#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 1.70 -0.16 2.41 0.00 -0.01 0.17 121.76 125.86 1lud s ALA 2 Ca 0.00 -1.27 -0.07 0.00 0.00 0.00 0.00 51.96 50.62 1lud s ALA 2 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1lud s ALA 2 CO 0.00 0.26 0.07 -0.06 0.00 0.00 0.00 175.76 176.03 1lud s PHE 3 N -1.53 3.31 -0.32 0.00 0.08 0.18 0.16 117.98 119.85 1lud s PHE 3 Ca 0.07 0.18 -0.01 0.00 0.12 0.00 0.00 56.93 57.29 1lud s PHE 3 Cb -0.08 -2.04 0.10 0.00 -0.57 0.00 0.00 43.02 40.43 1lud s PHE 3 CO 0.04 0.29 0.11 -1.17 -0.10 0.00 0.00 175.22 174.39 1lud s LEU 4 N 0.03 1.99 0.33 -0.37 2.96 -0.81 0.13 118.68 122.94 1lud s LEU 4 Ca 0.06 -1.66 0.06 0.00 -0.22 0.00 0.00 54.13 52.37 1lud s LEU 4 Cb -0.12 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.76 1lud s LEU 4 CO 0.01 -0.41 0.31 -1.66 -1.32 0.00 0.00 176.35 173.27 1lud s TRP 5 N 1.60 1.64 -0.01 5.38 -2.14 -0.50 -4.51 118.94 120.39 1lud s TRP 5 Ca 0.10 -1.60 0.03 0.00 2.66 0.00 0.00 56.10 57.29 1lud s TRP 5 Cb -0.18 -0.61 -0.00 0.00 -3.10 0.00 0.00 33.47 29.58 1lud s TRP 5 CO -0.25 -0.91 -0.09 0.00 -2.66 0.00 0.00 176.95 173.04 1lud s ALA 6 N -3.40 0.80 0.04 2.67 0.00 -1.26 -2.29 121.76 118.32 1lud s ALA 6 Ca 0.39 -0.36 -0.05 0.00 0.00 0.00 0.00 51.96 51.94 1lud s ALA 6 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1lud s ALA 6 CO 0.26 0.16 0.08 1.14 0.00 0.00 0.00 175.76 177.40 1lud s GLN 7 N -0.03 0.59 0.00 0.00 -2.07 0.12 -4.35 119.66 113.92 1lud s GLN 7 Ca 0.01 -0.83 0.00 0.00 -1.82 0.00 0.00 55.36 52.72 1lud s GLN 7 Cb -0.06 0.23 0.00 0.00 -1.09 0.00 0.00 33.01 32.09 1lud s GLN 7 CO -0.00 -0.14 0.00 -0.40 -1.32 0.00 0.00 175.29 173.43 1lud n ASP 8 N 0.66 0.00 -0.25 12.60 5.68 -1.20 -1.12 116.55 132.92 1lud n ASP 8 Ca -0.18 -0.67 -0.03 0.00 -0.50 0.00 0.00 54.79 53.40 1lud n ASP 8 Cb 0.59 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.65 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 0.85 -0.03 0.11 -0.00 -1.40 -2.09 114.38 111.80 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 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.97 29.76 1lud h ARG 9 CO 0.00 0.56 -0.56 -0.44 -0.00 0.00 0.00 179.97 179.53 1lud h ASP 10 N 0.87 0.11 0.00 0.08 3.32 -1.89 -3.47 116.42 115.44 1lud h ASP 10 Ca 0.29 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1lud h ASP 10 Cb 0.03 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1lud h ASP 10 CO -0.11 0.65 0.00 0.61 -1.72 0.00 0.00 179.24 178.67 1lud n GLY 11 N 0.11 0.98 3.91 2.75 0.00 -0.79 -5.10 105.19 107.06 1lud n GLY 11 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 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 3.99 0.05 0.99 2.96 -1.26 -3.66 118.68 121.75 1lud s LEU 12 Ca 0.00 0.70 0.00 0.00 -0.22 0.00 0.00 54.13 54.61 1lud s LEU 12 Cb 0.00 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.15 1lud s LEU 12 CO 0.00 -0.27 0.00 2.30 -1.32 0.00 0.00 176.35 177.06 1lud n ILE 13 N -1.28 0.46 -3.79 6.68 -5.35 -1.16 -3.21 119.36 111.72 1lud n ILE 13 Ca -0.02 0.15 -0.14 0.00 -0.27 0.00 0.00 62.75 62.48 1lud n ILE 13 Cb 0.55 -1.13 -0.15 0.00 -1.74 0.00 0.00 39.64 37.17 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 -3.54 0.03 -0.14 3.28 0.00 -1.24 -4.80 107.32 100.91 1lud s GLY 14 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 44.72 45.10 1lud s GLY 14 CO 0.00 0.63 -0.18 1.25 0.00 0.00 0.00 173.10 174.80 1lud s LYS 15 N 0.83 3.16 -1.32 2.90 2.20 -1.17 -4.16 119.74 122.17 1lud s LYS 15 Ca -0.07 -0.79 -0.00 0.00 -0.36 0.00 0.00 55.97 54.75 1lud s LYS 15 Cb -0.09 -2.52 -0.00 0.00 -1.51 0.00 0.00 37.83 33.70 1lud s LYS 15 CO -0.03 0.06 0.66 -0.25 -0.36 0.00 0.00 175.35 175.42 1lud n ASP 16 N 3.92 -1.05 0.00 1.43 8.00 -1.26 -3.68 116.55 123.90 1lud n ASP 16 Ca -0.19 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1lud