#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 1.81 -0.16 2.41 0.00 0.16 0.20 121.76 126.18 1lud s ALA 2 Ca 0.00 -1.39 -0.05 0.00 0.00 0.00 0.00 51.96 50.52 1lud s ALA 2 Cb 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1lud s ALA 2 CO 0.00 0.21 0.01 -0.06 0.00 0.00 0.00 175.76 175.92 1lud s PHE 3 N -1.93 3.13 -0.35 0.00 0.40 0.15 0.19 117.98 119.56 1lud s PHE 3 Ca 0.12 -0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.37 1lud s PHE 3 Cb -0.06 -1.98 0.12 0.00 0.51 0.00 0.00 43.02 41.61 1lud s PHE 3 CO 0.05 0.11 0.16 -1.17 0.70 0.00 0.00 175.22 175.07 1lud s LEU 4 N 0.18 2.15 0.35 -0.37 2.96 -0.91 0.13 118.68 123.16 1lud s LEU 4 Ca 0.01 -2.00 0.05 0.00 -0.22 0.00 0.00 54.13 51.97 1lud s LEU 4 Cb -0.13 -0.84 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 1lud s LEU 4 CO 0.02 -0.36 0.19 -1.66 -1.32 0.00 0.00 176.35 173.23 1lud s TRP 5 N 1.17 1.71 -0.03 5.38 -2.14 -0.47 -4.63 118.94 119.94 1lud s TRP 5 Ca 0.13 -1.46 -0.00 0.00 2.66 0.00 0.00 56.10 57.43 1lud s TRP 5 Cb -0.20 -0.90 0.03 0.00 -3.10 0.00 0.00 33.47 29.29 1lud s TRP 5 CO -0.14 -0.58 0.02 0.00 -2.66 0.00 0.00 176.95 173.58 1lud s ALA 6 N -3.41 0.25 0.12 2.67 0.00 -1.26 -2.01 121.76 118.11 1lud s ALA 6 Ca 0.33 0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.52 1lud s ALA 6 Cb 0.03 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 1lud s ALA 6 CO 0.20 -0.17 -0.08 1.14 0.00 0.00 0.00 175.76 176.85 1lud s GLN 7 N 1.27 0.94 0.00 0.00 -2.07 0.65 -4.57 119.66 115.88 1lud s GLN 7 Ca -0.06 -1.38 0.00 0.00 -1.82 0.00 0.00 55.36 52.10 1lud s GLN 7 Cb -0.13 -0.41 0.00 0.00 -1.09 0.00 0.00 33.01 31.38 1lud s GLN 7 CO -0.03 0.03 0.00 -0.40 -1.32 0.00 0.00 175.29 173.57 1lud n ASP 8 N -0.09 0.00 -0.21 12.60 5.68 -1.16 -1.74 116.55 131.63 1lud n ASP 8 Ca -0.11 -0.62 -0.06 0.00 -0.50 0.00 0.00 54.79 53.50 1lud n ASP 8 Cb 0.61 0.00 0.04 0.00 -1.14 0.00 0.00 41.12 40.62 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 0.80 -0.13 0.11 -0.00 -1.46 -2.34 114.38 111.36 1lud h ARG 9 Ca 0.00 -0.05 -0.13 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 0.53 -0.49 -0.44 -0.00 0.00 0.00 179.97 179.57 1lud h ASP 10 N 0.83 0.38 0.00 0.08 3.32 -1.90 -3.47 116.42 115.64 1lud h ASP 10 Ca 0.22 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1lud h ASP 10 Cb -0.09 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1lud h ASP 10 CO -0.05 0.81 0.00 0.61 -1.72 0.00 0.00 179.24 178.89 1lud n GLY 11 N 0.05 1.30 3.90 2.75 0.00 -0.88 -5.08 105.19 107.23 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 4.01 0.16 0.99 2.96 -1.26 -3.33 118.68 122.21 1lud s LEU 12 Ca 0.00 0.82 0.00 0.00 -0.22 0.00 0.00 54.13 54.73 1lud s LEU 12 Cb 0.00 -3.65 0.00 0.00 0.50 0.00 0.00 46.19 43.04 1lud s LEU 12 CO 0.00 -0.23 0.00 2.30 -1.32 0.00 0.00 176.35 177.10 1lud n ILE 13 N -0.97 0.27 -3.31 6.68 -5.35 -0.96 -3.00 119.36 112.72 1lud n ILE 13 Ca -0.01 0.09 -0.37 0.00 -0.27 0.00 0.00 62.75 62.20 1lud n ILE 13 Cb 0.54 -0.68 -0.06 0.00 -1.74 0.00 0.00 39.64 37.70 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 -4.34 2.56 -0.36 3.28 0.00 -1.13 -4.61 107.32 102.72 1lud s GLY 14 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.68 1lud s GLY 14 CO 0.00 0.30 0.23 1.25 0.00 0.00 0.00 173.10 174.89 1lud s LYS 15 N -1.60 0.58 -1.21 2.90 2.36 -1.20 -3.48 119.74 118.08 1lud s LYS 15 Ca 0.34 -1.38 -0.03 0.00 -2.55 0.00 0.00 55.97 52.35 1lud s LYS 15 Cb -0.17 -1.28 -0.01 0.00 -1.05 0.00 0.00 37.83 35.32 1lud s LYS 15 CO 0.19 -1.23 0.83 -0.25 1.55 0.00 0.00 175.35 176.44 1lud n ASP 16 N 3.93 -2.83 0.00 1.43 8.00 -1.26 -3.52 116.55 122.30 1lud n ASP 16 Ca 0.14 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.87 1lud n ASP 16 Cb 0.39 -4.48 0.00 0.00 -0.02 0.00 0.00 41.12 37.01 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 -1.41 2.23 3.87 0.44 0.00 -1.26 -4.93 105.19 104.14 1lud n GLY 17 Ca -0.23 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 3.54 0.86 1.61 -3.43 -1.23 -5.01 115.29 111.63 1lud s HIS 18 Ca 0.00 1.16 -0.12 0.00 -0.80 0.00 0.00 55.06 55.29 1lud s HIS 18 Cb 0.00 -2.57 0.08 0.00 -1.43 0.00 0.00 32.58 28.66 1lud s HIS 18 CO 0.00 -0.39 0.97 1.28 -2.00 0.00 0.00 174.74 174.60 1lud n LEU 19 N -2.05 2.86 0.06 5.38 4.77 -1.26 -3.28 117.00 123.47 1lud n LEU 19 Ca 0.04 0.48 -0.06 0.00 -0.03 0.00 0.00 56.01 56.44 1lud n LEU 19 Cb 0.54 -1.41 -0.11 0.00 -2.33 0.00 0.00 43.42 40.11 1lud n LEU 19 CO 0.52 -2.35 0.10 1.55 -1.33 0.00 0.00 177.39 175.88 1lud h PRO 20 N -1.30 0.00 0.00 3.23 0.14 -1.83 -3.46 132.00 128.78 1lud h PRO 20 Ca -0.45 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.69 1lud h PRO 20 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.43 1lud h PRO 20 CO 0.42 0.87 0.00 -2.67 0.14 0.00 0.00 178.00 176.76 1lud n TRP 21 N -3.29 0.00 -3.34 1.56 2.14 -1.26 -5.05 117.44 108.20 1lud n TRP 21 Ca -0.02 0.00 -0.13 0.00 2.07 0.00 0.00 57.50 59.42 1lud n TRP 21 Cb 0.93 0.00 -0.07 0.00 -0.81 0.00 0.00 31.31 31.36 1lud n TRP 21 CO 0.00 0.00 0.00 -1.58 2.07 0.00 0.00 177.69 178.18 1lud s HIS 22 N 1.53 -0.69 -0.26 -2.67 2.46 -1.26 -5.11 115.29 109.29 1lud s HIS 22 Ca 0.00 -0.17 -0.00 0.00 0.47 0.00 0.00 55.06 55.36 1lud s HIS 22 Cb 0.00 -0.29 0.08 0.00 -0.13 0.00 0.00 32.58 32.24 1lud s HIS 22 CO 0.00 -0.98 0.03 -1.17 -2.47 0.00 0.00 174.74 170.15 1lud s LEU 23 N 2.12 2.41 0.26 8.88 2.96 -1.26 -4.97 118.68 129.08 1lud s LEU 23 Ca 0.12 -1.37 0.04 0.00 -0.22 