#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 1.87 -0.13 2.41 0.00 0.70 0.12 121.76 126.73 1lud s ALA 2 Ca 0.00 -1.32 -0.04 0.00 0.00 0.00 0.00 51.96 50.60 1lud s ALA 2 Cb 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 1lud s ALA 2 CO 0.00 0.32 0.02 -0.06 0.00 0.00 0.00 175.76 176.03 1lud s PHE 3 N -1.45 3.17 -0.38 0.00 0.40 0.61 0.17 117.98 120.50 1lud s PHE 3 Ca 0.09 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.48 1lud s PHE 3 Cb -0.09 -1.92 0.13 0.00 0.51 0.00 0.00 43.02 41.65 1lud s PHE 3 CO 0.05 0.26 0.19 -1.17 0.70 0.00 0.00 175.22 175.25 1lud s LEU 4 N -0.21 2.15 0.02 -0.37 2.96 -0.91 0.13 118.68 122.44 1lud s LEU 4 Ca 0.06 -2.23 0.02 0.00 -0.22 0.00 0.00 54.13 51.76 1lud s LEU 4 Cb -0.12 -0.84 -0.01 0.00 0.50 0.00 0.00 46.19 45.72 1lud s LEU 4 CO 0.02 -0.32 -0.07 -1.66 -1.32 0.00 0.00 176.35 173.00 1lud s TRP 5 N 0.89 0.58 -0.72 5.38 -2.14 -0.85 -4.66 118.94 117.42 1lud s TRP 5 Ca 0.15 -0.26 -0.13 0.00 2.66 0.00 0.00 56.10 58.52 1lud s TRP 5 Cb -0.22 -0.36 0.19 0.00 -3.10 0.00 0.00 33.47 29.97 1lud s TRP 5 CO -0.07 -0.04 0.65 0.00 -2.66 0.00 0.00 176.95 174.83 1lud s ALA 6 N -0.64 3.89 0.26 2.67 0.00 -1.26 -1.89 121.76 124.79 1lud s ALA 6 Ca -0.03 -3.09 0.00 0.00 0.00 0.00 0.00 51.96 48.84 1lud s ALA 6 Cb -0.05 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1lud s ALA 6 CO 0.00 -2.18 0.45 1.14 0.00 0.00 0.00 175.76 175.17 1lud s GLN 7 N 0.53 3.51 0.05 0.00 -2.07 0.40 -4.74 119.66 117.34 1lud s GLN 7 Ca 0.14 -0.37 -0.01 0.00 -1.82 0.00 0.00 55.36 53.30 1lud s GLN 7 Cb -0.17 -2.78 0.01 0.00 -1.09 0.00 0.00 33.01 28.99 1lud s GLN 7 CO -0.05 0.31 0.06 -0.40 -1.32 0.00 0.00 175.29 173.89 1lud n ASP 8 N -1.13 0.02 -0.32 12.60 5.68 -1.14 -1.81 116.55 130.44 1lud n ASP 8 Ca -0.05 -1.03 -0.01 0.00 -0.50 0.00 0.00 54.79 53.20 1lud n ASP 8 Cb 0.55 -0.05 0.12 0.00 -1.14 0.00 0.00 41.12 40.60 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 1.08 -0.02 0.11 -0.00 -1.35 -2.18 114.38 112.01 1lud h ARG 9 Ca -0.02 -0.06 -0.15 0.00 -0.00 0.00 0.00 59.98 59.74 1lud h ARG 9 Cb 0.06 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.97 29.77 1lud h ARG 9 CO 0.02 0.71 -0.69 -0.44 -0.00 0.00 0.00 179.97 179.56 1lud h ASP 10 N 1.11 0.14 0.00 0.08 3.32 -1.88 -3.47 116.42 115.72 1lud h ASP 10 Ca 0.35 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1lud h ASP 10 Cb 0.01 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1lud h ASP 10 CO -0.12 0.79 0.00 0.61 -1.72 0.00 0.00 179.24 178.80 1lud n GLY 11 N 0.46 1.22 3.92 2.75 0.00 -0.82 -5.09 105.19 107.63 1lud n GLY 11 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 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 3.42 0.06 0.99 2.96 -1.26 -3.19 118.68 121.65 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 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.16 1lud s LEU 12 CO 0.00 -0.87 0.00 2.30 -1.32 0.00 0.00 176.35 176.46 1lud n ILE 13 N -2.39 0.15 -3.71 6.68 -5.35 -1.23 -2.88 119.36 110.63 1lud n ILE 13 Ca 0.03 0.05 -0.14 0.00 -0.27 0.00 0.00 62.75 62.42 1lud n ILE 13 Cb 0.57 -0.60 -0.09 0.00 -1.74 0.00 0.00 39.64 37.78 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 -3.82 -0.29 -0.07 3.28 0.00 -1.24 -4.53 107.32 100.65 1lud s GLY 14 Ca 0.00 0.90 0.04 0.00 0.00 0.00 0.00 44.72 45.66 1lud s GLY 14 CO 0.00 0.69 -0.19 1.25 0.00 0.00 0.00 173.10 174.85 1lud s LYS 15 N -0.53 2.28 -1.27 2.90 2.20 -1.23 -3.97 119.74 120.11 1lud s LYS 15 Ca -0.06 -0.68 -0.05 0.00 -0.36 0.00 0.00 55.97 54.81 1lud s LYS 15 Cb -0.03 -1.83 -0.01 0.00 -1.51 0.00 0.00 37.83 34.44 1lud s LYS 15 CO 0.03 0.18 0.68 -0.25 -0.36 0.00 0.00 175.35 175.63 1lud n ASP 16 N 3.44 -2.33 0.00 1.43 8.00 -1.26 -3.68 116.55 122.15 1lud n ASP 16 Ca -0.20 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.41 1lud n ASP 16 Cb 0.52 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.85 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 -1.66 2.03 3.74 0.44 0.00 -1.26 -4.88 105.19 103.60 1lud n GLY 17 Ca -0.24 0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 3.09 1.02 1.61 -3.43 -1.24 -4.96 115.29 111.38 1lud s HIS 18 Ca 0.00 0.98 -0.17 0.00 -0.80 0.00 0.00 55.06 55.07 1lud s HIS 18 Cb 0.00 -3.79 0.00 0.00 -1.43 0.00 0.00 32.58 27.37 1lud s HIS 18 CO 0.00 -2.63 -0.14 1.28 -2.00 0.00 0.00 174.74 171.24 1lud n LEU 19 N 2.84 -2.15 0.04 5.38 4.77 -1.26 -3.53 117.00 123.08 1lud n LEU 19 Ca 0.08 0.12 -0.07 0.00 -0.03 0.00 0.00 56.01 56.11 1lud n LEU 19 Cb 0.41 -0.97 -0.12 0.00 -2.33 0.00 0.00 43.42 40.40 1lud n LEU 19 CO 0.60 -3.71 -0.06 1.55 -1.33 0.00 0.00 177.39 174.44 1lud h PRO 20 N -1.58 0.00 0.00 3.23 0.14 -1.85 -3.43 132.00 128.51 1lud h PRO 20 Ca -0.46 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.68 1lud h PRO 20 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.46 1lud h PRO 20 CO 0.32 0.81 0.00 -2.67 0.14 0.00 0.00 178.00 176.61 1lud n TRP 21 N -3.24 0.00 -3.33 1.56 2.14 -1.26 -4.97 117.44 108.33 1lud n TRP 21 Ca -0.05 0.00 -0.13 0.00 2.07 0.00 0.00 57.50 59.39 1lud n TRP 21 Cb 0.97 0.00 -0.07 0.00 -0.81 0.00 0.00 31.31 31.40 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 1.49 -0.68 -0.27 -2.67 2.46 -1.26 -5.11 115.29 109.26 1lud s HIS 22 Ca 0.00 -0.32 0.01 0.00 0.47 0.00 0.00 55.06 55.22 1lud s HIS 22 Cb 0.00 -0.26 0.08 0.00 -0.13 0.00 0.00 32.58 32.27 1lud s HIS 22 CO 0.00 -1.00 0.00 -1.17 -2.47 0.00 0.00 174.74 170.10 