n ASP 16 Cb 0.52 -3.91 0.00 0.00 -0.02 0.00 0.00 41.12 37.71 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 -1.63 2.25 0.00 0.44 0.00 -1.26 -4.88 105.19 100.11 1lud n GLY 17 Ca -0.30 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1lud n GLY 17 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1lud n HIS 18 N 0.00 -1.49 -4.41 1.61 1.44 -1.24 -4.94 115.22 106.18 1lud n HIS 18 Ca 0.00 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.46 1lud n HIS 18 Cb 0.00 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.01 1lud n HIS 18 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1lud s LEU 19 N 0.00 2.65 0.05 2.39 1.43 -1.26 -3.04 118.68 120.89 1lud s LEU 19 Ca 0.00 -0.88 -0.15 0.00 -1.03 0.00 0.00 54.13 52.07 1lud s LEU 19 Cb 0.00 -1.26 -0.31 0.00 0.03 0.00 0.00 46.19 44.66 1lud s LEU 19 CO 0.00 0.07 1.08 1.55 0.23 0.00 0.00 176.35 179.28 1lud h PRO 20 N 2.62 0.59 -5.28 1.29 0.14 -1.87 -3.45 132.00 126.04 1lud h PRO 20 Ca -0.43 -0.85 -0.63 0.00 0.14 0.00 0.00 66.00 64.22 1lud h PRO 20 Cb 1.23 0.29 -0.21 0.00 0.14 0.00 0.00 31.00 32.46 1lud h PRO 20 CO 0.55 1.39 -0.65 1.67 0.14 0.00 0.00 178.00 181.11 1lud s TRP 21 N -2.87 3.06 -0.66 1.56 -2.14 -1.26 -5.06 118.94 111.57 1lud s TRP 21 Ca -0.09 -0.25 -0.21 0.00 2.66 0.00 0.00 56.10 58.21 1lud s TRP 21 Cb 0.05 -1.99 0.09 0.00 -3.10 0.00 0.00 33.47 28.52 1lud s TRP 21 CO 0.94 -0.02 0.88 -1.58 -2.66 0.00 0.00 176.95 174.51 1lud s HIS 22 N 0.42 2.85 -0.26 1.66 2.46 -1.26 -4.98 115.29 116.18 1lud s HIS 22 Ca -0.02 -0.80 0.01 0.00 0.47 0.00 0.00 55.06 54.71 1lud s HIS 22 Cb -0.14 -4.19 0.07 0.00 -0.13 0.00 0.00 32.58 28.20 1lud s HIS 22 CO 0.02 -1.50 -0.01 -1.17 -2.47 0.00 0.00 174.74 169.62 1lud s LEU 23 N 3.38 2.71 0.24 8.88 2.96 -1.26 -4.98 118.68 130.60 1lud s LEU 23 Ca 0.19 -1.36 0.00 0.00 -0.22 0.00 0.00 54.13 52.74 1lud s LEU 23 Cb -0.18 -1.14 0.28 0.00 0.50 0.00 0.00 46.19 45.64 1lud s LEU 23 CO 0.06 -0.29 1.63 1.55 -1.32 0.00 0.00 176.35 177.98 1lud h PRO 24 N 7.95 0.51 0.00 0.98 0.14 -2.00 -2.76 132.00 136.82 1lud h PRO 24 Ca -0.15 -0.24 -0.03 0.00 0.14 0.00 0.00 66.00 65.71 1lud h PRO 24 Cb 1.06 -0.00 -0.00 0.00 0.14 0.00 0.00 31.00 32.19 1lud h PRO 24 CO 0.43 0.81 -0.17 0.22 0.14 0.00 0.00 178.00 179.43 1lud h ASP 25 N 0.42 0.00 0.06 1.44 3.58 -1.99 -2.81 116.42 117.12 1lud h ASP 25 Ca 0.04 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.33 1lud h ASP 25 Cb 0.86 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.92 1lud h ASP 25 CO 0.07 0.17 -0.66 -0.78 -2.88 0.00 0.00 179.24 175.15 1lud h ASP 26 N 0.00 0.47 -0.60 2.28 3.58 -1.91 -2.96 116.42 117.28 1lud h ASP 26 Ca -0.00 -0.85 0.09 0.00 0.42 0.00 0.00 57.03 56.68 1lud h ASP 26 Cb 0.49 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.32 1lud h ASP 26 CO 0.02 1.28 0.24 -0.07 -2.88 0.00 0.00 179.24 177.83 1lud h LEU 27 N -0.26 0.27 -1.15 2.28 3.38 -1.39 0.11 115.31 118.53 1lud h LEU 27 Ca -0.10 0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1lud h LEU 27 Cb 1.44 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 42.17 1lud h LEU 27 CO 0.13 0.17 0.58 0.45 0.09 0.00 0.00 178.44 179.85 1lud h HIS 28 N 0.44 1.06 -0.38 1.13 3.86 -1.56 0.58 115.15 120.28 1lud h HIS 28 Ca 0.30 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.50 1lud h HIS 28 Cb 0.34 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1lud h HIS 28 CO -0.15 0.61 0.09 -0.92 0.86 0.00 0.00 177.93 178.42 1lud h TYR 29 N 1.09 0.56 -0.10 2.45 3.20 -0.67 -0.43 116.97 123.06 1lud h TYR 29 Ca 0.36 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.17 1lud h TYR 29 Cb 0.05 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 1lud h TYR 29 CO -0.00 0.49 -0.03 0.35 -1.64 0.00 0.00 178.16 177.33 1lud h PHE 30 N 0.54 0.21 0.62 -3.82 3.57 0.37 -0.76 