0.00 0.00 54.13 52.70 1lud s LEU 23 Cb -0.13 -1.00 0.33 0.00 0.50 0.00 0.00 46.19 45.89 1lud s LEU 23 CO -0.22 -0.33 1.63 1.55 -1.32 0.00 0.00 176.35 177.66 1lud h PRO 24 N 8.02 0.32 0.00 0.98 0.14 -1.99 -2.72 132.00 136.75 1lud h PRO 24 Ca -0.14 -0.18 -0.04 0.00 0.14 0.00 0.00 66.00 65.78 1lud h PRO 24 Cb 1.06 0.01 -0.01 0.00 0.14 0.00 0.00 31.00 32.20 1lud h PRO 24 CO 0.43 0.73 -0.19 0.22 0.14 0.00 0.00 178.00 179.33 1lud h ASP 25 N 0.26 0.00 0.05 1.44 1.82 -1.96 -2.47 116.42 115.56 1lud h ASP 25 Ca 0.02 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.52 1lud h ASP 25 Cb 0.93 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.95 1lud h ASP 25 CO 0.08 0.19 -0.57 -0.78 -1.61 0.00 0.00 179.24 176.55 1lud h ASP 26 N 0.00 0.42 -0.74 2.28 3.58 -1.89 -2.94 116.42 117.14 1lud h ASP 26 Ca -0.00 -0.84 0.10 0.00 0.42 0.00 0.00 57.03 56.71 1lud h ASP 26 Cb 0.42 -0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.26 1lud h ASP 26 CO 0.02 1.22 0.37 -0.07 -2.88 0.00 0.00 179.24 177.90 1lud h LEU 27 N -0.32 0.47 -1.13 2.28 3.38 -1.37 0.13 115.31 118.75 1lud h LEU 27 Ca -0.09 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1lud h LEU 27 Cb 1.35 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.05 1lud h LEU 27 CO 0.11 0.26 0.50 0.45 0.09 0.00 0.00 178.44 179.85 1lud h HIS 28 N 0.61 1.06 -0.25 1.13 3.86 -1.50 -0.36 115.15 119.69 1lud h HIS 28 Ca 0.37 0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.52 1lud h HIS 28 Cb 0.41 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 1lud h HIS 28 CO -0.11 0.70 -0.10 -0.92 0.86 0.00 0.00 177.93 178.35 1lud h TYR 29 N 1.12 0.43 0.00 2.45 3.20 -0.63 0.45 116.97 123.99 1lud h TYR 29 Ca 0.29 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 1lud h TYR 29 Cb -0.07 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.09 1lud h TYR 29 CO 0.00 0.51 -0.00 0.35 -1.64 0.00 0.00 178.16 177.38 1lud h PHE 30 N 0.38 -0.00 0.67 -3.82 3.57 0.52 -1.23 116.94 117.03 1lud h PHE 30 Ca 0.08 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1lud h PHE 30 Cb 0.42 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.17 1lud h PHE 30 CO 0.01 0.42 -0.32 -0.09 -2.23 0.00 0.00 178.31 176.10 1lud h ARG 31 N -0.42 -0.87 -0.98 1.11 2.43 -1.05 -2.42 114.38 112.18 1lud h ARG 31 Ca -0.00 0.06 0.22 0.00 -0.81 0.00 0.00 59.98 59.45 1lud h ARG 31 Cb 0.42 0.20 -0.12 0.00 -0.42 0.00 0.00 29.97 30.05 1lud h ARG 31 CO 0.00 -0.55 0.57 0.00 -1.51 0.00 0.00 179.97 178.48 1lud h ALA 32 N -1.02 1.68 0.00 2.80 0.00 -1.00 0.34 119.26 122.06 1lud h ALA 32 Ca -0.09 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1lud h ALA 32 Cb 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1lud h ALA 32 CO 0.15 -0.19 0.00 1.96 0.00 0.00 0.00 179.25 181.17 1lud h GLN 33 N 0.63 0.00 -0.10 0.00 1.08 -1.12 -3.13 115.11 112.46 1lud h GLN 33 Ca 0.60 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.74 1lud h GLN 33 Cb 1.06 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.44 1lud h GLN 33 CO -0.44 0.00 -0.43 0.25 -0.95 0.00 0.00 178.83 177.26 1lud n THR 34 N -2.76 2.30 -2.68 -0.54 -2.24 0.11 -4.93 114.28 103.55 1lud n THR 34 Ca 0.02 -3.20 -0.43 0.00 -2.27 0.00 0.00 64.05 58.17 1lud n THR 34 Cb 0.32 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.23 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 -3.31 4.59 -0.17 2.28 -7.23 -0.79 -3.19 120.40 112.59 1lud s VAL 35 Ca 0.40 1.77 0.00 0.00 -1.81 0.00 0.00 61.98 62.34 1lud s VAL 35 Cb 0.38 -4.36 0.00 0.00 0.56 0.00 0.00 36.38 32.96 1lud s VAL 35 CO -0.05 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 1lud n GLY 36 N 3.74 0.52 3.40 2.32 0.00 -1.26 -5.02 105.19 108.90 1lud n GLY 36 Ca 0.11 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.30 1.47 -0.10 1.61 1.02 -1.19 -4.40 119.74 116.86 1lud s LYS 37 Ca 0.00 -1.56 -0.30 0.00 0.02 0.00 0.00 55.97 54.14 1lud s LYS 37 Cb 0.00 -1.63 -0.03 0.00 -0.52 0.00 0.00 37.83 35.64 1lud s LYS 37 CO 0.00 0.33 1.41 0.42 -0.92 0.00 0.00 175.35 176.59 1lud s ILE 38 N -2.07 3.96 -0.38 2.17 1.01 -1.05 -3.91 121.20 120.93 1lud s ILE 38 Ca 0.22 1.20 -0.13 0.00 0.00 0.00 0.00 60.65 61.94 1lud s ILE 38 Cb -0.06 -3.77 0.02 0.00 0.01 0.00 0.00 42.46 38.66 1lud s ILE 38 CO 0.10 -0.09 0.24 -0.32 0.00 0.00 0.00 174.94 174.88 1lud s MET 39 N 3.45 2.94 -0.32 2.79 1.75 -0.49 0.18 119.30 129.60 1lud s MET 39 Ca 0.62 -1.02 -0.19 0.00 -1.25 0.00 0.00 55.69 53.86 1lud s MET 39 Cb -0.27 -3.82 -0.01 0.00 2.84 0.00 0.00 34.83 33.57 1lud s MET 39 CO 0.22 -0.69 0.56 0.08 -0.65 0.00 0.00 175.02 174.53 1lud s VAL 40 N 1.61 4.99 -0.04 10.11 1.01 0.16 0.38 120.40 138.62 1lud s VAL 40 Ca 0.03 0.63 0.02 0.00 0.00 0.00 0.00 61.98 62.66 1lud s VAL 40 Cb -0.19 -3.96 0.01 0.00 0.00 0.00 0.00 36.38 32.25 1lud s VAL 40 CO 0.08 -0.14 -0.10 0.68 0.00 0.00 0.00 175.10 175.63 1lud s VAL 41 N 2.47 0.88 0.74 2.92 -7.23 -0.73 -0.33 120.40 119.12 1lud s VAL 41 Ca 0.22 -0.37 -0.11 0.00 -1.81 0.00 0.00 61.98 59.90 1lud s VAL 41 Cb -0.15 -0.80 0.04 0.00 0.56 0.00 0.00 36.38 36.02 1lud s VAL 41 CO 0.12 0.28 1.08 -0.83 -0.31 0.00 0.00 175.10 175.45 1lud s GLY 42 N 0.45 1.73 0.64 2.32 0.00 0.06 -2.27 107.32 110.25 1lud s GLY 42 Ca -0.08 0.25 0.25 0.00 0.00 0.00 0.00 44.72 45.14 1lud s GLY 42 CO 0.01 0.58 1.76 -0.09 0.00 0.00 0.00 173.10 175.37 1lud h ARG 43 N -0.88 0.00 0.02 2.90 1.12 -1.58 0.14 114.38 116.11 1lud h ARG 43 Ca -0.44 0.00 -0.09 0.00 -1.11 0.00 0.00 59.98 