35 174.85