116.94 117.68 1lud h PHE 30 Ca 0.13 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1lud h PHE 30 Cb 0.21 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 38.90 1lud h PHE 30 CO 0.01 0.51 -0.30 -0.09 -2.23 0.00 0.00 178.31 176.21 1lud h ARG 31 N -0.14 -0.81 -1.02 1.11 2.43 -0.91 -2.03 114.38 113.00 1lud h ARG 31 Ca 0.02 0.06 0.26 0.00 -0.81 0.00 0.00 59.98 59.51 1lud h ARG 31 Cb 0.44 0.18 -0.11 0.00 -0.42 0.00 0.00 29.97 30.06 1lud h ARG 31 CO 0.01 -0.54 0.63 0.00 -1.51 0.00 0.00 179.97 178.56 1lud h ALA 32 N -1.53 1.97 0.00 2.80 0.00 -1.17 0.85 119.26 122.18 1lud h ALA 32 Ca -0.09 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1lud h ALA 32 Cb 0.64 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1lud h ALA 32 CO 0.14 -0.43 0.00 1.96 0.00 0.00 0.00 179.25 180.92 1lud h GLN 33 N 0.50 0.00 -0.05 0.00 1.08 -0.93 -3.03 115.11 112.68 1lud h GLN 33 Ca 0.63 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.81 1lud h GLN 33 Cb 1.36 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.78 1lud h GLN 33 CO -0.41 0.00 -0.37 0.25 -0.95 0.00 0.00 178.83 177.35 1lud n THR 34 N -2.54 2.21 -2.49 -0.54 -2.24 0.29 -4.90 114.28 104.07 1lud n THR 34 Ca 0.02 -3.02 -0.43 0.00 -2.27 0.00 0.00 64.05 58.35 1lud n THR 34 Cb 0.28 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 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 -3.18 4.18 -0.27 2.28 -7.23 -0.74 -3.04 120.40 112.39 1lud s VAL 35 Ca 0.38 1.30 0.00 0.00 -1.81 0.00 0.00 61.98 61.85 1lud s VAL 35 Cb 0.36 -4.31 0.00 0.00 0.56 0.00 0.00 36.38 32.99 1lud s VAL 35 CO -0.04 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 174.71 1lud n GLY 36 N 4.48 0.58 3.51 2.32 0.00 -1.26 -5.00 105.19 109.81 1lud n GLY 36 Ca 0.14 -0.41 -0.25 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 -1.46 1.82 -0.20 1.61 1.02 -1.17 -4.60 119.74 116.75 1lud s LYS 37 Ca 0.00 -1.61 -0.29 0.00 0.02 0.00 0.00 55.97 54.09 1lud s LYS 37 Cb 0.00 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.39 1lud s LYS 37 CO 0.00 0.36 1.41 0.42 -0.92 0.00 0.00 175.35 176.62 1lud s ILE 38 N -2.26 4.01 -0.35 2.17 1.01 -1.07 -4.01 121.20 120.69 1lud s ILE 38 Ca 0.28 1.17 -0.10 0.00 0.00 0.00 0.00 60.65 62.01 1lud s ILE 38 Cb -0.06 -3.90 0.02 0.00 0.01 0.00 0.00 42.46 38.52 1lud s ILE 38 CO 0.15 -0.26 0.18 -0.32 0.00 0.00 0.00 174.94 174.69 1lud s MET 39 N 4.06 3.01 -0.27 2.79 1.75 -0.99 -0.66 119.30 128.98 1lud s MET 39 Ca 0.62 -0.95 -0.14 0.00 -1.25 0.00 0.00 55.69 53.97 1lud s MET 39 Cb -0.22 -3.65 -0.04 0.00 2.84 0.00 0.00 34.83 33.76 1lud s MET 39 CO 0.23 -0.59 0.31 0.08 -0.65 0.00 0.00 175.02 174.40 1lud s VAL 40 N 1.57 5.22 -0.05 10.11 1.01 -0.71 0.23 120.40 137.77 1lud s VAL 40 Ca 0.03 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.47 1lud s VAL 40 Cb -0.18 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.57 1lud s VAL 40 CO 0.06 0.19 -0.10 0.68 0.00 0.00 0.00 175.10 175.93 1lud s VAL 41 N 1.94 0.95 0.38 2.92 -7.23 -1.04 -0.32 120.40 117.99 1lud s VAL 41 Ca 0.12 -0.39 -0.26 0.00 -1.81 0.00 0.00 61.98 59.64 1lud s VAL 41 Cb -0.16 -0.87 -0.11 0.00 0.56 0.00 0.00 36.38 35.80 1lud s VAL 41 CO 0.10 0.31 1.22 0.61 -0.31 0.00 0.00 175.10 177.02 1lud n GLY 42 N 3.73 0.38 0.34 2.32 0.00 0.23 -2.55 105.19 109.64 1lud n GLY 42 Ca -0.22 0.25 0.14 0.00 0.00 0.00 0.00 46.02 46.18 1lud n GLY 42 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1lud h ARG 43 N 2.18 0.00 0.14 1.61 1.12 -1.15 0.87 114.38 119.15 1lud h ARG 43 Ca -0.46 0.00 -0.26 0.00 -1.11 0.00 0.00 59.98 58.15 1lud h ARG 43 Cb 1.30 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.27 1lud h ARG 43 CO 0.60 0.00 -1.29 0.00 -3.11 0.00 0.00 179.97 176.17 1lud h ARG 44 N 0.00 0.29 -0.24 0.20 3.08 -1.87 -2.72 114.38 113.12 1lud h ARG 44 Ca 0.00 -0.50 -0.09 0.00 