58.34 1lud h ARG 43 Cb 1.23 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.19 1lud h ARG 43 CO 0.53 0.00 -0.38 0.00 -3.11 0.00 0.00 179.97 177.01 1lud h ARG 44 N 0.00 0.23 0.20 0.20 3.08 -1.89 -2.78 114.38 113.41 1lud h ARG 44 Ca 0.07 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1lud h ARG 44 Cb 1.07 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1lud h ARG 44 CO -0.00 1.01 -0.10 1.15 -1.07 0.00 0.00 179.97 180.96 1lud h THR 45 N -0.44 0.87 -0.96 2.04 2.02 -1.34 -2.20 112.91 112.90 1lud h THR 45 Ca -0.05 -0.89 0.24 0.00 0.77 0.00 0.00 66.41 66.48 1lud h THR 45 Cb 1.16 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.85 1lud h THR 45 CO 0.07 0.18 0.64 0.22 0.37 0.00 0.00 175.52 177.01 1lud h TYR 46 N -0.75 0.44 0.00 3.16 3.20 -1.37 0.88 116.97 122.53 1lud h TYR 46 Ca -0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1lud h TYR 46 Cb 0.50 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.64 1lud h TYR 46 CO 0.06 0.09 0.00 0.93 -1.64 0.00 0.00 178.16 177.59 1lud h GLU 47 N 0.30 0.00 0.00 1.82 5.08 -1.39 -3.23 114.58 117.16 1lud h GLU 47 Ca 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 1lud h GLU 47 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1lud h GLU 47 CO -0.17 0.00 -1.75 0.43 -1.00 0.00 0.00 179.01 176.52 1lud n SER 48 N -2.79 0.21 -4.30 1.42 7.64 0.26 -4.98 113.62 111.09 1lud n SER 48 Ca 0.05 0.03 -0.33 0.00 1.01 0.00 0.00 58.87 59.62 1lud n SER 48 Cb 0.49 1.64 0.14 0.00 -1.01 0.00 0.00 64.21 65.47 1lud n SER 48 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1lud n PHE 49 N -2.31 -1.63 -0.07 1.43 3.01 0.12 -4.97 117.46 113.05 1lud n PHE 49 Ca -0.03 0.19 -0.06 0.00 1.01 0.00 0.00 57.45 58.57 1lud n PHE 49 Cb 0.56 -1.63 -0.03 0.00 -0.01 0.00 0.00 39.48 38.37 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 -1.77 0.00 -4.10 -1.08 0.14 -1.91 -3.45 132.00 119.83 1lud h PRO 50 Ca -0.49 0.00 -0.61 0.00 0.14 0.00 0.00 66.00 65.04 1lud h PRO 50 Cb 1.33 0.00 -0.40 0.00 0.14 0.00 0.00 31.00 32.08 1lud h PRO 50 CO 0.35 0.22 -0.75 -1.59 0.14 0.00 0.00 178.00 176.37 1lud s LYS 51 N -1.98 1.18 -0.08 0.86 -2.85 -1.26 -5.11 119.74 110.49 1lud s LYS 51 Ca -0.11 -1.26 0.01 0.00 -1.00 0.00 0.00 55.97 53.61 1lud s LYS 51 Cb 0.01 -2.51 -0.03 0.00 -2.06 0.00 0.00 37.83 33.24 1lud s LYS 51 CO 0.23 -0.86 -0.10 1.03 0.10 0.00 0.00 175.35 175.75 1lud s ARG 52 N 1.36 2.90 0.78 1.78 3.00 -1.26 -4.02 118.95 123.49 1lud s ARG 52 Ca 0.06 -0.61 -0.08 0.00 0.00 0.00 0.00 55.73 55.10 1lud s ARG 52 Cb -0.18 -2.58 0.17 0.00 0.00 0.00 0.00 34.95 32.36 1lud s ARG 52 CO -0.14 0.52 1.07 -0.35 0.00 0.00 0.00 175.30 176.40 1lud n PRO 53 N 2.63 -0.62 -2.91 3.54 -0.04 -1.26 -5.08 135.00 131.26 1lud n PRO 53 Ca -0.18 -2.19 -0.42 0.00 -0.04 0.00 0.00 63.50 60.67 1lud n PRO 53 Cb 0.53 -0.93 -0.05 0.00 -0.04 0.00 0.00 33.50 33.01 1lud n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1lud s LEU 54 N 0.00 4.10 0.81 1.53 1.43 -1.26 -5.02 118.68 120.27 1lud s LEU 54 Ca 0.65 0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 53.93 1lud s LEU 54 Cb -0.03 -3.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.05 1lud s LEU 54 CO 0.44 -0.82 0.22 -2.65 0.23 0.00 0.00 176.35 173.77 1lud n PRO 55 N 6.62 0.06 -1.65 1.29 -0.01 -1.26 -2.07 135.00 137.99 1lud n PRO 55 Ca 0.04 0.06 -0.10 0.00 -0.01 0.00 0.00 63.50 63.49 1lud n PRO 55 Cb 0.48 -1.63 -0.03 0.00 -0.01 0.00 0.00 33.50 32.31 1lud n PRO 55 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 175.50 175.88 1lud n GLU 56 N -0.27 -1.58 -3.79 -0.52 -0.58 -1.26 -4.89 120.64 107.76 1lud n GLU 56 Ca 0.07 0.56 -0.13 0.00 -0.42 0.00 0.00 57.16 57.25 1lud n GLU 56 Cb 0.52 -4.87 -0.10 0.00 -0.57 0.00 0.00 31.44 26.41 1lud n GLU 56 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1lud s ARG 57 N -3.53 0.52 -0.21 3.49 0.52 -0.88 -4.10 118.95 114.77 1lud s ARG 57 Ca 0.00 -0.06 -0.14 0.00 -0.52 0.00 0.00 55.73 55.01 1lud s ARG 57 Cb 0.00 0.23 -0.04 0.00 0.52 0.00 0.00 34.95 35.66 1lud s ARG 57 CO 0.00 -0.12 0.32 0.99 0.02 0.00 0.00 175.30 176.50 1lud s THR 58 N -0.89 5.25 0.07 0.02 2.01 -1.25 -4.65 115.64 116.21 1lud s THR 58 Ca -0.10 0.52 0.07 0.00 0.31 0.00 0.00 61.69 62.50 1lud s THR 58 Cb -0.05 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1lud s THR 58 CO 0.02 0.28 -0.19 0.20 -0.69 0.00 0.00 174.62 174.24 1lud s ASN 59 N 1.05 2.33 -0.05 3.53 0.01 -1.26 -1.40 114.94 119.15 1lud s ASN 59 Ca 0.15 -0.59 0.05 0.00 -0.71 0.00 0.00 52.86 51.76 1lud s ASN 59 Cb -0.14 -0.15 -0.00 0.00 0.41 0.00 0.00 41.25 41.36 1lud s ASN 59 CO 0.07 0.08 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.86 1lud s VAL 60 N -0.99 1.57 0.13 1.60 1.01 0.16 -1.64 120.40 122.24 1lud s VAL 60 Ca 0.05 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1lud s VAL 60 Cb -0.09 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1lud s VAL 60 CO 0.03 0.45 0.19 -0.69 0.00 0.00 0.00 175.10 175.08 1lud s VAL 61 N 0.02 4.93 -0.16 2.92 1.01 -0.91 -1.77 120.40 126.44 1lud s VAL 61 Ca -0.04 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1lud s VAL 61 Cb -0.12 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.78 1lud s VAL 61 CO 0.03 -0.03 -0.21 -0.22 0.00 0.00 0.00 175.10 174.67 1lud s LEU 62 N -2.96 2.16 0.07 3.92 2.96 -0.96 -2.51 118.68 121.35 1lud s LEU 62 Ca 0.33 -0.61 -0.08 0.00 -0.22 0.00 0.00 54.13 53.55 1lud s LEU 62 Cb -0.11 -1.47 -0.00 0.00 0.50 0.00 0.00 46.19 45.10 1lud s LEU 62 