1lud s LEU 23 N 1.87 2.96 0.23 8.88 2.96 -1.26 -4.97 118.68 129.34 1lud s LEU 23 Ca 0.14 -1.48 -0.01 0.00 -0.22 0.00 0.00 54.13 52.57 1lud s LEU 23 Cb -0.13 -1.21 0.23 0.00 0.50 0.00 0.00 46.19 45.59 1lud s LEU 23 CO -0.14 -0.30 1.60 1.55 -1.32 0.00 0.00 176.35 177.74 1lud h PRO 24 N 7.91 0.54 0.00 0.98 0.14 -1.99 -2.75 132.00 136.83 1lud h PRO 24 Ca -0.14 -0.27 -0.04 0.00 0.14 0.00 0.00 66.00 65.69 1lud h PRO 24 Cb 1.05 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.19 1lud h PRO 24 CO 0.45 0.85 -0.18 0.22 0.14 0.00 0.00 178.00 179.48 1lud h ASP 25 N 0.45 0.00 0.03 1.44 3.58 -1.99 -2.81 116.42 117.12 1lud h ASP 25 Ca 0.04 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.37 1lud h ASP 25 Cb 0.89 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.96 1lud h ASP 25 CO 0.08 0.18 -0.49 -0.78 -2.88 0.00 0.00 179.24 175.35 1lud h ASP 26 N 0.00 0.38 -0.45 2.28 3.58 -1.92 -2.74 116.42 117.56 1lud h ASP 26 Ca -0.00 -0.82 0.08 0.00 0.42 0.00 0.00 57.03 56.70 1lud h ASP 26 Cb 0.51 -0.12 -0.06 0.00 1.72 0.00 0.00 39.33 41.38 1lud h ASP 26 CO 0.02 1.16 0.06 -0.07 -2.88 0.00 0.00 179.24 177.54 1lud h LEU 27 N -0.35 -0.05 -1.06 2.28 3.38 -1.38 0.25 115.31 118.38 1lud h LEU 27 Ca -0.07 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1lud h LEU 27 Cb 1.26 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 42.09 1lud h LEU 27 CO 0.10 0.01 0.63 0.45 0.09 0.00 0.00 178.44 179.72 1lud h HIS 28 N 0.19 1.20 -0.39 1.13 3.86 -1.57 0.11 115.15 119.67 1lud h HIS 28 Ca 0.22 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.41 1lud h HIS 28 Cb 0.30 -0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1lud h HIS 28 CO -0.23 0.73 0.02 -0.92 0.86 0.00 0.00 177.93 178.39 1lud h TYR 29 N 1.27 0.63 -0.04 2.45 3.20 -0.64 0.28 116.97 124.12 1lud h TYR 29 Ca 0.36 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 1lud h TYR 29 Cb -0.10 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1lud h TYR 29 CO -0.00 0.59 -0.03 0.35 -1.64 0.00 0.00 178.16 177.44 1lud h PHE 30 N 0.58 0.11 -0.49 -3.82 3.57 0.13 0.90 116.94 117.91 1lud h PHE 30 Ca 0.12 -0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.51 1lud h PHE 30 Cb 0.34 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 1lud h PHE 30 CO 0.01 0.50 -0.05 -0.09 -2.23 0.00 0.00 178.31 176.45 1lud h ARG 31 N -0.32 0.86 -0.32 1.11 2.43 -0.60 -2.63 114.38 114.90 1lud h ARG 31 Ca 0.01 -0.27 -0.18 0.00 -0.81 0.00 0.00 59.98 58.73 1lud h ARG 31 Cb 0.47 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1lud h ARG 31 CO 0.01 0.89 -0.49 0.00 -1.51 0.00 0.00 179.97 178.87 1lud h ALA 32 N 1.15 0.51 0.00 2.80 0.00 -0.41 -2.75 119.26 120.56 1lud h ALA 32 Ca 0.14 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1lud h ALA 32 Cb 0.54 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1lud h ALA 32 CO 0.03 0.68 0.00 1.04 0.00 0.00 0.00 179.25 181.00 1lud n GLN 33 N -4.02 0.12 -0.80 0.00 1.13 0.30 -2.71 117.38 111.40 1lud n GLN 33 Ca -0.04 0.41 0.03 0.00 -1.94 0.00 0.00 57.00 55.46 1lud n GLN 33 Cb 0.60 -1.75 0.18 0.00 0.11 0.00 0.00 30.24 29.38 1lud n GLN 33 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1lud n THR 34 N -1.98 2.11 -2.73 5.09 -2.24 -1.01 -4.95 114.28 108.56 1lud n THR 34 Ca 0.02 -3.22 -0.43 0.00 -2.27 0.00 0.00 64.05 58.16 1lud n THR 34 Cb 0.17 -0.25 -0.03 0.00 -2.10 0.00 0.00 70.33 68.12 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 -3.20 4.74 -0.20 2.28 -7.23 -1.10 -3.39 120.40 112.30 1lud s VAL 35 Ca 0.39 1.89 0.00 0.00 -1.81 0.00 0.00 61.98 62.45 1lud s VAL 35 Cb 0.37 -4.25 0.00 0.00 0.56 0.00 0.00 36.38 33.06 1lud s VAL 35 CO -0.06 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.22 1lud n GLY 36 N 3.40 0.54 3.46 2.32 0.00 -1.26 -5.02 105.19 108.62 1lud n GLY 36 Ca 0.10 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.28 1.61 -0.16 1.61 1.02 -1.22 -4.60 119.74 116.73 1lud s LYS 37 Ca 0.00 -1.81 -0.29 0.00 0.02 0.00 0.00 55.97 53.89 1lud s LYS 37 Cb 0.00 -1.33 -0.01 0.00 -0.52 0.00 0.00 37.83 35.97 1lud s LYS 37 CO 0.00 0.09 1.10 0.42 -0.92 0.00 0.00 175.35 176.05 1lud s ILE 38 N -2.87 4.56 -0.32 2.17 1.01 -1.04 -3.89 121.20 120.82 1lud s ILE 38 Ca 0.30 1.87 -0.09 0.00 0.00 0.00 0.00 60.65 62.73 1lud s ILE 38 Cb 0.02 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.30 1lud s ILE 38 CO 0.13 -0.10 0.14 -0.32 0.00 0.00 0.00 174.94 174.79 1lud s MET 39 N 2.85 3.15 -0.32 2.79 1.75 -0.94 0.13 119.30 128.70 1lud s MET 39 Ca 0.49 -0.84 -0.18 0.00 -1.25 0.00 0.00 55.69 53.91 1lud s MET 39 Cb -0.19 -3.53 -0.01 0.00 2.84 0.00 0.00 34.83 33.94 1lud s MET 39 CO 0.13 -0.48 0.53 0.08 -0.65 0.00 0.00 175.02 174.63 1lud s VAL 40 N 1.56 5.02 -0.05 10.11 1.01 0.11 0.37 120.40 138.53 1lud s VAL 40 Ca 0.03 0.60 0.02 0.00 0.00 0.00 0.00 61.98 62.63 1lud s VAL 40 Cb -0.18 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.29 1lud s VAL 40 CO 0.05 -0.11 -0.09 0.68 0.00 0.00 0.00 175.10 175.63 1lud s VAL 41 N 2.42 0.88 0.66 2.92 -7.23 -0.86 -0.38 120.40 118.80 1lud s VAL 41 Ca 0.21 -0.35 -0.16 0.00 -1.81 0.00 0.00 61.98 59.86 1lud s VAL 41 Cb -0.15 -0.82 0.00 0.00 0.56 0.00 0.00 36.38 35.97 1lud s VAL 41 CO 0.12 0.29 1.18 -0.83 -0.31 0.00 0.00 175.10 175.56 1lud s GLY 42 N 0.62 2.46 0.65 2.32 0.00 -0.44 -2.52 107.32 110.41 1lud s GLY 42 Ca -0.11 0.85 0.28 0.00 0.00 0.00 0.00 44.72 45.74 1lud s GLY 42 CO 0.02 1.24 1.85 -0.09 0.00 0.00 0.00 173.10 