0.07 0.00 0.00 59.98 59.47 1lud h ARG 44 Cb 0.80 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 1lud h ARG 44 CO -0.00 1.24 -0.19 1.15 -1.07 0.00 0.00 179.97 181.10 1lud h THR 45 N -0.26 1.31 -0.89 2.04 2.02 -1.49 -1.84 112.91 113.80 1lud h THR 45 Ca -0.26 -1.32 0.09 0.00 0.77 0.00 0.00 66.41 65.69 1lud h THR 45 Cb 1.79 1.64 -0.07 0.00 -1.74 0.00 0.00 68.15 69.76 1lud h THR 45 CO 0.11 0.41 0.53 0.22 0.37 0.00 0.00 175.52 177.16 1lud h TYR 46 N 0.26 0.97 0.00 3.16 3.20 -1.03 0.96 116.97 124.50 1lud h TYR 46 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1lud h TYR 46 Cb 0.73 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.69 1lud h TYR 46 CO 0.07 0.42 0.00 0.39 -1.64 0.00 0.00 178.16 177.40 1lud n GLU 47 N -4.68 0.20 -0.02 1.82 1.02 -1.02 -2.40 120.64 115.57 1lud n GLU 47 Ca 0.15 0.38 0.07 0.00 -0.02 0.00 0.00 57.16 57.74 1lud n GLU 47 Cb 0.28 -1.86 -0.15 0.00 -0.02 0.00 0.00 31.44 29.68 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 -2.23 0.08 -4.11 1.62 3.41 0.19 -4.99 113.62 107.60 1lud n SER 48 Ca 0.03 0.03 -0.35 0.00 -0.26 0.00 0.00 58.87 58.32 1lud n SER 48 Cb 0.26 1.66 0.06 0.00 -0.26 0.00 0.00 64.21 65.93 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 -2.40 -4.25 -0.04 7.33 3.01 0.27 -4.95 117.46 116.45 1lud n PHE 49 Ca -0.09 0.03 -0.00 0.00 1.01 0.00 0.00 57.45 58.40 1lud n PHE 49 Cb 0.68 -1.52 -0.00 0.00 -0.01 0.00 0.00 39.48 38.63 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 -1.13 0.00 -4.70 -1.08 0.14 -1.90 -3.45 132.00 119.87 1lud h PRO 50 Ca -0.44 0.00 -0.66 0.00 0.14 0.00 0.00 66.00 65.04 1lud h PRO 50 Cb 1.30 0.00 -0.38 0.00 0.14 0.00 0.00 31.00 32.05 1lud h PRO 50 CO 0.26 0.00 -0.77 0.15 0.14 0.00 0.00 178.00 177.78 1lud s LYS 51 N -1.41 1.84 -0.02 0.86 1.02 -1.26 -5.10 119.74 115.67 1lud s LYS 51 Ca -0.01 -1.50 0.07 0.00 0.02 0.00 0.00 55.97 54.55 1lud s LYS 51 Cb 0.00 -2.95 -0.02 0.00 -0.52 0.00 0.00 37.83 34.35 1lud s LYS 51 CO 0.01 -0.73 -0.23 1.03 -0.92 0.00 0.00 175.35 174.51 1lud s ARG 52 N 1.07 1.97 0.73 1.68 3.00 -1.26 -4.18 118.95 121.97 1lud s ARG 52 Ca -0.01 -0.84 -0.05 0.00 0.00 0.00 0.00 55.73 54.83 1lud s ARG 52 Cb -0.19 -1.87 0.11 0.00 0.00 0.00 0.00 34.95 32.99 1lud s ARG 52 CO -0.07 0.48 1.03 -1.25 0.00 0.00 0.00 175.30 175.49 1lud s PRO 53 N -0.49 1.78 0.50 3.54 0.04 -1.26 -5.13 135.00 133.97 1lud s PRO 53 Ca 0.07 -0.68 -0.19 0.00 0.04 0.00 0.00 61.00 60.23 1lud s PRO 53 Cb -0.10 -2.22 -0.08 0.00 0.04 0.00 0.00 34.50 32.14 1lud s PRO 53 CO -0.00 -1.45 1.02 -0.51 0.04 0.00 0.00 177.00 176.10 1lud s LEU 54 N -5.25 3.79 0.18 -3.56 1.43 -1.26 -5.01 118.68 109.00 1lud s LEU 54 Ca 0.64 1.84 -0.30 0.00 -1.03 0.00 0.00 54.13 55.28 1lud s LEU 54 Cb -0.07 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.52 1lud s LEU 54 CO 0.45 -0.75 1.13 -2.16 0.23 0.00 0.00 176.35 175.25 1lud s PRO 55 N -3.43 4.56 -1.53 1.29 0.04 -1.26 -3.62 135.00 131.06 1lud s PRO 55 Ca 0.65 1.76 -0.15 0.00 0.04 0.00 0.00 61.00 63.30 1lud s PRO 55 Cb -0.14 -3.27 0.12 0.00 0.04 0.00 0.00 34.50 31.25 1lud s PRO 55 CO 0.22 0.03 0.72 0.39 0.04 0.00 0.00 177.00 178.40 1lud n GLU 56 N 2.42 -3.59 -3.82 4.56 1.02 -1.26 -4.94 120.64 115.04 1lud n GLU 56 Ca 0.03 0.43 -0.13 0.00 -0.02 0.00 0.00 57.16 57.47 1lud n GLU 56 Cb 0.46 -5.18 -0.14 0.00 -0.02 0.00 0.00 31.44 26.55 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 -6.58 0.04 -0.18 3.49 3.00 -1.24 -4.13 118.95 113.35 1lud s ARG 57 Ca 0.62 0.15 -0.26 0.00 0.00 0.00 0.00 55.73 56.24 1lud s ARG 57 Cb -0.33 -0.08 -0.01 0.00 0.00 0.00 0.00 34.95 34.53 1lud s ARG 57 CO 0.77 -0.07 0.87 0.99 0.00 0.00 0.00 175.30 177.85 1lud s THR 58 N 0.48 4.84 0.00 0.02 2.01 -1.26 -4.67 115.64 117.06 1lud s THR 58 Ca -0.04 1.71 0.06 0.00 0.31 0.00 0.00 61.69 63.73 1lud s THR 58 Cb -0.05 