CO 0.26 0.05 0.16 0.28 -1.32 0.00 0.00 176.35 175.78 1lud s THR 63 N 1.00 0.14 -2.80 3.68 -1.32 -1.11 -1.35 115.64 113.88 1lud s THR 63 Ca -0.02 -1.16 0.24 0.00 -1.21 0.00 0.00 61.69 59.54 1lud s THR 63 Cb -0.15 -1.19 0.28 0.00 -1.51 0.00 0.00 72.50 69.93 1lud s THR 63 CO -0.06 -0.64 1.33 1.41 -2.21 0.00 0.00 174.62 174.45 1lud n HIS 64 N 0.24 0.17 -1.41 9.09 8.25 -1.26 -4.37 115.22 125.94 1lud n HIS 64 Ca -0.16 -0.09 -0.30 0.00 -0.26 0.00 0.00 57.72 56.91 1lud n HIS 64 Cb 0.61 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.96 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 -1.83 -0.86 -0.03 -0.41 1.11 -1.26 -5.02 119.66 111.37 1lud s GLN 65 Ca 0.32 -0.35 0.02 0.00 0.01 0.00 0.00 55.36 55.37 1lud s GLN 65 Cb 0.21 -1.66 -0.04 0.00 -1.01 0.00 0.00 33.01 30.51 1lud s GLN 65 CO 0.31 -3.42 0.01 0.39 0.01 0.00 0.00 175.29 172.58 1lud n GLU 66 N -4.49 3.28 -1.55 2.91 1.02 -1.26 -4.70 120.64 115.83 1lud n GLU 66 Ca 0.16 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.00 1lud n GLU 66 Cb 0.60 -1.08 0.07 0.00 -0.02 0.00 0.00 31.44 31.00 1lud n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1lud n ASP 67 N -2.15 6.43 -4.62 1.62 2.03 -1.26 -5.00 116.55 113.61 1lud n ASP 67 Ca -0.05 -3.77 -0.43 0.00 0.52 0.00 0.00 54.79 51.06 1lud n ASP 67 Cb 0.60 -0.74 -0.03 0.00 -0.72 0.00 0.00 41.12 40.23 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1lud s TYR 68 N -3.71 1.23 -0.41 -0.67 5.04 -1.26 -4.92 117.35 112.64 1lud s TYR 68 Ca 0.59 0.22 -0.12 0.00 -2.44 0.00 0.00 57.07 55.32 1lud s TYR 68 Cb 0.47 -4.03 0.05 0.00 0.35 0.00 0.00 41.96 38.79 1lud s TYR 68 CO 0.01 -4.52 0.28 -0.65 -1.34 0.00 0.00 175.55 169.32 1lud s GLN 69 N 5.71 2.84 -0.40 4.97 -1.52 -1.26 -4.99 119.66 125.01 1lud s GLN 69 Ca 0.96 -1.21 0.02 0.00 -1.95 0.00 0.00 55.36 53.18 1lud s GLN 69 Cb -0.36 -3.88 0.15 0.00 -0.22 0.00 0.00 33.01 28.70 1lud s GLN 69 CO 0.37 -0.84 0.27 0.00 -0.25 0.00 0.00 175.29 174.85 1lud s ALA 70 N 1.57 1.34 0.02 6.09 0.00 -1.26 -5.10 121.76 124.41 1lud s ALA 70 Ca 0.03 -2.24 -0.30 0.00 0.00 0.00 0.00 51.96 49.45 1lud s ALA 70 Cb -0.21 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.21 1lud s ALA 70 CO 0.06 -2.05 1.26 -0.65 0.00 0.00 0.00 175.76 174.39 1lud s GLN 71 N 0.51 4.36 0.00 0.00 -0.21 -1.26 -2.93 119.66 120.14 1lud s GLN 71 Ca 0.24 1.82 0.00 0.00 0.02 0.00 0.00 55.36 57.44 1lud s GLN 71 Cb -0.12 -3.45 0.00 0.00 1.00 0.00 0.00 33.01 30.44 1lud s GLN 71 CO -0.08 -0.40 0.00 0.41 -2.12 0.00 0.00 175.29 173.10 1lud n GLY 72 N 3.38 2.70 3.57 3.09 0.00 -1.26 -4.99 105.19 111.68 1lud n GLY 72 Ca 0.11 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.23 2.94 0.68 4.61 0.00 -1.15 -4.88 121.76 122.73 1lud s ALA 73 Ca 0.00 -0.95 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 1lud s ALA 73 Cb 0.00 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.98 1lud s ALA 73 CO 0.00 0.58 1.28 0.08 0.00 0.00 0.00 175.76 177.70 1lud s VAL 74 N -0.85 2.01 -0.05 0.00 1.01 -0.65 -4.78 120.40 117.09 1lud s VAL 74 Ca 0.14 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1lud s VAL 74 Cb -0.11 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.41 1lud s VAL 74 CO 0.03 -0.00 -0.03 -0.69 0.00 0.00 0.00 175.10 174.41 1lud s VAL 75 N -1.53 0.46 0.09 2.92 1.01 -1.26 -2.15 120.40 119.93 1lud s VAL 75 Ca 0.81 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.69 1lud s VAL 75 Cb -0.36 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1lud s VAL 75 CO 0.42 0.22 0.10 0.68 0.00 0.00 0.00 175.10 176.52 1lud s VAL 76 N 1.10 0.15 -0.08 2.92 -7.23 -1.04 -4.96 120.40 111.26 1lud s VAL 76 Ca -0.08 -1.55 0.23 0.00 -1.81 0.00 0.00 61.98 58.77 1lud s VAL 76 Cb -0.14 -1.59 0.45 0.00 0.56 0.00 0.00 36.38 35.66 1lud s VAL 76 CO -0.01 -0.69 1.16 1.41 -0.31 0.00 0.00 175.10 176.66 1lud n HIS 77 N -0.03 0.33 -3.15 2.82 8.25 -1.26 -2.75 115.22 119.43 1lud n HIS 77 Ca -0.12 -0.98 0.05 0.00 -0.26 0.00 0.00 57.72 56.41 1lud n HIS 77 Cb 0.62 -0.18 -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 -2.53 -0.85 0.53 0.41 1.01 -1.26 -4.94 116.67 109.04 1lud s ASP 78 Ca 0.34 0.53 0.44 0.00 0.71 0.00 0.00 52.55 54.57 1lud s ASP 78 Cb 0.37 1.71 1.66 0.00 1.01 0.00 0.00 42.92 47.67 1lud s ASP 78 CO -0.13 -0.16 1.61 0.58 0.21 0.00 0.00 175.17 177.28 1lud h VAL 79 N 5.60 0.07 -0.75 -1.27 2.07 -1.98 0.80 116.25 120.78 1lud h VAL 79 Ca -0.17 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1lud h VAL 79 Cb 1.17 0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 1lud h VAL 79 CO 0.05 0.00 0.47 0.00 0.02 0.00 0.00 177.57 178.11 1lud h ALA 80 N 1.19 1.00 -0.22 1.67 0.00 -2.00 -1.94 119.26 118.96 1lud h ALA 80 Ca 0.87 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.74 1lud h ALA 80 Cb 3.35 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 20.91 1lud h ALA 80 CO -0.11 0.23 0.02 0.00 0.00 0.00 0.00 179.25 179.39 1lud h ALA 81 N 1.34 0.30 -0.95 0.00 0.00 0.21 -2.87 119.26 117.29 1lud h ALA 81 Ca 0.31 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.17 1lud h ALA 81 Cb 0.07 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 1lud h ALA 81 CO -0.13 0.00 0.56 0.28 0.00 0.00 0.00 179.25 179.96 1lud h VAL 82 N 0.17 0.80 -0.51 0.00 2.07 -1.33 0.39 116.25 117.83 1lud h VAL 82 Ca 0.07 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1lud h VAL 82 Cb 0.37 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1lud h VAL 82 CO 0.01 0.15 0.20 -0.26 