176.12 1lud h ARG 43 N 0.24 0.00 0.06 2.90 1.12 -1.82 0.17 114.38 117.04 1lud h ARG 43 Ca -0.49 0.00 -0.08 0.00 -1.11 0.00 0.00 59.98 58.31 1lud h ARG 43 Cb 1.29 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.25 1lud h ARG 43 CO 0.53 0.00 -0.34 0.00 -3.11 0.00 0.00 179.97 177.05 1lud h ARG 44 N 0.00 0.13 -0.18 0.20 2.47 -1.88 -2.37 114.38 112.74 1lud h ARG 44 Ca 0.04 -0.21 -0.07 0.00 -1.26 0.00 0.00 59.98 58.47 1lud h ARG 44 Cb 0.86 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1lud h ARG 44 CO -0.00 1.10 -0.17 1.15 0.56 0.00 0.00 179.97 182.61 1lud h THR 45 N -0.74 1.33 -0.65 2.04 2.02 -1.48 -2.00 112.91 113.44 1lud h THR 45 Ca -0.06 -1.33 0.06 0.00 0.77 0.00 0.00 66.41 65.85 1lud h THR 45 Cb 1.27 1.80 -0.04 0.00 -1.74 0.00 0.00 68.15 69.44 1lud h THR 45 CO 0.06 0.40 0.43 0.22 0.37 0.00 0.00 175.52 177.00 1lud h TYR 46 N 0.09 0.66 0.00 3.16 3.20 -0.87 0.30 116.97 123.51 1lud h TYR 46 Ca 0.03 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1lud h TYR 46 Cb 0.71 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.76 1lud h TYR 46 CO 0.08 0.36 0.00 0.39 -1.64 0.00 0.00 178.16 177.35 1lud n GLU 47 N -4.47 0.25 0.01 1.82 1.02 -0.89 -3.00 120.64 115.37 1lud n GLU 47 Ca 0.09 0.27 0.11 0.00 -0.02 0.00 0.00 57.16 57.61 1lud n GLU 47 Cb 0.22 -1.83 -0.13 0.00 -0.02 0.00 0.00 31.44 29.69 1lud n GLU 47 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1lud n SER 48 N -2.26 0.26 -4.43 1.62 3.41 0.73 -4.98 113.62 107.97 1lud n SER 48 Ca 0.05 -0.06 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 1lud n SER 48 Cb 0.38 1.60 0.03 0.00 -0.26 0.00 0.00 64.21 65.96 1lud n SER 48 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1lud n PHE 49 N -2.23 -1.02 -0.05 7.33 3.01 0.62 -4.94 117.46 120.18 1lud n PHE 49 Ca -0.02 0.48 -0.00 0.00 1.01 0.00 0.00 57.45 58.91 1lud n PHE 49 Cb 0.54 -1.92 -0.00 0.00 -0.01 0.00 0.00 39.48 38.09 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 0.31 0.00 -5.01 -1.08 0.13 -1.91 -3.45 132.00 121.00 1lud h PRO 50 Ca -0.44 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 1lud h PRO 50 Cb 1.41 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.24 1lud h PRO 50 CO 0.47 0.01 -0.76 0.15 -0.23 0.00 0.00 178.00 177.64 1lud s LYS 51 N -1.60 3.25 -0.08 0.86 1.02 -1.26 -5.09 119.74 116.84 1lud s LYS 51 Ca -0.01 -0.69 -0.09 0.00 0.02 0.00 0.00 55.97 55.20 1lud s LYS 51 Cb 0.00 -2.89 0.02 0.00 -0.52 0.00 0.00 37.83 34.44 1lud s LYS 51 CO 0.02 -0.21 0.23 -0.98 -0.92 0.00 0.00 175.35 173.50 1lud s ARG 52 N 1.42 0.32 0.82 1.68 1.70 -1.26 -4.46 118.95 119.18 1lud s ARG 52 Ca 0.05 0.22 -0.11 0.00 -0.47 0.00 0.00 55.73 55.43 1lud s ARG 52 Cb -0.14 0.15 0.12 0.00 -0.57 0.00 0.00 34.95 34.51 1lud s ARG 52 CO -0.06 -0.05 1.17 -1.25 -1.08 0.00 0.00 175.30 174.03 1lud s PRO 53 N -0.12 1.55 0.21 3.89 0.04 -1.26 -5.11 135.00 134.20 1lud s PRO 53 Ca -0.02 -0.27 -0.30 0.00 0.04 0.00 0.00 61.00 60.45 1lud s PRO 53 Cb -0.02 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1lud s PRO 53 CO 0.01 -1.76 0.93 -0.51 0.04 0.00 0.00 177.00 175.71 1lud s LEU 54 N -5.56 4.62 0.30 -3.56 1.43 -1.26 -5.01 118.68 109.64 1lud s LEU 54 Ca 0.66 1.90 -0.29 0.00 -1.03 0.00 0.00 54.13 55.37 1lud s LEU 54 Cb -0.08 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.45 1lud s LEU 54 CO 0.49 0.12 1.42 -2.16 0.23 0.00 0.00 176.35 176.45 1lud s PRO 55 N -0.97 4.25 -1.28 1.29 0.05 -1.26 -2.83 135.00 134.25 1lud s PRO 55 Ca 0.42 2.35 -0.12 0.00 0.05 0.00 0.00 61.00 63.70 1lud s PRO 55 Cb -0.25 -3.06 0.10 0.00 0.05 0.00 0.00 34.50 31.33 1lud s PRO 55 CO 0.31 -0.39 0.49 0.39 0.05 0.00 0.00 177.00 177.85 1lud n GLU 56 N 1.53 -2.90 -3.79 4.56 1.02 -1.26 -4.92 120.64 114.88 1lud n GLU 56 Ca 0.04 0.35 -0.15 0.00 -0.02 0.00 0.00 57.16 57.38 1lud n GLU 56 Cb 0.40 -5.02 -0.16 0.00 -0.02 0.00 0.00 31.44 26.64 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 -6.20 -0.02 -0.20 3.49 0.52 -1.13 -4.11 118.95 111.30 1lud s ARG 57 Ca 0.46 0.16 -0.23 0.00 -0.52 0.00 0.00 55.73 55.61 1lud s ARG 57 Cb -0.25 -0.23 -0.02 0.00 0.52 0.00 0.00 34.95 34.97 1lud s ARG 57 CO 0.57 -0.15 0.72 0.99 0.02 0.00 0.00 175.30 177.46 1lud s THR 58 N 0.95 4.94 0.05 0.02 2.01 -1.25 -4.57 115.64 117.79 1lud s THR 58 Ca -0.08 1.38 0.07 0.00 0.31 0.00 0.00 61.69 63.37 1lud s THR 58 Cb -0.12 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.34 1lud s THR 58 CO -0.03 0.04 -0.21 0.20 -0.69 0.00 0.00 174.62 173.94 1lud s ASN 59 N 1.25 2.48 -0.04 3.53 0.02 -1.26 -2.22 114.94 118.69 1lud s ASN 59 Ca 0.32 -0.55 0.05 0.00 -1.02 0.00 0.00 52.86 51.66 1lud s ASN 59 Cb -0.16 -0.19 -0.01 0.00 0.02 0.00 0.00 41.25 40.91 1lud s ASN 59 CO 0.10 0.14 -0.19 -0.69 0.02 0.00 0.00 177.10 176.49 1lud s VAL 60 N -0.86 1.53 0.11 1.60 1.01 0.16 -0.65 120.40 123.31 1lud s VAL 60 Ca 0.07 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.30 1lud s VAL 60 Cb -0.09 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1lud s VAL 60 CO 0.02 0.44 0.15 -0.69 0.00 0.00 0.00 175.10 175.02 1lud s VAL 61 N -0.04 4.78 -0.16 2.92 1.01 -0.90 -2.03 120.40 125.99 1lud s VAL 61 Ca -0.03 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1lud s VAL 61 Cb -0.11 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.91 1lud s VAL 61 CO 0.02 0.02 -0.17 -0.76 0.00 0.00 0.00 175.10 174.21 1lud s LEU 62 N -2.76 1.92 0.15 3.92 1.02 -1.05 -1.78 118.68 120.11 1lud s LEU 62 Ca 0.32 -0.57 -0.11 0.00 0.02 0.00 0.00 54.13 53.78 1lud s LEU 62 Cb -0.11 -1.34 0.00 0.00 0.02 0.00 0.00 46.19 44.76 1lud s LEU 62 CO 0.24 -0.02 0.33 0.28 0.02 0.00 0.00 176.35 177.20 1lud s THR 63 N 1.34 0.07 -1.11 5.49 -1.32 -0.92 -2.22 115.64 116.96 1lud s THR 63 Ca 0.04 -1.15 0.16 0.00 -1.21 0.00 0.00 61.69 59.54 1lud s THR 63 Cb -0.13 -1.63 0.53 0.00 -1.51 0.00 0.00 72.50 69.76 1lud s THR 63 CO -0.11 -0.32 1.45 1.41 -2.21 0.00 0.00 174.62 174.84 1lud n HIS 64 N -0.21 0.94 -1.72 9.09 8.25 -1.26 -4.10 115.22 126.20 1lud n HIS 64 Ca -0.10 -0.58 -0.27 0.00 -0.26 0.00 0.00 57.72 56.51 1lud n HIS 64 Cb 0.63 -0.12 0.19 0.00 1.12 0.00 0.00 29.99 31.81 1lud n HIS 64 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1lud n GLN 65 N 0.81 -1.45 0.00 -0.41 3.00 -1.26 -5.03 117.38 113.04 1lud n GLN 65 Ca 0.20 -1.84 0.00 0.00 -0.01 0.00 0.00 57.00 55.34 1lud n GLN 65 Cb 0.67 -1.29 0.00 0.00 0.00 0.00 0.00 30.24 29.62 1lud n GLN 65 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1lud n GLU 66 N -3.73 2.90 -1.05 -1.09 2.13 -1.26 -4.74 120.64 113.80 1lud n GLU 66 Ca 0.15 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.86 1lud n GLU 66 Cb 0.53 -0.92 0.17 0.00 0.27 0.00 0.00 31.44 31.48 1lud n GLU 66 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1lud n ASP 67 N -1.67 3.31 -4.63 4.31 2.03 -1.26 -5.00 116.55 113.63 1lud n ASP 67 Ca 0.00 -3.78 -0.42 0.00 0.52 0.00 0.00 54.79 51.10 1lud n ASP 67 Cb 0.34 -0.65 -0.03 0.00 -0.72 0.00 0.00 41.12 40.06 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 -3.36 1.22 -0.50 -0.67 5.04 -1.26 -4.92 117.35 112.90 1lud s TYR 68 Ca 0.48 0.01 -0.14 0.00 -2.44 0.00 0.00 57.07 54.98 1lud s TYR 68 Cb 0.42 -4.10 0.11 0.00 0.35 0.00 0.00 41.96 38.75 1lud s TYR 68 CO 0.01 -4.87 0.43 -0.65 -1.34 0.00 0.00 175.55 169.13 1lud s GLN 69 N 5.37 2.87 -0.45 4.97 -0.21 -1.26 -4.97 119.66 125.97 1lud s GLN 69 Ca 0.94 -1.62 0.03 0.00 0.02 0.00 0.00 55.36 54.74 1lud s GLN 69 Cb -0.38 -4.16 0.16 0.00 1.00 0.00 0.00 33.01 29.63 1lud s GLN 69 CO 0.38 -1.21 0.33 0.00 -2.12 0.00 0.00 175.29 172.67 1lud s ALA 70 N 1.56 1.82 0.09 6.09 0.00 -1.26 -5.10 121.76 124.95 1lud s ALA 70 Ca 0.04 -2.60 -0.30 0.00 0.00 0.00 0.00 51.96 49.10 1lud s ALA 70 Cb -0.28 -1.73 -0.06 0.00 0.00 0.00 0.00 23.12 21.05 1lud s ALA 70 CO 0.03 -2.03 1.13 -0.65 0.00 0.00 0.00 175.76 174.24 1lud s GLN 71 N 0.03 4.50 0.00 0.00 1.11 -1.26 -3.20 119.66 120.84 1lud s GLN 71 Ca 0.27 1.69 0.00 0.00 0.01 0.00 0.00 55.36 57.33 1lud s GLN 71 Cb -0.06 -3.34 0.00 0.00 -1.01 0.00 0.00 33.01 28.59 1lud s GLN 71 CO -0.13 -0.12 0.00 0.41 0.01 0.00 0.00 175.29 175.46 1lud n GLY 72 N 2.80 2.58 3.50 3.09 0.00 -1.26 -4.95 105.19 110.95 1lud n GLY 72 Ca 0.06 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.99 2.74 0.97 4.61 0.00 -1.19 -4.83 121.76 123.08 1lud s ALA 73 Ca 0.00 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 50.89 1lud s ALA 73 Cb 0.00 -1.02 0.17 0.00 0.00 0.00 0.00 23.12 22.27 1lud s ALA 73 CO 0.00 0.56 1.10 0.28 0.00 0.00 0.00 175.76 177.71 1lud n VAL 74 N 2.24 0.00 -3.74 0.00 0.31 0.18 -4.84 118.33 112.48 1lud n VAL 74 Ca -0.17 -0.09 -0.13 0.00 -0.01 0.00 0.00 64.34 63.94 1lud n VAL 74 Cb 0.52 -0.99 -0.13 0.00 -0.91 0.00 0.00 33.84 32.33 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 -2.59 -0.04 0.16 2.52 1.01 -1.26 -2.11 120.40 118.09 1lud s VAL 75 Ca 0.67 0.15 -0.07 0.00 0.00 0.00 0.00 61.98 62.73 1lud s VAL 75 Cb -0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 1lud s VAL 75 CO 0.60 0.06 0.23 0.68 0.00 0.00 0.00 175.10 176.67 1lud s VAL 76 N 1.16 0.07 -0.06 2.92 -7.23 -0.73 -4.92 120.40 111.60 1lud s VAL 76 Ca -0.09 -1.53 0.25 0.00 -1.81 0.00 0.00 61.98 58.80 1lud s VAL 76 Cb -0.10 -1.92 0.44 0.00 0.56 0.00 0.00 36.38 35.37 1lud s VAL 76 CO -0.07 -0.32 1.16 1.41 -0.31 0.00 0.00 175.10 176.97 1lud n HIS 77 N -0.19 0.26 -3.15 2.82 -0.00 -1.26 -2.15 115.22 111.55 1lud n HIS 77 Ca -0.07 -0.86 0.05 0.00 -0.00 0.00 0.00 57.72 56.84 1lud n HIS 77 Cb 0.63 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.99 30.44 1lud n HIS 77 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1lud s ASP 78 N -2.40 -0.97 0.52 0.41 2.15 -1.26 -4.89 116.67 110.23 1lud s ASP 78 Ca 0.33 0.51 0.40 0.00 0.43 0.00 0.00 52.55 54.22 1lud s ASP 78 Cb 0.38 1.78 1.58 0.00 -0.30 0.00 0.00 42.92 46.35 1lud s ASP 78 CO -0.14 -0.18 1.69 0.58 -0.17 0.00 0.00 175.17 176.94 1lud h VAL 79 N 5.62 0.22 -0.88 1.11 2.07 -2.00 0.75 116.25 123.13 1lud h VAL 79 Ca -0.16 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.39 1lud h VAL 79 Cb 1.17 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 1lud h VAL 79 CO 0.08 0.01 0.57 0.00 0.02 0.00 0.00 177.57 178.24 1lud h ALA 80 N 1.30 1.17 -0.25 1.67 0.00 -1.99 -0.52 119.26 120.63 1lud h ALA 80 Ca 0.75 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.58 1lud h ALA 80 Cb 2.86 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 20.34 1lud h ALA 80 CO -0.09 0.41 -0.01 0.00 0.00 0.00 0.00 179.25 179.56 1lud h ALA 81 N 1.37 0.34 -0.65 0.00 0.00 0.11 -2.65 119.26 117.77 1lud h ALA 81 Ca 0.35 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1lud h ALA 81 Cb 0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1lud h ALA 81 CO -0.12 0.09 0.41 0.28 0.00 0.00 0.00 179.25 179.91 1lud h VAL 82 N 0.23 1.10 0.00 0.00 2.07 -1.29 -0.20 116.25 118.15 1lud h VAL 82 Ca 0.07 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1lud