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.27 1lud s THR 58 CO -0.02 -0.02 -0.18 0.20 -0.69 0.00 0.00 174.62 173.91 1lud s ASN 59 N 1.19 2.15 -0.06 3.53 0.01 -1.26 -2.35 114.94 118.15 1lud s ASN 59 Ca 0.39 -0.38 0.05 0.00 -0.71 0.00 0.00 52.86 52.21 1lud s ASN 59 Cb -0.16 -0.22 -0.00 0.00 0.41 0.00 0.00 41.25 41.27 1lud s ASN 59 CO 0.11 0.19 -0.21 -0.69 -1.51 0.00 0.00 177.10 175.00 1lud s VAL 60 N -0.53 1.72 0.09 1.60 1.01 0.14 -0.24 120.40 124.18 1lud s VAL 60 Ca 0.07 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1lud s VAL 60 Cb -0.07 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 1lud s VAL 60 CO -0.00 0.49 0.18 -0.69 0.00 0.00 0.00 175.10 175.07 1lud s VAL 61 N 0.04 5.04 -0.19 2.92 1.01 -1.05 -2.51 120.40 125.66 1lud s VAL 61 Ca -0.06 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 1lud s VAL 61 Cb -0.13 -3.48 0.01 0.00 0.00 0.00 0.00 36.38 32.78 1lud s VAL 61 CO 0.04 0.07 -0.17 -0.22 0.00 0.00 0.00 175.10 174.83 1lud s LEU 62 N -2.65 2.30 0.09 3.92 2.96 -1.06 -1.94 118.68 122.31 1lud s LEU 62 Ca 0.33 -0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 1lud s LEU 62 Cb -0.12 -1.54 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 1lud s LEU 62 CO 0.26 -0.01 0.14 0.28 -1.32 0.00 0.00 176.35 175.70 1lud s THR 63 N 1.33 0.15 -2.31 3.68 -1.32 -1.11 -0.48 115.64 115.59 1lud s THR 63 Ca 0.05 -1.39 0.21 0.00 -1.21 0.00 0.00 61.69 59.35 1lud s THR 63 Cb -0.13 -1.46 0.44 0.00 -1.51 0.00 0.00 72.50 69.84 1lud s THR 63 CO -0.11 -0.70 1.45 1.41 -2.21 0.00 0.00 174.62 174.46 1lud n HIS 64 N -0.03 0.43 -2.11 9.09 8.25 -1.26 -4.35 115.22 125.24 1lud n HIS 64 Ca -0.14 -0.22 -0.28 0.00 -0.26 0.00 0.00 57.72 56.83 1lud n HIS 64 Cb 0.62 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.90 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 -1.57 0.92 0.00 -0.41 1.11 -1.26 -5.03 119.66 113.42 1lud s GLN 65 Ca 0.35 -0.61 0.00 0.00 0.01 0.00 0.00 55.36 55.11 1lud s GLN 65 Cb 0.20 -1.98 0.00 0.00 -1.01 0.00 0.00 33.01 30.22 1lud s GLN 65 CO 0.28 -2.16 0.00 0.39 0.01 0.00 0.00 175.29 173.81 1lud n GLU 66 N -3.51 0.53 -1.23 2.91 -0.58 -1.26 -4.71 120.64 112.79 1lud n GLU 66 Ca 0.15 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.74 1lud n GLU 66 Cb 0.60 -0.98 0.13 0.00 -0.57 0.00 0.00 31.44 30.62 1lud n GLU 66 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1lud n ASP 67 N -1.49 4.01 -4.66 1.62 2.03 -1.26 -5.01 116.55 111.79 1lud n ASP 67 Ca 0.00 -3.78 -0.42 0.00 0.52 0.00 0.00 54.79 51.11 1lud n ASP 67 Cb 0.04 -0.63 -0.03 0.00 -0.72 0.00 0.00 41.12 39.78 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 -3.45 1.24 -0.36 -0.67 5.04 -1.26 -4.94 117.35 112.96 1lud s TYR 68 Ca 0.50 -0.42 -0.11 0.00 -2.44 0.00 0.00 57.07 54.61 1lud s TYR 68 Cb 0.43 -4.24 0.02 0.00 0.35 0.00 0.00 41.96 38.52 1lud s TYR 68 CO 0.01 -5.54 0.19 -0.65 -1.34 0.00 0.00 175.55 168.22 1lud s GLN 69 N 4.61 2.93 -0.43 4.97 -1.52 -1.26 -5.00 119.66 123.96 1lud s GLN 69 Ca 0.90 -1.01 0.03 0.00 -1.95 0.00 0.00 55.36 53.33 1lud s GLN 69 Cb -0.42 -3.69 0.16 0.00 -0.22 0.00 0.00 33.01 28.84 1lud s GLN 69 CO 0.42 -0.64 0.33 0.00 -0.25 0.00 0.00 175.29 175.14 1lud s ALA 70 N 1.56 1.56 -0.01 6.09 0.00 -1.26 -5.10 121.76 124.61 1lud s ALA 70 Ca 0.02 -2.48 -0.30 0.00 0.00 0.00 0.00 51.96 49.20 1lud s ALA 70 Cb -0.19 -1.66 -0.06 0.00 0.00 0.00 0.00 23.12 21.22 1lud s ALA 70 CO 0.07 -2.01 1.54 -0.65 0.00 0.00 0.00 175.76 174.70 1lud s GLN 71 N 0.11 4.23 0.00 0.00 -1.52 -1.26 -2.60 119.66 118.61 1lud s GLN 71 Ca 0.29 2.11 0.00 0.00 -1.95 0.00 0.00 55.36 55.81 1lud s GLN 71 Cb -0.03 -3.72 0.00 0.00 -0.22 0.00 0.00 33.01 29.05 1lud s GLN 71 CO -0.15 -0.71 0.00 0.41 -0.25 0.00 0.00 175.29 174.59 1lud n GLY 72 N 3.88 2.68 3.54 3.09 0.00 -1.26 -5.05 105.19 112.08 1lud n GLY 72 Ca 