0.02 0.00 0.00 177.57 177.68 1lud h PHE 83 N 0.80 0.74 0.57 1.57 0.04 -1.16 -3.03 116.94 116.48 1lud h PHE 83 Ca 0.51 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 61.22 1lud h PHE 83 Cb 0.65 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 1lud h PHE 83 CO -0.03 0.59 -0.41 0.00 -0.60 0.00 0.00 178.31 177.85 1lud h ALA 84 N 1.48 -0.99 -0.44 2.45 0.00 -0.75 -2.05 119.26 118.97 1lud h ALA 84 Ca 0.18 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.99 1lud h ALA 84 Cb 0.16 0.54 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1lud h ALA 84 CO -0.02 -1.08 -0.30 -0.92 0.00 0.00 0.00 179.25 176.94 1lud h TYR 85 N -0.95 -0.80 -0.43 0.00 3.20 -1.41 -0.22 116.97 116.36 1lud h TYR 85 Ca -0.07 0.06 0.07 0.00 3.14 0.00 0.00 58.73 61.93 1lud h TYR 85 Cb 0.79 0.42 -0.06 0.00 1.54 0.00 0.00 36.73 39.42 1lud h TYR 85 CO -0.15 -0.36 0.06 0.00 -1.64 0.00 0.00 178.16 176.07 1lud h ALA 86 N 0.91 0.45 0.00 1.82 0.00 -1.45 0.29 119.26 121.28 1lud h ALA 86 Ca 0.19 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1lud h ALA 86 Cb 0.52 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1lud h ALA 86 CO -0.56 -0.34 -0.05 0.87 0.00 0.00 0.00 179.25 179.18 1lud h LYS 87 N 0.19 0.00 0.13 0.00 6.56 -0.52 -2.48 116.57 120.44 1lud h LYS 87 Ca 0.21 0.00 -0.32 0.00 -1.06 0.00 0.00 60.65 59.48 1lud h LYS 87 Cb 0.28 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.93 1lud h LYS 87 CO -0.30 0.05 -1.66 1.96 -2.06 0.00 0.00 179.45 177.44 1lud h GLN 88 N 0.00 0.27 -5.64 3.15 7.50 0.11 -3.44 115.11 117.06 1lud h GLN 88 Ca -0.00 -0.46 -0.61 0.00 0.50 0.00 0.00 58.65 58.07 1lud h GLN 88 Cb 0.17 0.17 -0.11 0.00 0.05 0.00 0.00 27.48 27.76 1lud h GLN 88 CO 0.01 1.13 0.28 -1.01 -1.50 0.00 0.00 178.83 177.74 1lud s HIS 89 N -2.60 3.19 -2.02 2.96 3.76 0.63 -4.90 115.29 116.31 1lud s HIS 89 Ca -0.12 0.66 0.08 0.00 -0.15 0.00 0.00 55.06 55.53 1lud s HIS 89 Cb 0.06 -3.14 0.25 0.00 1.11 0.00 0.00 32.58 30.87 1lud s HIS 89 CO 0.84 -0.55 1.20 -0.35 -0.85 0.00 0.00 174.74 175.03 1lud n PRO 90 N 6.08 1.45 -0.02 8.40 -0.04 -1.26 -3.53 135.00 146.09 1lud n PRO 90 Ca 0.01 -0.70 0.00 0.00 -0.04 0.00 0.00 63.50 62.77 1lud n PRO 90 Cb 0.48 -1.18 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 -0.25 -0.04 0.00 0.00 175.50 175.21 1lud n ASP 91 N 0.06 0.00 -3.40 3.54 9.92 -1.26 -5.01 116.55 120.40 1lud n ASP 91 Ca 0.08 -1.04 -0.18 0.00 -0.53 0.00 0.00 54.79 53.12 1lud n ASP 91 Cb 0.17 -0.01 -0.10 0.00 -0.64 0.00 0.00 41.12 40.55 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1lud s GLN 92 N 0.00 0.35 0.00 -1.24 0.74 -1.23 -4.77 119.66 113.51 1lud s GLN 92 Ca 0.00 -0.23 0.00 0.00 0.05 0.00 0.00 55.36 55.18 1lud s GLN 92 Cb 0.00 -0.68 0.00 0.00 1.10 0.00 0.00 33.01 33.43 1lud s GLN 92 CO 0.00 -1.05 0.00 0.39 -0.55 0.00 0.00 175.29 174.08 1lud n GLU 93 N 5.21 1.08 -3.69 1.67 1.02 -1.26 -4.59 120.64 120.08 1lud n GLU 93 Ca -0.01 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.75 1lud n GLU 93 Cb 0.46 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.76 1lud n GLU 93 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1lud s LEU 94 N 0.00 3.85 -0.14 -4.62 2.96 -1.26 -2.51 118.68 116.96 1lud s LEU 94 Ca 0.00 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1lud s LEU 94 Cb 0.00 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.71 1lud s LEU 94 CO 0.00 -0.12 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.03 1lud s VAL 95 N 1.63 2.38 0.22 1.68 1.01 0.13 0.36 120.40 127.80 1lud s VAL 95 Ca 0.05 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 61.02 1lud s VAL 95 Cb -0.16 -1.97 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 1lud s VAL 95 CO 0.06 0.54 0.61 -0.63 0.00 0.00 0.00 175.10 175.67 1lud s ILE 96 N 0.69 4.81 0.00 2.22 -1.09 0.50 0.39 121.20 128.73 1lud s ILE 96 Ca -0.09 0.80 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 1lud s ILE 96 Cb -0.16 -3.69 0.00 0.00 -1.58 0.00 0.00 42.46 37.03 1lud s ILE 96 CO 0.01 0.05 0.22 0.00 -1.23 0.00 0.00 174.94 173.99 1lud n ALA 97 N 0.25 1.20 0.00 9.38 0.00 0.55 -2.15 120.51 129.75 1lud n ALA 97 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.21 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 0.05 -1.84 0.00 0.00 0.00 -1.17 -4.93 105.19 97.31 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 -1.17 0.35 -0.02 0.00 -1.26 -0.76 105.19 102.33 1lud n GLY 99 Ca 0.00 -1.13 -0.04 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 1.17 -1.00 4.61 0.00 -1.92 -2.38 119.26 117.73 1lud h ALA 100 Ca 0.00 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.84 1lud h ALA 100 Cb 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 17.79 17.39 1lud h ALA 100 CO 0.00 0.64 0.64 0.37 0.00 0.00 0.00 179.25 180.91 1lud h GLN 101 N 1.18 1.09 0.00 0.00 5.75 -1.99 -1.55 115.11 119.59 1lud h GLN 101 Ca 0.29 -0.07 -0.12 0.00 -0.15 0.00 0.00 58.65 58.61 1lud h GLN 101 Cb 0.09 -0.25 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 1lud h GLN 101 CO -0.04 0.72 -0.55 0.82 -2.65 0.00 0.00 178.83 177.13 1lud h ILE 102 N 1.13 1.01 0.00 2.39 1.08 -1.67 -3.03 117.51 118.41 1lud h ILE 102 Ca 0.45 -2.22 -0.06 0.00 -0.39 0.00 0.00 64.86 62.64 1lud h ILE 102 Cb 0.26 2.35 -0.01 0.00 -3.07 0.00 0.00 36.82 36.35 1lud h ILE 102 CO -0.20 0.54 -0.26 -0.26 -0.69 0.00 0.00 178.15 177.28 1lud h PHE 103 N 0.00 0.00 0.01 1.37 0.04 -0.85 -2.94 116.94 114.57 1lud h PHE 103 Ca -0.01 