h VAL 82 Cb 0.44 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1lud h VAL 82 CO 0.02 0.15 -0.03 -0.26 0.02 0.00 0.00 177.57 177.47 1lud h PHE 83 N 0.81 0.00 0.00 1.57 0.04 -0.98 -0.28 116.94 118.10 1lud h PHE 83 Ca 0.26 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.01 1lud h PHE 83 Cb 0.00 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1lud h PHE 83 CO -0.05 0.03 -0.07 0.00 -0.60 0.00 0.00 178.31 177.62 1lud h ALA 84 N 1.97 0.95 0.03 2.45 0.00 -0.68 -3.02 119.26 120.96 1lud h ALA 84 Ca -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1lud h ALA 84 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1lud h ALA 84 CO 0.00 0.09 -0.01 -0.92 0.00 0.00 0.00 179.25 178.41 1lud h TYR 85 N 0.00 -0.04 -0.87 0.00 3.20 -0.61 -2.63 116.97 116.03 1lud h TYR 85 Ca -0.00 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 61.98 1lud h TYR 85 Cb 1.05 0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.26 1lud h TYR 85 CO 0.00 0.51 0.51 0.00 -1.64 0.00 0.00 178.16 177.54 1lud h ALA 86 N -0.39 1.28 0.00 1.82 0.00 -1.62 0.50 119.26 120.85 1lud h ALA 86 Ca -0.00 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1lud h ALA 86 Cb 0.57 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1lud h ALA 86 CO 0.01 0.10 -0.19 0.87 0.00 0.00 0.00 179.25 180.04 1lud h LYS 87 N 0.81 0.00 0.06 0.00 1.57 -1.62 -2.74 116.57 114.66 1lud h LYS 87 Ca 0.43 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.93 1lud h LYS 87 Cb 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 1lud h LYS 87 CO -0.27 0.19 -1.51 1.96 -0.57 0.00 0.00 179.45 179.25 1lud h GLN 88 N 0.00 0.12 -5.56 3.15 7.50 0.08 -3.44 115.11 116.95 1lud h GLN 88 Ca -0.00 -0.20 -0.62 0.00 0.50 0.00 0.00 58.65 58.32 1lud h GLN 88 Cb 0.37 0.08 -0.13 0.00 0.05 0.00 0.00 27.48 27.85 1lud h GLN 88 CO 0.02 0.90 0.20 -1.01 -1.50 0.00 0.00 178.83 177.45 1lud s HIS 89 N -2.63 3.16 -2.11 2.96 3.76 0.13 -4.90 115.29 115.66 1lud s HIS 89 Ca -0.06 0.47 0.18 0.00 -0.15 0.00 0.00 55.06 55.50 1lud s HIS 89 Cb 0.08 -3.16 0.83 0.00 1.11 0.00 0.00 32.58 31.44 1lud s HIS 89 CO 0.83 -0.61 1.57 -0.35 -0.85 0.00 0.00 174.74 175.33 1lud n PRO 90 N 6.08 1.34 0.00 8.40 -0.04 -1.26 -3.55 135.00 145.98 1lud n PRO 90 Ca -0.00 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 1lud n PRO 90 Cb 0.49 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.24 0.36 -3.45 3.54 9.92 -1.26 -5.00 116.55 120.42 1lud n ASP 91 Ca 0.14 -1.15 -0.16 0.00 -0.53 0.00 0.00 54.79 53.08 1lud n ASP 91 Cb 0.18 0.00 -0.11 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 -0.15 0.24 0.00 -1.24 0.74 -1.23 -4.86 119.66 113.16 1lud s GLN 92 Ca 0.00 0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.63 1lud s GLN 92 Cb 0.00 -0.98 0.00 0.00 1.10 0.00 0.00 33.01 33.13 1lud s GLN 92 CO 0.00 -0.71 0.00 0.39 -0.55 0.00 0.00 175.29 174.42 1lud n GLU 93 N 5.33 1.93 -3.76 1.67 1.02 -1.26 -4.58 120.64 120.98 1lud n GLU 93 Ca -0.05 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.73 1lud n GLU 93 Cb 0.49 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.79 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 3.55 -0.16 -4.62 2.96 -1.26 -2.49 118.68 116.66 1lud s LEU 94 Ca 0.00 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1lud s LEU 94 Cb 0.00 -1.90 -0.00 0.00 0.50 0.00 0.00 46.19 44.79 1lud s LEU 94 CO 0.00 -0.09 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.10 1lud s VAL 95 N 1.57 2.69 0.23 1.68 1.01 0.34 -0.21 120.40 127.70 1lud s VAL 95 Ca 0.05 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 1lud s VAL 95 Cb -0.16 -2.14 -0.08 0.00 0.00 0.00 0.00 36.38 34.00 1lud s VAL 95 CO 0.03 0.51 0.67 -0.63 0.00 0.00 0.00 175.10 175.68 1lud s ILE 96 N 0.84 4.69 0.00 2.22 -1.09 0.44 0.05 121.20 128.35 1lud s ILE 96 Ca -0.05 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 59.41 1lud s ILE 96 Cb -0.15 -3.76 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 1lud s ILE 96 CO -0.00 0.11 0.30 0.00 -1.23 0.00 0.00 174.94 174.12 1lud n ALA 97 N 0.44 1.58 0.00 9.38 0.00 0.49 -2.13 120.51 130.27 1lud n ALA 97 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.12 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 0.04 -1.86 0.00 0.00 0.00 -1.13 -4.91 105.19 97.33 1lud n GLY 98 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.80 0.28 -0.02 0.00 -1.26 -1.33 105.19 102.06 1lud n GLY 99 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 1.39 -0.94 4.61 0.00 -1.93 -2.49 119.26 117.91 1lud h ALA 100 Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1lud h ALA 100 Cb 0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 1lud h ALA 100 CO 0.00 0.43 0.60 0.37 0.00 0.00 0.00 179.25 180.65 1lud h GLN 101 N 0.55 1.08 0.00 0.00 4.15 -1.96 -1.52 115.11 117.41 1lud h GLN 101 Ca 0.12 -0.07 -0.09 0.00 0.77 0.00 0.00 58.65 59.39 1lud h GLN 101 Cb 0.27 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1lud h GLN 101 CO 0.00 0.72 -0.42 0.82 -1.93 0.00 0.00 178.83 178.02 1lud h ILE 102 N 1.12 0.81 0.00 2.39 1.08 -1.68 -3.04 117.51 118.19 1lud h ILE 102 Ca 0.40 -1.87 -0.04 0.00 -0.39 0.00 0.00 64.86 62.96 1lud h ILE 102 Cb 0.11 2.20 -0.01 0.00 -3.07 0.00 0.00 36.82 36.06 1lud h ILE 102 CO -0.16 0.42 -0.18 -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 -1.03 -2.90 116.94 114.43 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 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1lud