0.15 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.00 2.86 1.01 4.61 0.00 -1.07 -4.84 121.76 123.33 1lud s ALA 73 Ca 0.00 -1.00 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 1lud s ALA 73 Cb 0.00 -1.06 0.20 0.00 0.00 0.00 0.00 23.12 22.26 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 1.92 0.00 -3.71 0.00 0.31 0.66 -4.74 118.33 112.78 1lud n VAL 74 Ca -0.17 -0.16 -0.11 0.00 -0.01 0.00 0.00 64.34 63.90 1lud n VAL 74 Cb 0.52 -0.99 -0.11 0.00 -0.91 0.00 0.00 33.84 32.35 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 -2.55 -0.02 0.13 2.52 1.01 -1.26 -2.54 120.40 117.68 1lud s VAL 75 Ca 0.67 0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.68 1lud s VAL 75 Cb -0.24 -0.57 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1lud s VAL 75 CO 0.61 0.04 0.19 0.68 0.00 0.00 0.00 175.10 176.61 1lud s VAL 76 N 1.23 0.10 -0.01 2.92 -7.23 -0.82 -4.92 120.40 111.68 1lud s VAL 76 Ca -0.08 -1.49 0.23 0.00 -1.81 0.00 0.00 61.98 58.83 1lud s VAL 76 Cb -0.08 -1.75 0.39 0.00 0.56 0.00 0.00 36.38 35.50 1lud s VAL 76 CO -0.11 -0.46 1.16 1.41 -0.31 0.00 0.00 175.10 176.79 1lud n HIS 77 N -0.13 0.00 -3.19 2.82 8.25 -1.26 -2.74 115.22 118.97 1lud n HIS 77 Ca -0.09 -0.49 0.04 0.00 -0.26 0.00 0.00 57.72 56.92 1lud n HIS 77 Cb 0.63 -0.14 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.95 -0.95 0.50 0.41 1.01 -1.26 -4.92 116.67 109.51 1lud s ASP 78 Ca 0.31 0.66 0.42 0.00 0.71 0.00 0.00 52.55 54.65 1lud s ASP 78 Cb 0.35 1.82 1.62 0.00 1.01 0.00 0.00 42.92 47.73 1lud s ASP 78 CO -0.15 -0.18 1.57 0.58 0.21 0.00 0.00 175.17 177.21 1lud h VAL 79 N 5.70 0.00 -0.71 -1.27 2.07 -1.99 0.83 116.25 120.87 1lud h VAL 79 Ca -0.19 -0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.39 1lud h VAL 79 Cb 1.16 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 1lud h VAL 79 CO 0.10 0.00 0.42 0.00 0.02 0.00 0.00 177.57 178.11 1lud h ALA 80 N 1.31 0.95 -0.16 1.67 0.00 -2.00 -1.82 119.26 119.21 1lud h ALA 80 Ca 0.92 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.80 1lud h ALA 80 Cb 3.32 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 20.94 1lud h ALA 80 CO -0.25 0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.11 1lud h ALA 81 N 1.35 0.22 -0.81 0.00 0.00 0.27 -2.98 119.26 117.31 1lud h ALA 81 Ca 0.31 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 55.11 1lud h ALA 81 Cb 0.15 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 1lud h ALA 81 CO -0.16 -0.04 0.43 0.28 0.00 0.00 0.00 179.25 179.75 1lud h VAL 82 N 0.02 0.82 -0.86 0.00 2.07 -1.34 -0.61 116.25 116.35 1lud h VAL 82 Ca 0.04 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.34 1lud h VAL 82 Cb 0.43 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1lud h VAL 82 CO 0.01 0.12 0.56 -0.26 0.02 0.00 0.00 177.57 178.03 1lud h PHE 83 N 0.68 1.09 0.67 1.57 0.04 -1.25 -2.97 116.94 116.76 1lud h PHE 83 Ca 0.41 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.18 1lud h PHE 83 Cb 0.48 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1lud h PHE 83 CO -0.09 0.69 -0.48 0.00 -0.60 0.00 0.00 178.31 177.83 1lud h ALA 84 N 1.45 -1.17 -0.65 2.45 0.00 -0.96 -1.90 119.26 118.48 1lud h ALA 84 Ca 0.31 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1lud h ALA 84 Cb -0.12 0.63 -0.11 0.00 0.00 0.00 0.00 17.79 18.18 1lud h ALA 84 CO -0.07 -1.18 -0.46 -0.92 0.00 0.00 0.00 179.25 176.62 1lud h TYR 85 N -1.10 -1.36 -0.54 0.00 3.20 -1.36 0.21 116.97 116.02 1lud h TYR 85 Ca -0.09 0.09 0.08 0.00 3.14 0.00 0.00 58.73 61.96 1lud h TYR 85 Cb 0.91 0.68 -0.07 0.00 1.54 0.00 0.00 36.73 39.79 1lud h TYR 85 CO -0.15 -0.42 0.16 0.00 -1.64 0.00 0.00 178.16 176.11 1lud h ALA 86 N 0.63 0.65 0.00 1.82 0.00 -1.44 0.27 119.26 121.18 1lud h ALA 86 Ca 0.18 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1lud