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1lud h PHE 103 Cb 1.31 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.46 1lud h PHE 103 CO 0.00 0.26 -0.25 1.15 -0.60 0.00 0.00 178.31 178.87 1lud h THR 104 N 0.00 1.64 -0.12 -1.55 2.02 -1.35 -0.88 112.91 112.67 1lud h THR 104 Ca -0.00 -2.33 0.02 0.00 0.77 0.00 0.00 66.41 64.86 1lud h THR 104 Cb 0.81 3.20 -0.01 0.00 -1.74 0.00 0.00 68.15 70.42 1lud h THR 104 CO 0.03 0.57 0.08 0.00 0.37 0.00 0.00 175.52 176.58 1lud h ALA 105 N -0.07 2.01 -0.02 6.16 0.00 -1.58 -1.82 119.26 123.94 1lud h ALA 105 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1lud h ALA 105 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1lud h ALA 105 CO -0.02 -0.04 -0.26 1.19 0.00 0.00 0.00 179.25 180.13 1lud n PHE 106 N -4.51 0.00 -0.21 0.00 3.01 -1.11 -4.46 117.46 110.17 1lud n PHE 106 Ca -0.01 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.51 1lud n PHE 106 Cb 0.15 0.00 0.32 0.00 -0.01 0.00 0.00 39.48 39.93 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 3.24 0.82 -0.39 -1.08 2.10 -0.24 -2.17 116.57 118.85 1lud h LYS 107 Ca 0.00 -0.05 -0.13 0.00 -2.00 0.00 0.00 60.65 58.47 1lud h LYS 107 Cb 0.82 -0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 31.95 1lud h LYS 107 CO 0.00 0.54 -0.29 0.22 -2.00 0.00 0.00 179.45 177.92 1lud h ASP 108 N 0.85 0.86 -3.79 7.07 3.58 -1.78 -3.35 116.42 119.85 1lud h ASP 108 Ca 0.33 -0.35 -0.76 0.00 0.42 0.00 0.00 57.03 56.67 1lud h ASP 108 Cb 0.21 -0.24 -0.30 0.00 1.72 0.00 0.00 39.33 40.72 1lud h ASP 108 CO -0.11 1.09 0.05 -1.81 -2.88 0.00 0.00 179.24 175.58 1lud s ASP 109 N -6.78 6.46 0.12 2.28 1.11 -0.81 -5.03 116.67 114.00 1lud s ASP 109 Ca -0.10 -3.04 0.09 0.00 0.18 0.00 0.00 52.55 49.68 1lud s ASP 109 Cb 0.12 -2.10 -0.04 0.00 1.07 0.00 0.00 42.92 41.98 1lud s ASP 109 CO 0.85 -0.42 -0.22 -0.69 1.18 0.00 0.00 175.17 175.87 1lud s VAL 110 N -0.37 1.88 0.00 -1.27 1.01 -1.25 -4.58 120.40 115.82 1lud s VAL 110 Ca 0.21 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.54 1lud s VAL 110 Cb -0.12 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1lud s VAL 110 CO -0.08 -0.05 0.00 0.47 0.00 0.00 0.00 175.10 175.44 1lud n ASP 111 N 0.93 2.44 -3.86 3.32 9.92 0.52 -4.85 116.55 124.98 1lud n ASP 111 Ca -0.18 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 53.96 1lud n ASP 111 Cb 0.54 0.19 -0.14 0.00 -0.64 0.00 0.00 41.12 41.07 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1lud s THR 112 N -1.52 -0.00 -0.11 -3.53 2.01 -1.03 -2.54 115.64 108.92 1lud s THR 112 Ca 0.00 0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.04 1lud s THR 112 Cb 0.00 -0.04 0.00 0.00 0.01 0.00 0.00 72.50 72.47 1lud s THR 112 CO 0.00 0.00 -0.23 -0.76 -0.69 0.00 0.00 174.62 172.94 1lud s LEU 113 N 0.05 2.08 -0.27 4.42 1.43 -0.96 0.30 118.68 125.73 1lud s LEU 113 Ca -0.00 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 1lud s LEU 113 Cb -0.01 -1.40 0.08 0.00 0.03 0.00 0.00 46.19 44.89 1lud s LEU 113 CO -0.00 0.13 -0.01 -0.76 0.23 0.00 0.00 176.35 175.94 1lud s LEU 114 N 0.48 3.06 -0.03 1.79 1.43 0.34 0.03 118.68 125.78 1lud s LEU 114 Ca -0.16 -1.49 0.07 0.00 -1.03 0.00 0.00 54.13 51.53 1lud s LEU 114 Cb -0.17 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.78 1lud s LEU 114 CO 0.06 -0.29 -0.25 0.54 0.23 0.00 0.00 176.35 176.64 1lud s VAL 115 N 1.30 1.99 -0.21 -1.59 0.11 -0.48 -1.37 120.40 120.14 1lud s VAL 115 Ca 0.00 -1.06 -0.05 0.00 -2.93 0.00 0.00 61.98 57.95 1lud s VAL 115 Cb -0.19 -1.66 -0.02 0.00 -1.53 0.00 0.00 36.38 32.98 1lud s VAL 115 CO -0.10 0.56 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.33 1lud s THR 116 N -0.40 3.70 -0.29 5.04 2.01 -0.85 -1.16 115.64 123.69 1lud s THR 116 Ca 0.04 -0.39 -0.08 0.00 0.31 0.00 0.00 61.69 61.57 1lud s THR 116 Cb -0.11 -2.68 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 1lud s THR 116 CO 0.01 0.42 0.11 -0.13 -0.69 0.00 0.00 174.62 174.33 1lud s ARG 117 N 1.26 3.32 0.53 4.92 0.52 -1.03 -0.25 118.95 128.24 1lud s ARG 117 Ca 0.03 -0.71 -0.09 0.00 -0.52 0.00 0.00 55.73 54.44 1lud s ARG 117 Cb -0.15 -3.44 -0.05 0.00 0.52 0.00 0.00 34.95 31.84 1lud s ARG 117 CO 0.00 -0.37 0.91 -0.51 0.02 0.00 0.00 175.30 175.35 1lud s LEU 118 N 1.57 3.48 0.09 2.53 1.02 -0.71 -2.40 118.68 124.27 1lud s LEU 118 Ca 0.04 1.23 0.10 0.00 0.02 0.00 0.00 54.13 55.52 1lud s LEU 118 Cb -0.17 -4.21 -0.18 0.00 0.02 0.00 0.00 46.19 41.65 1lud s LEU 118 CO 0.04 -0.68 1.10 0.00 0.02 0.00 0.00 176.35 176.83 1lud h ALA 119 N 0.19 0.52 -2.42 4.21 0.00 -1.07 -3.04 119.26 117.66 1lud h ALA 119 Ca -0.46 -1.00 -0.47 0.00 0.00 0.00 0.00 54.91 52.98 1lud h ALA 119 Cb 1.19 0.05 0.13 0.00 0.00 0.00 0.00 17.79 19.17 1lud h ALA 119 CO 0.62 1.25 0.28 0.20 0.00 0.00 0.00 179.25 181.59 1lud s GLY 120 N -4.79 1.59 -0.20 0.00 0.00 -1.18 -4.72 107.32 98.02 1lud s GLY 120 Ca -0.00 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.39 1lud s GLY 120 CO 0.81 0.19 -0.11 -1.35 0.00 0.00 0.00 173.10 172.65 1lud s SER 121 N -3.77 3.36 0.29 1.64 1.04 -1.26 -3.08 113.70 111.92 1lud s SER 121 Ca 0.63 -0.87 0.08 0.00 0.48 0.00 0.00 55.95 56.28 1lud s SER 121 Cb -0.16 -1.23 -0.04 0.00 0.10 0.00 0.00 66.02 64.69 1lud s SER 121 CO 0.55 -0.14 0.12 -0.36 0.98 0.00 0.00 173.24 174.39 1lud s PHE 122 N 1.40 2.83 0.33 5.02 0.40 -1.26 -5.05 117.98 121.65 1lud s PHE 122 Ca -0.01 -0.25 0.09 0.00 -0.60 0.00 0.00 56.93 56.16 1lud s PHE 122 Cb -0.16 -1.44 -0.05 0.00 0.51 0.00 0.00 43.02 41.88 