h PHE 103 CO 0.00 0.18 -0.00 1.15 -0.60 0.00 0.00 178.31 179.03 1lud h THR 104 N 0.00 1.31 0.00 -1.55 2.02 -1.26 -0.74 112.91 112.69 1lud h THR 104 Ca -0.00 -1.94 -0.02 0.00 0.77 0.00 0.00 66.41 65.22 1lud h THR 104 Cb 0.91 2.46 -0.00 0.00 -1.74 0.00 0.00 68.15 69.78 1lud h THR 104 CO 0.02 0.44 -0.09 0.00 0.37 0.00 0.00 175.52 176.26 1lud h ALA 105 N -0.25 1.74 -0.02 6.16 0.00 -1.63 -1.86 119.26 123.40 1lud h ALA 105 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1lud h ALA 105 Cb 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1lud h ALA 105 CO 0.00 0.11 -0.32 1.19 0.00 0.00 0.00 179.25 180.23 1lud n PHE 106 N -4.27 0.00 -0.32 0.00 3.01 -1.09 -4.41 117.46 110.38 1lud n PHE 106 Ca -0.03 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.52 1lud n PHE 106 Cb 0.17 -0.01 0.29 0.00 -0.01 0.00 0.00 39.48 39.92 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 2.91 0.86 -0.36 -1.08 2.10 -0.25 -1.65 116.57 119.10 1lud h LYS 107 Ca 0.00 -0.05 -0.12 0.00 -2.00 0.00 0.00 60.65 58.48 1lud h LYS 107 Cb 0.79 -0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 31.91 1lud h LYS 107 CO 0.00 0.57 -0.26 0.22 -2.00 0.00 0.00 179.45 177.98 1lud h ASP 108 N 0.89 0.76 -3.78 7.07 3.58 -1.77 -3.36 116.42 119.81 1lud h ASP 108 Ca 0.47 -0.28 -0.75 0.00 0.42 0.00 0.00 57.03 56.89 1lud h ASP 108 Cb 0.55 -0.21 -0.31 0.00 1.72 0.00 0.00 39.33 41.08 1lud h ASP 108 CO -0.24 0.98 -0.00 -1.81 -2.88 0.00 0.00 179.24 175.29 1lud s ASP 109 N -6.77 6.29 -0.04 2.28 1.11 -0.62 -5.03 116.67 113.88 1lud s ASP 109 Ca -0.09 -3.12 0.07 0.00 0.18 0.00 0.00 52.55 49.58 1lud s ASP 109 Cb 0.13 -2.05 -0.02 0.00 1.07 0.00 0.00 42.92 42.05 1lud s ASP 109 CO 0.83 -0.38 -0.25 -0.69 1.18 0.00 0.00 175.17 175.87 1lud s VAL 110 N -0.49 2.13 -0.05 -1.27 1.01 -1.25 -4.54 120.40 115.96 1lud s VAL 110 Ca 0.22 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1lud s VAL 110 Cb -0.12 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1lud s VAL 110 CO -0.08 0.57 -0.02 -0.67 0.00 0.00 0.00 175.10 174.90 1lud n ASP 111 N 2.72 3.77 -3.73 3.32 2.03 0.34 -4.74 116.55 120.27 1lud n ASP 111 Ca -0.17 -0.02 -0.13 0.00 0.52 0.00 0.00 54.79 54.99 1lud n ASP 111 Cb 0.52 0.20 -0.14 0.00 -0.72 0.00 0.00 41.12 40.97 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1lud s THR 112 N -2.10 -0.09 -0.16 5.18 2.01 -0.99 -1.99 115.64 117.51 1lud s THR 112 Ca -0.05 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 1lud s THR 112 Cb 0.02 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 1lud s THR 112 CO 0.14 0.08 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.36 1lud s LEU 113 N 1.39 3.35 -0.39 4.42 1.43 -0.46 -0.28 118.68 128.14 1lud s LEU 113 Ca -0.08 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 1lud s LEU 113 Cb -0.11 -1.81 0.11 0.00 0.03 0.00 0.00 46.19 44.41 1lud s LEU 113 CO -0.07 0.18 0.14 -0.76 0.23 0.00 0.00 176.35 176.06 1lud s LEU 114 N 0.32 3.79 0.00 1.79 1.43 0.34 0.98 118.68 127.32 1lud s LEU 114 Ca -0.03 -2.31 0.06 0.00 -1.03 0.00 0.00 54.13 50.83 1lud s LEU 114 Cb -0.14 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 1lud s LEU 114 CO 0.02 -0.34 -0.19 0.54 0.23 0.00 0.00 176.35 176.62 1lud s VAL 115 N 0.71 2.71 -0.19 -1.59 0.11 -0.02 -2.01 120.40 120.12 1lud s VAL 115 Ca 0.13 -1.03 -0.05 0.00 -2.93 0.00 0.00 61.98 58.10 1lud s VAL 115 Cb -0.21 -2.08 -0.03 0.00 -1.53 0.00 0.00 36.38 32.54 1lud s VAL 115 CO -0.09 0.46 -0.00 -0.89 -3.33 0.00 0.00 175.10 171.25 1lud s THR 116 N -0.80 4.01 -0.30 5.04 2.01 -0.79 -0.10 115.64 124.70 1lud s THR 116 Ca 0.13 -0.30 -0.09 0.00 0.31 0.00 0.00 61.69 61.73 1lud s THR 116 Cb -0.10 -2.80 -0.01 0.00 0.01 0.00 0.00 72.50 69.60 1lud s THR 116 CO 0.02 0.45 0.14 -0.13 -0.69 0.00 0.00 174.62 174.42 1lud s ARG 117 N 0.78 3.41 0.39 4.92 0.52 -0.10 -0.45 118.95 128.41 1lud s ARG 117 Ca 0.00 -0.67 -0.13 0.00 -0.52 0.00 0.00 55.73 54.41 1lud s ARG 117 Cb -0.14 -3.54 -0.08 0.00 0.52 0.00 0.00 34.95 31.71 1lud s ARG 117 CO 0.02 -0.37 0.79 -0.51 0.02 0.00 0.00 175.30 175.24 1lud s LEU 118 N 1.62 3.90 0.20 2.53 1.02 -0.75 -0.84 118.68 126.36 1lud s LEU 118 Ca 0.05 1.25 0.16 0.00 0.02 0.00 0.00 54.13 55.61 1lud s LEU 118 Cb -0.17 -4.11 -0.00 0.00 0.02 0.00 0.00 46.19 41.93 1lud s LEU 118 CO 0.06 -0.35 1.19 0.00 0.02 0.00 0.00 176.35 177.28 1lud h ALA 119 N 1.61 0.66 -2.48 4.21 0.00 -0.69 -1.61 119.26 120.96 1lud h ALA 119 Ca -0.47 -0.55 -0.46 0.00 0.00 0.00 0.00 54.91 53.43 1lud h ALA 119 Cb 1.18 0.06 0.13 0.00 0.00 0.00 0.00 17.79 19.16 1lud h ALA 119 CO 0.64 0.66 0.31 0.20 0.00 0.00 0.00 179.25 181.06 1lud s GLY 120 N -4.56 1.58 -0.20 0.00 0.00 -1.07 -4.75 107.32 98.31 1lud s GLY 120 Ca 0.01 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.19 1lud s GLY 120 CO 0.77 0.01 -0.12 -0.45 0.00 0.00 0.00 173.10 173.31 1lud s SER 121 N -4.09 3.48 0.29 1.64 0.15 -1.26 -3.60 113.70 110.32 1lud s SER 121 Ca 0.64 -0.91 0.08 0.00 0.70 0.00 0.00 55.95 56.46 1lud s SER 121 Cb -0.14 -1.30 -0.04 0.00 -1.71 0.00 0.00 66.02 62.83 1lud s SER 121 CO 0.53 -0.13 0.13 -0.36 1.20 0.00 0.00 173.24 174.61 1lud s PHE 122 N 1.35 2.84 0.30 3.44 0.08 -1.26 -5.10 117.98 119.62 1lud s PHE 122 Ca -0.01 -0.25 0.11 0.00 0.12 0.00 0.00 56.93 56.90 1lud s PHE 122 Cb -0.16 -1.46 -0.05 0.00 -0.57 0.00 0.00 43.02 40.78 1lud s PHE 122 CO -0.08 0.45 -0.13 -1.21 -0.10 0.00 0.00 175.22 174.15 1lud s GLU 123 N -3.81 