h ALA 86 Cb 0.55 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1lud h ALA 86 CO -0.73 -0.24 -0.10 0.87 0.00 0.00 0.00 179.25 179.04 1lud h LYS 87 N 0.33 0.00 0.00 0.00 1.79 -0.12 -2.63 116.57 115.93 1lud h LYS 87 Ca 0.27 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.51 1lud h LYS 87 Cb 0.33 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.94 1lud h LYS 87 CO -0.30 0.10 -1.44 1.96 -1.08 0.00 0.00 179.45 178.69 1lud h GLN 88 N 0.00 0.00 -5.57 3.15 4.20 0.23 -3.44 115.11 113.68 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 0.25 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 27.91 1lud h GLN 88 CO 0.01 0.48 0.21 -1.01 -0.67 0.00 0.00 178.83 177.86 1lud s HIS 89 N -2.75 3.18 -2.18 2.96 3.76 0.62 -4.90 115.29 115.99 1lud s HIS 89 Ca -0.03 0.53 0.26 0.00 -0.15 0.00 0.00 55.06 55.67 1lud s HIS 89 Cb 0.08 -3.12 1.30 0.00 1.11 0.00 0.00 32.58 31.95 1lud s HIS 89 CO 0.81 -0.57 1.86 -0.35 -0.85 0.00 0.00 174.74 175.65 1lud n PRO 90 N 6.05 1.30 -0.05 8.40 -0.04 -1.26 -3.54 135.00 145.85 1lud n PRO 90 Ca 0.00 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.02 1lud n PRO 90 Cb 0.49 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.41 0.38 -3.48 3.54 9.92 -1.26 -5.01 116.55 120.22 1lud n ASP 91 Ca 0.19 -1.31 -0.13 0.00 -0.53 0.00 0.00 54.79 53.01 1lud n ASP 91 Cb 0.20 -0.03 -0.11 0.00 -0.64 0.00 0.00 41.12 40.54 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 -0.23 0.25 0.00 -1.24 0.74 -1.23 -4.91 119.66 113.04 1lud s GLN 92 Ca 0.01 0.48 0.00 0.00 0.05 0.00 0.00 55.36 55.90 1lud s GLN 92 Cb 0.01 -0.62 0.00 0.00 1.10 0.00 0.00 33.01 33.50 1lud s GLN 92 CO 0.00 -0.56 0.00 0.39 -0.55 0.00 0.00 175.29 174.57 1lud n GLU 93 N 5.35 0.61 -3.60 1.67 1.02 -1.26 -4.52 120.64 119.90 1lud n GLU 93 Ca -0.05 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.70 1lud n GLU 93 Cb 0.50 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.81 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 4.09 -0.10 -4.62 2.96 -1.26 -2.61 118.68 117.13 1lud s LEU 94 Ca 0.00 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 1lud s LEU 94 Cb 0.00 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.61 1lud s LEU 94 CO 0.00 -0.11 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.01 1lud s VAL 95 N 1.72 1.89 0.23 1.68 1.01 0.16 -0.83 120.40 126.26 1lud s VAL 95 Ca 0.06 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 1lud s VAL 95 Cb -0.16 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.49 1lud s VAL 95 CO 0.09 0.52 0.56 -0.63 0.00 0.00 0.00 175.10 175.65 1lud s ILE 96 N 0.50 4.91 0.00 2.22 -1.09 0.41 -1.74 121.20 126.42 1lud s ILE 96 Ca -0.16 0.51 0.00 0.00 -2.23 0.00 0.00 60.65 58.77 1lud s ILE 96 Cb -0.17 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 37.09 1lud s ILE 96 CO 0.06 -0.07 0.30 0.00 -1.23 0.00 0.00 174.94 174.00 1lud n ALA 97 N -0.14 1.25 0.00 9.38 0.00 0.57 -1.93 120.51 129.64 1lud n ALA 97 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.14 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 -0.03 -1.13 0.00 0.00 0.00 -0.99 -4.85 105.19 98.18 1lud n GLY 98 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.23 0.32 -0.02 0.00 -1.26 -0.60 105.19 102.40 1lud n GLY 99 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 46.02 44.87 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 1.35 -0.86 4.61 0.00 -1.92 -2.20 119.26 118.24 1lud h ALA 100 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1lud h ALA 100 Cb 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 1lud h ALA 100 CO 0.00 0.51 0.56 1.96 0.00 0.00 0.00 179.25 182.28 1lud h GLN 101 N 0.87 1.08 0.00 0.00 4.20 -1.94 -2.05 115.11 117.27 1lud h GLN 101 Ca 0.22 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.77 1lud h GLN 101 Cb 0.10 