1lud s PHE 122 CO -0.08 0.47 0.07 -2.00 0.70 0.00 0.00 175.22 174.38 1lud s GLU 123 N -3.80 2.24 0.00 0.44 2.12 -1.26 -4.83 118.70 113.61 1lud s GLU 123 Ca 0.35 -1.62 0.00 0.00 0.36 0.00 0.00 54.97 54.05 1lud s GLU 123 Cb -0.06 -2.07 0.00 0.00 0.26 0.00 0.00 34.13 32.27 1lud s GLU 123 CO 0.23 0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 1lud n GLY 124 N -1.04 -0.72 0.00 -1.50 0.00 -1.26 -4.94 105.19 95.72 1lud n GLY 124 Ca -0.04 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 0.04 -4.43 1.61 9.92 -1.26 -5.03 116.55 117.39 1lud n ASP 125 Ca 0.00 -0.02 -0.38 0.00 -0.53 0.00 0.00 54.79 53.87 1lud n ASP 125 Cb 0.00 0.04 -0.12 0.00 -0.64 0.00 0.00 41.12 40.40 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 -0.04 4.41 0.24 -3.53 2.01 -1.23 -5.07 115.64 112.43 1lud s THR 126 Ca 0.00 -0.37 0.10 0.00 0.31 0.00 0.00 61.69 61.73 1lud s THR 126 Cb 0.00 -3.19 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 1lud s THR 126 CO 0.00 0.16 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.38 1lud s LYS 127 N 1.60 1.50 0.76 4.92 1.02 -1.26 -2.26 119.74 126.02 1lud s LYS 127 Ca 0.05 -1.66 -0.14 0.00 0.02 0.00 0.00 55.97 54.24 1lud s LYS 127 Cb -0.16 -1.47 0.06 0.00 -0.52 0.00 0.00 37.83 35.73 1lud s LYS 127 CO 0.05 0.27 1.18 1.41 -0.92 0.00 0.00 175.35 177.34 1lud s MET 128 N -3.48 1.98 0.93 1.68 1.75 -1.21 -4.88 119.30 116.07 1lud s MET 128 Ca 0.25 1.65 -0.12 0.00 -1.25 0.00 0.00 55.69 56.22 1lud s MET 128 Cb -0.03 -1.83 0.15 0.00 2.84 0.00 0.00 34.83 35.96 1lud s MET 128 CO 0.11 -1.93 1.12 0.96 -0.65 0.00 0.00 175.02 174.63 1lud s ILE 129 N -2.21 2.15 -0.69 10.11 -4.36 -1.26 -4.95 121.20 120.00 1lud s ILE 129 Ca 0.71 0.05 -0.27 0.00 -0.26 0.00 0.00 60.65 60.88 1lud s ILE 129 Cb -0.26 -2.70 0.01 0.00 1.25 0.00 0.00 42.46 40.75 1lud s ILE 129 CO 0.48 -0.06 1.49 -2.16 0.24 0.00 0.00 174.94 174.93 1lud s PRO 130 N -5.15 2.99 0.35 0.37 0.05 -1.26 -5.02 135.00 127.33 1lud s PRO 130 Ca 0.64 0.08 -0.05 0.00 0.05 0.00 0.00 61.00 61.72 1lud s PRO 130 Cb -0.16 -4.25 -0.05 0.00 0.05 0.00 0.00 34.50 30.09 1lud s PRO 130 CO 0.55 -2.36 0.63 -0.51 0.05 0.00 0.00 177.00 175.36 1lud s LEU 131 N 6.95 3.94 -1.17 -3.56 1.43 -1.26 -5.00 118.68 120.01 1lud s LEU 131 Ca 0.47 0.79 -0.06 0.00 -1.03 0.00 0.00 54.13 54.30 1lud s LEU 131 Cb -0.10 -3.65 0.25 0.00 0.03 0.00 0.00 46.19 42.72 1lud s LEU 131 CO 0.17 -0.31 1.66 -3.20 0.23 0.00 0.00 176.35 174.90 1lud n ASN 132 N -1.35 5.86 -0.08 2.29 4.05 -1.26 -4.80 115.26 119.97 1lud n ASN 132 Ca -0.01 -3.29 0.25 0.00 0.45 0.00 0.00 54.58 51.99 1lud n ASN 132 Cb 0.54 -1.36 0.72 0.00 1.23 0.00 0.00 39.78 40.91 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 5.55 0.00 0.00 1.20 4.06 -1.95 0.41 115.95 125.23 1lud h TRP 133 Ca 0.29 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.20 1lud h TRP 133 Cb 0.62 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.77 1lud h TRP 133 CO 1.12 0.00 -0.19 -0.44 -3.56 0.00 0.00 178.44 175.37 1lud h ASP 134 N 0.00 0.00 0.52 -3.49 3.32 -2.04 -2.46 116.42 112.27 1lud h ASP 134 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 1lud h ASP 134 Cb 1.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.06 1lud h ASP 134 CO -0.00 0.19 -0.79 -0.67 -1.72 0.00 0.00 179.24 176.24 1lud n ASP 135 N -3.72 0.63 -4.72 6.45 -0.08 0.14 -4.91 116.55 110.34 1lud n ASP 135 Ca -0.02 -0.20 -0.23 0.00 -1.51 0.00 0.00 54.79 52.83 1lud n ASP 135 Cb 0.30 0.51 -0.07 0.00 2.34 0.00 0.00 41.12 44.21 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1lud s PHE 136 N -3.12 2.67 -0.03 -0.67 0.40 -0.92 -3.06 117.98 113.25 1lud s PHE 136 Ca 0.07 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 55.99 1lud s PHE 136 Cb 0.15 -1.68 0.02 0.00 0.51 0.00 0.00 43.02 42.02 1lud s PHE 136 CO 0.76 0.33 -0.03 0.99 0.70 0.00 0.00 175.22 177.97 1lud s THR 137 N -2.46 0.36 -0.15 0.64 2.01 -0.94 -4.87 115.64 110.23 1lud s THR 137 Ca 0.38 -0.07 -0.29 0.00 0.31 0.00 0.00 61.69 62.02 1lud s THR 137 Cb -0.01 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 1lud s THR 137 CO 0.22 0.16 1.48 -0.75 -0.69 0.00 0.00 174.62 175.05 1lud s LYS 138 N 0.66 4.08 -0.04 4.92 2.36 -1.26 -1.19 119.74 129.27 1lud s LYS 138 Ca -0.07 1.80 0.19 0.00 -2.55 0.00 0.00 55.97 55.34 1lud s LYS 138 Cb -0.11 -3.92 -0.23 0.00 -1.05 0.00 0.00 37.83 32.53 1lud s LYS 138 CO -0.01 -0.93 0.50 1.33 1.55 0.00 0.00 175.35 177.79 1lud n VAL 139 N 5.74 0.81 -3.78 4.02 0.24 0.35 -4.94 118.33 120.77 1lud n VAL 139 Ca 0.16 -0.67 -0.13 0.00 -2.04 0.00 0.00 64.34 61.67 1lud n VAL 139 Cb 0.44 -0.38 -0.11 0.00 -1.47 0.00 0.00 33.84 32.32 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 -5.25 -0.25 -0.12 -1.34 0.01 -1.18 -5.04 113.70 100.53 1lud s SER 140 Ca -0.07 0.43 -0.08 0.00 1.31 0.00 0.00 55.95 57.54 1lud s SER 140 Cb 0.10 0.51 0.04 0.00 0.21 0.00 0.00 66.02 66.88 1lud s SER 140 CO 0.85 -0.19 0.30 -0.94 0.41 0.00 0.00 173.24 173.67 1lud s SER 141 N -0.25 -0.34 -0.11 2.44 1.04 -1.26 -1.05 113.70 114.17 1lud s SER 141 Ca -0.04 0.63 0.02 0.00 0.48 0.00 0.00 55.95 57.04 1lud s SER 141 Cb -0.03 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.66 1lud s SER 141 CO 0.01 -0.15 -0.15 -0.60 0.98 0.00 0.00 173.24 173.33 1lud s ARG 142 N 0.97 2.20 -0.16 4.02 3.52 -0.75 -4.94 118.95 123.81 1lud s ARG 142 Ca -0.07 -0.55 -0.05 0.00 -0.13 0.00 0.00 55.73 54.93 1lud s ARG 142 Cb -0.07 -1.88 -0.03 0.00 -1.56 0.00 0.00 34.95 31.40 1lud s ARG 142 