1.83 0.00 0.44 2.02 -1.26 -4.89 118.70 113.02 1lud s GLU 123 Ca 0.35 -1.78 0.00 0.00 0.02 0.00 0.00 54.97 53.56 1lud s GLU 123 Cb -0.06 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.37 1lud s GLU 123 CO 0.23 0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.18 1lud n GLY 124 N -0.74 1.23 0.00 -1.39 0.00 -1.26 -4.90 105.19 98.14 1lud n GLY 124 Ca -0.05 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.33 -4.29 1.61 -0.08 -1.26 -5.03 116.55 107.83 1lud n ASP 125 Ca 0.00 -0.09 -0.34 0.00 -1.51 0.00 0.00 54.79 52.85 1lud n ASP 125 Cb 0.00 0.24 -0.14 0.00 2.34 0.00 0.00 41.12 43.56 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 -0.31 3.11 0.27 5.18 2.01 -1.25 -5.11 115.64 119.55 1lud s THR 126 Ca 0.00 -0.59 0.07 0.00 0.31 0.00 0.00 61.69 61.48 1lud s THR 126 Cb 0.00 -2.38 -0.06 0.00 0.01 0.00 0.00 72.50 70.07 1lud s THR 126 CO 0.00 0.46 -0.07 -0.54 -0.69 0.00 0.00 174.62 173.78 1lud s LYS 127 N 1.25 1.54 0.74 4.92 3.01 -1.26 -3.50 119.74 126.44 1lud s LYS 127 Ca 0.03 -1.77 -0.14 0.00 -1.01 0.00 0.00 55.97 53.07 1lud s LYS 127 Cb -0.14 -1.17 0.05 0.00 -1.01 0.00 0.00 37.83 35.56 1lud s LYS 127 CO -0.03 0.05 1.19 1.41 0.51 0.00 0.00 175.35 178.48 1lud s MET 128 N -3.72 2.09 0.85 1.68 1.75 -1.19 -4.85 119.30 115.91 1lud s MET 128 Ca 0.29 1.69 -0.12 0.00 -1.25 0.00 0.00 55.69 56.30 1lud s MET 128 Cb 0.03 -1.84 0.10 0.00 2.84 0.00 0.00 34.83 35.97 1lud s MET 128 CO 0.12 -1.85 1.11 0.96 -0.65 0.00 0.00 175.02 174.70 1lud s ILE 129 N -2.11 2.66 -0.65 10.11 -4.36 -1.26 -4.93 121.20 120.65 1lud s ILE 129 Ca 0.72 0.21 -0.26 0.00 -0.26 0.00 0.00 60.65 61.06 1lud s ILE 129 Cb -0.27 -2.91 -0.02 0.00 1.25 0.00 0.00 42.46 40.51 1lud s ILE 129 CO 0.46 -0.28 1.81 -2.16 0.24 0.00 0.00 174.94 175.02 1lud s PRO 130 N -5.15 2.68 0.36 0.37 0.05 -1.26 -5.00 135.00 127.05 1lud s PRO 130 Ca 0.62 0.44 -0.05 0.00 0.05 0.00 0.00 61.00 62.07 1lud s PRO 130 Cb -0.15 -4.43 -0.05 0.00 0.05 0.00 0.00 34.50 29.92 1lud s PRO 130 CO 0.55 -2.73 0.63 -0.51 0.05 0.00 0.00 177.00 174.98 1lud s LEU 131 N 8.84 3.93 -1.15 -3.56 1.43 -1.26 -5.00 118.68 121.90 1lud s LEU 131 Ca 0.64 0.76 -0.06 0.00 -1.03 0.00 0.00 54.13 54.45 1lud s LEU 131 Cb -0.12 -3.63 0.25 0.00 0.03 0.00 0.00 46.19 42.73 1lud s LEU 131 CO 0.18 -0.32 1.69 -3.20 0.23 0.00 0.00 176.35 174.93 1lud n ASN 132 N -1.44 6.17 -0.01 2.29 5.15 -1.26 -4.79 115.26 121.37 1lud n ASN 132 Ca -0.01 -3.33 0.23 0.00 -0.60 0.00 0.00 54.58 50.87 1lud n ASN 132 Cb 0.55 -1.33 0.71 0.00 -0.53 0.00 0.00 39.78 39.17 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 5.38 0.00 0.00 1.20 4.06 -1.94 0.42 115.95 125.06 1lud h TRP 133 Ca 0.32 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.24 1lud h TRP 133 Cb 0.57 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.73 1lud h TRP 133 CO 1.15 0.00 -0.12 0.22 -3.56 0.00 0.00 178.44 176.14 1lud h ASP 134 N 0.00 0.00 0.14 -3.49 3.58 -2.04 -1.56 116.42 113.05 1lud h ASP 134 Ca 0.28 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.73 1lud h ASP 134 Cb 1.46 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.51 1lud h ASP 134 CO -0.00 0.12 -0.33 -0.67 -2.88 0.00 0.00 179.24 175.47 1lud n ASP 135 N -3.86 1.41 -4.56 2.28 2.03 0.15 -4.92 116.55 109.08 1lud n ASP 135 Ca -0.02 -1.14 -0.25 0.00 0.52 0.00 0.00 54.79 53.90 1lud n ASP 135 Cb 0.21 0.26 -0.09 0.00 -0.72 0.00 0.00 41.12 40.77 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 -2.48 2.45 -0.03 -0.67 0.40 -0.59 -3.88 117.98 113.18 1lud s PHE 136 Ca 0.23 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 56.16 1lud s PHE 136 Cb 0.19 -1.29 0.02 0.00 0.51 0.00 0.00 43.02 42.45 1lud s PHE 136 CO 0.53 0.59 -0.04 0.99 0.70 0.00 0.00 175.22 177.99 1lud s THR 137 N -2.53 0.48 -0.10 0.64 2.01 -1.06 -4.90 115.64 110.18 1lud s THR 137 Ca 0.32 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.90 1lud s THR 137 Cb -0.01 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 71.98 1lud s THR 137 CO 0.17 0.19 1.36 -0.75 -0.69 0.00 0.00 174.62 174.91 1lud s LYS 138 N 0.68 4.24 -0.05 4.92 2.36 -1.26 -1.83 119.74 128.80 1lud s LYS 138 Ca -0.09 1.82 0.21 0.00 -2.55 0.00 0.00 55.97 55.36 1lud s LYS 138 Cb -0.12 -3.76 -0.28 0.00 -1.05 0.00 0.00 37.83 32.63 1lud s LYS 138 CO -0.00 -0.68 0.44 1.33 1.55 0.00 0.00 175.35 177.99 1lud n VAL 139 N 5.19 0.46 -3.79 4.02 0.24 0.38 -4.95 118.33 119.88 1lud n VAL 139 Ca 0.14 -0.60 -0.13 0.00 -2.04 0.00 0.00 64.34 61.71 1lud n VAL 139 Cb 0.44 -0.18 -0.12 0.00 -1.47 0.00 0.00 33.84 32.51 1lud n VAL 139 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1lud s SER 140 N -4.90 -0.21 -0.16 -1.34 1.04 -1.22 -5.03 113.70 101.88 1lud s SER 140 Ca -0.08 0.41 -0.14 0.00 0.48 0.00 0.00 55.95 56.63 1lud s SER 140 Cb 0.11 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.68 1lud s SER 140 CO 0.88 -0.08 0.43 -0.55 0.98 0.00 0.00 173.24 174.89 1lud s SER 141 N 0.29 -0.47 -0.01 7.02 0.15 -1.26 -1.36 113.70 118.06 1lud s SER 141 Ca -0.02 0.88 0.02 0.00 0.70 0.00 0.00 55.95 57.53 1lud s SER 141 Cb -0.03 0.86 0.00 0.00 -1.71 0.00 0.00 66.02 65.14 1lud s SER 141 CO -0.01 -0.16 -0.06 -0.60 1.20 0.00 0.00 173.24 173.61 1lud s ARG 142 N 0.53 0.57 -0.16 5.44 6.06 -1.04 -4.96 118.95 125.40 1lud s ARG 142 Ca -0.02 -0.19 -0.04 0.00 -2.50 0.00 0.00 55.73 52.98 1lud s ARG 142 Cb -0.04 -0.57 -0.03 0.00 0.06 0.00 0.00 34.95 34.37 1lud s ARG 142 CO -0.03 0.08 -0.02 0.99 -2.50 0.00 