CO -0.07 -0.07 -0.01 0.99 -0.81 0.00 0.00 175.30 175.33 1lud s THR 143 N 1.01 4.18 -0.05 4.11 2.01 -1.26 -0.23 115.64 125.41 1lud s THR 143 Ca -0.06 -0.26 0.03 0.00 0.31 0.00 0.00 61.69 61.71 1lud s THR 143 Cb -0.15 -2.84 0.01 0.00 0.01 0.00 0.00 72.50 69.53 1lud s THR 143 CO -0.02 0.49 -0.12 0.54 -0.69 0.00 0.00 174.62 174.83 1lud s VAL 144 N 0.25 1.06 0.47 3.82 0.11 -0.88 -5.01 120.40 120.23 1lud s VAL 144 Ca -0.01 -0.47 -0.04 0.00 -2.93 0.00 0.00 61.98 58.54 1lud s VAL 144 Cb -0.13 -0.96 -0.03 0.00 -1.53 0.00 0.00 36.38 33.73 1lud s VAL 144 CO 0.02 0.33 0.76 -1.61 -3.33 0.00 0.00 175.10 171.27 1lud s GLU 145 N 0.47 3.42 0.05 1.54 2.02 -1.26 -2.89 118.70 122.04 1lud s GLU 145 Ca -0.10 0.05 -0.00 0.00 0.02 0.00 0.00 54.97 54.93 1lud s GLU 145 Cb -0.13 -2.42 -0.03 0.00 0.10 0.00 0.00 34.13 31.65 1lud s GLU 145 CO 0.02 -0.22 -0.04 0.34 0.02 0.00 0.00 175.26 175.39 1lud s ASP 146 N -4.13 0.50 0.31 -0.19 2.15 -1.26 -4.94 116.67 109.11 1lud s ASP 146 Ca 0.47 -0.85 0.21 0.00 0.43 0.00 0.00 52.55 52.81 1lud s ASP 146 Cb -0.10 0.16 1.14 0.00 -0.30 0.00 0.00 42.92 43.82 1lud s ASP 146 CO 0.43 -0.49 1.65 0.35 -0.17 0.00 0.00 175.17 176.94 1lud n THR 147 N 0.55 1.06 -4.12 1.71 -2.24 -1.26 -4.41 114.28 105.57 1lud n THR 147 Ca -0.17 0.73 -0.35 0.00 -2.27 0.00 0.00 64.05 61.99 1lud n THR 147 Cb 0.59 -1.72 -0.12 0.00 -2.10 0.00 0.00 70.33 66.98 1lud n THR 147 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1lud s ASN 148 N -4.01 5.06 0.21 3.42 2.47 -1.26 -5.00 114.94 115.83 1lud s ASN 148 Ca -0.02 -0.11 -0.12 0.00 0.42 0.00 0.00 52.86 53.03 1lud s ASN 148 Cb 0.06 -1.86 0.27 0.00 -1.45 0.00 0.00 41.25 38.27 1lud s ASN 148 CO 0.19 0.11 1.65 -0.65 -3.72 0.00 0.00 177.10 174.69 1lud h PRO 149 N 7.15 0.08 0.07 0.43 0.10 -1.99 -1.84 132.00 136.00 1lud h PRO 149 Ca -0.35 -0.00 -0.25 0.00 0.10 0.00 0.00 66.00 65.50 1lud h PRO 149 Cb 1.18 -0.02 -0.01 0.00 0.10 0.00 0.00 31.00 32.25 1lud h PRO 149 CO 0.63 0.05 -1.13 0.00 0.10 0.00 0.00 178.00 177.65 1lud h ALA 150 N 1.56 0.21 0.00 -0.75 0.00 -1.94 -3.20 119.26 115.14 1lud h ALA 150 Ca 0.31 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1lud h ALA 150 Cb 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1lud h ALA 150 CO -0.55 1.10 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1lud n LEU 151 N -3.45 0.00 -4.78 0.00 4.77 -0.74 -3.09 117.00 109.71 1lud n LEU 151 Ca -0.05 0.20 -0.36 0.00 -0.03 0.00 0.00 56.01 55.78 1lud n LEU 151 Cb 0.99 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 41.86 1lud n LEU 151 CO 0.51 -0.11 0.78 -0.89 -1.33 0.00 0.00 177.39 176.35 1lud s THR 152 N -2.40 3.30 0.10 -5.08 2.01 -0.93 -4.68 115.64 107.95 1lud s THR 152 Ca 0.16 0.87 -0.26 0.00 0.31 0.00 0.00 61.69 62.77 1lud s THR 152 Cb 0.10 -3.39 0.09 0.00 0.01 0.00 0.00 72.50 69.31 1lud s THR 152 CO 0.20 -0.12 1.11 -1.38 -0.69 0.00 0.00 174.62 173.74 1lud s HIS 153 N -1.74 -0.03 0.10 4.92 -3.43 -1.14 -0.90 115.29 113.07 1lud s HIS 153 Ca 0.68 -0.23 0.03 0.00 -0.80 0.00 0.00 55.06 54.73 1lud s HIS 153 Cb -0.24 0.63 -0.04 0.00 -1.43 0.00 0.00 32.58 31.50 1lud s HIS 153 CO 0.28 -0.65 -0.09 0.99 -2.00 0.00 0.00 174.74 173.28 1lud s THR 154 N -2.56 0.85 -0.18 -5.38 2.01 -1.01 -2.06 115.64 107.30 1lud s THR 154 Ca 0.18 -1.77 -0.03 0.00 0.31 0.00 0.00 61.69 60.37 1lud s THR 154 Cb -0.00 -1.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 1lud s THR 154 CO 0.01 -0.69 -0.05 -0.31 -0.69 0.00 0.00 174.62 172.88 1lud s TYR 155 N -2.95 2.96 -0.15 4.92 2.02 0.68 -2.45 117.35 122.38 1lud s TYR 155 Ca 0.08 -0.59 0.01 0.00 -0.37 0.00 0.00 57.07 56.21 1lud s TYR 155 Cb 0.01 -2.00 0.00 0.00 -0.40 0.00 0.00 41.96 39.57 1lud s TYR 155 CO -0.02 -0.26 -0.17 -1.21 -1.57 0.00 0.00 175.55 172.33 1lud s GLU 156 N 0.79 3.16 -0.14 -0.62 0.41 -0.31 -1.81 118.70 120.18 1lud s GLU 156 Ca -0.02 -0.78 0.00 0.00 -0.41 0.00 0.00 54.97 53.77 1lud s GLU 156 Cb -0.15 -2.58 -0.01 0.00 -1.78 0.00 0.00 34.13 29.62 1lud s GLU 156 CO 0.02 0.00 -0.15 0.08 -0.49 0.00 0.00 175.26 174.72 1lud s VAL 157 N 0.82 2.76 0.36 2.63 1.01 -0.22 -1.38 120.40 126.38 1lud s VAL 157 Ca -0.06 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.26 1lud s VAL 157 Cb -0.15 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.01 1lud s VAL 157 CO -0.01 0.52 0.01 0.26 0.00 0.00 0.00 175.10 175.88 1lud s TRP 158 N 0.64 2.52 0.00 5.22 0.52 0.10 -0.50 118.94 127.45 1lud s TRP 158 Ca -0.08 -0.49 0.02 0.00 0.02 0.00 0.00 56.10 55.57 1lud s TRP 158 Cb -0.16 -1.55 -0.01 0.00 -1.15 0.00 0.00 33.47 30.60 1lud s TRP 158 CO 0.03 0.46 -0.06 -0.65 0.02 0.00 0.00 176.95 176.74 1lud s GLN 159 N -3.72 0.50 0.09 4.98 -0.21 -0.33 -2.26 119.66 118.72 1lud s GLN 159 Ca 0.35 -0.29 -0.31 0.00 0.02 0.00 0.00 55.36 55.13 1lud s GLN 159 Cb 0.02 -0.46 -0.07 0.00 1.00 0.00 0.00 33.01 33.50 1lud s GLN 159 CO 0.19 0.12 1.31 0.21 -2.12 0.00 0.00 175.29 175.01 1lud s LYS 160 N -0.34 4.36 0.46 2.91 2.20 -1.05 -2.20 119.74 126.08 1lud s LYS 160 Ca 0.01 1.95 -0.07 0.00 -0.36 0.00 0.00 55.97 57.50 1lud s LYS 160 Cb -0.03 -3.29 -0.05 0.00 -1.51 0.00 0.00 37.83 32.95 1lud s LYS 160 CO -0.00 -0.37 0.79 0.15 -0.36 0.00 0.00 175.35 175.56 1lud s LYS 161 N 1.08 3.62 0.00 4.03 -0.14 -1.17 -4.97 119.74 122.20 1lud s LYS 161 Ca 0.62 0.32 0.25 0.00 -1.36 0.00 0.00 55.97 55.80 1lud s LYS 161 Cb -0.34 -2.37 0.47 0.00 -1.68 0.00 0.00 37.83 33.91 1lud s LYS 161 CO 0.30 -0.16 1.42 0.00 -0.76 0.00 0.00 175.35 176.14