0.00 175.30 173.82 1lud s THR 143 N 0.13 4.05 -0.05 4.11 2.01 -1.26 -1.29 115.64 123.34 1lud s THR 143 Ca -0.01 -0.30 0.02 0.00 0.31 0.00 0.00 61.69 61.71 1lud s THR 143 Cb -0.06 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.69 1lud s THR 143 CO -0.00 0.49 -0.11 0.54 -0.69 0.00 0.00 174.62 174.85 1lud s VAL 144 N 0.29 1.04 0.48 3.82 0.11 -0.93 -5.02 120.40 120.19 1lud s VAL 144 Ca -0.02 -0.45 -0.04 0.00 -2.93 0.00 0.00 61.98 58.54 1lud s VAL 144 Cb -0.14 -0.94 -0.02 0.00 -1.53 0.00 0.00 36.38 33.75 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 0.52 3.32 0.06 1.54 0.41 -1.26 -2.87 118.70 120.41 1lud s GLU 145 Ca -0.11 -0.03 0.01 0.00 -0.41 0.00 0.00 54.97 54.44 1lud s GLU 145 Cb -0.14 -2.42 -0.03 0.00 -1.78 0.00 0.00 34.13 29.76 1lud s GLU 145 CO 0.03 -0.28 -0.05 0.34 -0.49 0.00 0.00 175.26 174.80 1lud s ASP 146 N -4.16 0.74 0.52 -0.19 2.15 -1.26 -4.94 116.67 109.53 1lud s ASP 146 Ca 0.48 -0.81 0.30 0.00 0.43 0.00 0.00 52.55 52.94 1lud s ASP 146 Cb -0.10 0.11 1.62 0.00 -0.30 0.00 0.00 42.92 44.25 1lud s ASP 146 CO 0.43 -0.41 1.89 0.71 -0.17 0.00 0.00 175.17 177.62 1lud h THR 147 N 3.66 0.00 -3.45 1.71 1.35 -1.99 -3.39 112.91 110.80 1lud h THR 147 Ca -0.34 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 64.88 1lud h THR 147 Cb 1.17 0.66 -0.20 0.00 -1.73 0.00 0.00 68.15 68.06 1lud h THR 147 CO 0.55 0.00 -0.61 0.21 -0.25 0.00 0.00 175.52 175.43 1lud s ASN 148 N -4.38 5.28 0.24 5.36 3.84 -1.26 -4.99 114.94 119.02 1lud s ASN 148 Ca -0.03 -0.08 -0.06 0.00 0.21 0.00 0.00 52.86 52.90 1lud s ASN 148 Cb 0.09 -1.92 0.44 0.00 -0.55 0.00 0.00 41.25 39.31 1lud s ASN 148 CO 0.27 0.08 1.68 -0.65 -2.79 0.00 0.00 177.10 175.69 1lud h PRO 149 N 7.37 0.23 0.00 0.43 0.10 -2.00 -1.18 132.00 136.95 1lud h PRO 149 Ca -0.36 -0.01 -0.16 0.00 0.10 0.00 0.00 66.00 65.56 1lud h PRO 149 Cb 1.18 -0.05 -0.02 0.00 0.10 0.00 0.00 31.00 32.20 1lud h PRO 149 CO 0.63 0.15 -0.80 0.00 0.10 0.00 0.00 178.00 178.09 1lud h ALA 150 N 1.61 0.50 0.00 -0.75 0.00 -1.93 -3.21 119.26 115.48 1lud h ALA 150 Ca 0.40 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1lud h ALA 150 Cb 0.69 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1lud h ALA 150 CO -0.52 0.98 0.00 1.28 0.00 0.00 0.00 179.25 180.99 1lud n LEU 151 N -3.29 0.00 -4.76 0.00 4.77 -0.47 -2.61 117.00 110.64 1lud n LEU 151 Ca 0.01 0.17 -0.38 0.00 -0.03 0.00 0.00 56.01 55.77 1lud n LEU 151 Cb 0.85 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.79 1lud n LEU 151 CO 0.44 -0.05 0.93 -0.89 -1.33 0.00 0.00 177.39 176.48 1lud s THR 152 N -2.34 2.52 0.14 -5.08 2.01 -1.07 -4.68 115.64 107.15 1lud s THR 152 Ca 0.25 0.40 -0.25 0.00 0.31 0.00 0.00 61.69 62.39 1lud s THR 152 Cb 0.14 -3.21 0.07 0.00 0.01 0.00 0.00 72.50 69.51 1lud s THR 152 CO 0.29 0.00 0.93 -1.38 -0.69 0.00 0.00 174.62 173.77 1lud s HIS 153 N -1.39 -0.17 0.11 4.92 -3.43 -1.14 -0.14 115.29 114.05 1lud s HIS 153 Ca 0.67 -0.12 0.04 0.00 -0.80 0.00 0.00 55.06 54.85 1lud s HIS 153 Cb -0.36 0.63 -0.04 0.00 -1.43 0.00 0.00 32.58 31.38 1lud s HIS 153 CO 0.43 -0.81 -0.11 0.99 -2.00 0.00 0.00 174.74 173.24 1lud s THR 154 N -3.31 1.04 -0.22 -5.38 2.01 -0.02 -2.18 115.64 107.58 1lud s THR 154 Ca 0.11 -1.69 -0.06 0.00 0.31 0.00 0.00 61.69 60.35 1lud s THR 154 Cb -0.02 -1.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.03 1lud s THR 154 CO 0.01 -0.55 0.04 -0.31 -0.69 0.00 0.00 174.62 173.12 1lud s TYR 155 N -2.46 3.10 -0.16 4.92 2.02 -0.41 -0.92 117.35 123.43 1lud s TYR 155 Ca 0.07 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.44 1lud s TYR 155 Cb -0.03 -2.15 0.00 0.00 -0.40 0.00 0.00 41.96 39.38 1lud s TYR 155 CO 0.01 -0.21 -0.17 -1.21 -1.57 0.00 0.00 175.55 172.40 1lud s GLU 156 N 1.15 3.16 -0.16 -0.62 2.02 0.85 -2.49 118.70 122.61 1lud s GLU 156 Ca 0.04 -0.78 -0.01 0.00 0.02 0.00 0.00 54.97 54.24 1lud s GLU 156 Cb -0.14 -2.59 -0.01 0.00 0.10 0.00 0.00 34.13 31.48 1lud s GLU 156 CO 0.03 -0.02 -0.11 0.08 0.02 0.00 0.00 175.26 175.26 1lud s VAL 157 N 0.89 3.12 0.34 2.63 1.01 -0.46 -0.84 120.40 127.09 1lud s VAL 157 Ca -0.04 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.41 1lud s VAL 157 Cb -0.15 -2.34 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 1lud s VAL 157 CO -0.02 0.50 -0.02 0.26 0.00 0.00 0.00 175.10 175.82 1lud s TRP 158 N 0.71 2.51 0.01 5.22 0.52 0.27 -0.47 118.94 127.72 1lud s TRP 158 Ca -0.05 -0.44 0.01 0.00 0.02 0.00 0.00 56.10 55.64 1lud s TRP 158 Cb -0.15 -1.45 -0.01 0.00 -1.15 0.00 0.00 33.47 30.71 1lud s TRP 158 CO 0.02 0.51 -0.05 -0.65 0.02 0.00 0.00 176.95 176.80 1lud s GLN 159 N -3.69 0.38 0.04 4.98 -0.21 -0.76 -1.36 119.66 119.04 1lud s GLN 159 Ca 0.34 -0.35 -0.22 0.00 0.02 0.00 0.00 55.36 55.16 1lud s GLN 159 Cb 0.00 -0.28 -0.06 0.00 1.00 0.00 0.00 33.01 33.67 1lud s GLN 159 CO 0.19 0.07 0.65 0.21 -2.12 0.00 0.00 175.29 174.28 1lud s LYS 160 N -0.60 4.36 0.60 2.91 2.20 -0.84 -2.56 119.74 125.81 1lud s LYS 160 Ca -0.03 0.86 -0.15 0.00 -0.36 0.00 0.00 55.97 56.29 1lud s LYS 160 Cb -0.04 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 1lud s LYS 160 CO -0.00 0.41 1.05 0.15 -0.36 0.00 0.00 175.35 176.60 1lud s LYS 161 N -0.41 3.33 0.00 4.03 -0.14 -1.25 -5.02 119.74 120.28 1lud s LYS 161 Ca 0.33 1.12 0.00 0.00 -1.36 0.00 0.00 55.97 56.06 1lud s LYS 161 Cb -0.19 -2.04 0.00 0.00 -1.68 0.00 0.00 37.83 33.92 1lud s LYS 161 CO 0.20 -0.79 0.33 0.00 -0.76 0.00 0.00 175.35 174.33