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 1lud h GLN 101 CO -0.03 0.71 -0.42 0.82 -0.67 0.00 0.00 178.83 179.24 1lud h ILE 102 N 1.11 0.81 0.00 2.54 1.08 -1.64 -3.00 117.51 118.40 1lud h ILE 102 Ca 0.34 -1.88 -0.03 0.00 -0.39 0.00 0.00 64.86 62.89 1lud h ILE 102 Cb -0.04 2.21 -0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1lud h ILE 102 CO -0.10 0.42 -0.16 -0.26 -0.69 0.00 0.00 178.15 177.35 1lud h PHE 103 N 0.00 0.00 0.04 1.37 0.04 -0.80 -2.70 116.94 114.89 1lud h PHE 103 Ca -0.00 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 1lud h PHE 103 Cb 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1lud h PHE 103 CO 0.00 0.16 -0.30 1.15 -0.60 0.00 0.00 178.31 178.72 1lud h THR 104 N 0.00 1.67 -0.32 -1.55 2.02 -1.31 -0.83 112.91 112.60 1lud h THR 104 Ca -0.00 -2.40 -0.03 0.00 0.77 0.00 0.00 66.41 64.75 1lud h THR 104 Cb 0.74 3.29 -0.02 0.00 -1.74 0.00 0.00 68.15 70.43 1lud h THR 104 CO 0.02 0.63 0.08 0.00 0.37 0.00 0.00 175.52 176.62 1lud h ALA 105 N 0.00 1.55 -0.01 6.16 0.00 -1.55 -2.02 119.26 123.39 1lud h ALA 105 Ca -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1lud h ALA 105 Cb 1.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1lud h ALA 105 CO 0.04 0.34 -0.33 1.19 0.00 0.00 0.00 179.25 180.49 1lud n PHE 106 N -4.36 0.00 -0.35 0.00 3.01 -1.02 -4.36 117.46 110.38 1lud n PHE 106 Ca 0.02 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.59 1lud n PHE 106 Cb 0.17 -0.05 0.30 0.00 -0.01 0.00 0.00 39.48 39.89 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 2.04 0.74 -0.49 -1.08 2.10 -0.36 -0.40 116.57 119.12 1lud h LYS 107 Ca 0.00 -0.04 -0.07 0.00 -2.00 0.00 0.00 60.65 58.54 1lud h LYS 107 Cb 0.65 -0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 31.79 1lud h LYS 107 CO 0.00 0.49 0.03 0.22 -2.00 0.00 0.00 179.45 178.19 1lud h ASP 108 N 0.76 0.75 -3.79 7.07 3.58 -1.76 -3.34 116.42 119.69 1lud h ASP 108 Ca 0.56 -0.17 -0.79 0.00 0.42 0.00 0.00 57.03 57.05 1lud h ASP 108 Cb 0.83 -0.20 -0.27 0.00 1.72 0.00 0.00 39.33 41.41 1lud h ASP 108 CO -0.37 0.80 0.14 -0.62 -2.88 0.00 0.00 179.24 176.30 1lud s ASP 109 N -6.63 6.78 -0.04 2.28 2.15 -0.16 -5.03 116.67 116.03 1lud s ASP 109 Ca -0.09 -2.88 0.07 0.00 0.43 0.00 0.00 52.55 50.08 1lud s ASP 109 Cb 0.15 -2.19 -0.02 0.00 -0.30 0.00 0.00 42.92 40.56 1lud s ASP 109 CO 0.81 -0.51 -0.25 -0.69 -0.17 0.00 0.00 175.17 174.36 1lud s VAL 110 N -0.13 2.08 0.00 1.11 1.01 -1.26 -4.54 120.40 118.68 1lud s VAL 110 Ca 0.20 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1lud s VAL 110 Cb -0.10 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.54 1lud s VAL 110 CO -0.09 0.58 0.00 0.47 0.00 0.00 0.00 175.10 176.06 1lud n ASP 111 N 2.65 2.63 -3.73 3.32 9.92 0.46 -4.76 116.55 127.03 1lud n ASP 111 Ca -0.17 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 53.94 1lud n ASP 111 Cb 0.51 0.12 -0.15 0.00 -0.64 0.00 0.00 41.12 40.96 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 -1.60 -0.10 -0.15 -3.53 2.01 -1.07 -2.55 115.64 108.66 1lud s THR 112 Ca 0.00 0.25 -0.03 0.00 0.31 0.00 0.00 61.69 62.21 1lud s THR 112 Cb 0.00 -0.20 -0.03 0.00 0.01 0.00 0.00 72.50 72.28 1lud s THR 112 CO 0.00 0.10 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.23 1lud s LEU 113 N 1.44 3.20 -0.27 4.42 1.43 -0.89 0.47 118.68 128.49 1lud s LEU 113 Ca -0.06 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 1lud s LEU 113 Cb -0.12 -1.77 0.07 0.00 0.03 0.00 0.00 46.19 44.41 1lud s LEU 113 CO -0.05 0.18 -0.03 -0.76 0.23 0.00 0.00 176.35 175.92 1lud s LEU 114 N 0.31 3.11 -0.02 1.79 1.43 0.35 -0.35 118.68 125.30 1lud s LEU 114 Ca -0.04 -1.45 0.07 0.00 -1.03 0.00 0.00 54.13 51.67 1lud s LEU 114 Cb -0.14 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 1lud s LEU 114 CO 0.03 -0.28 -0.23 0.54 0.23 0.00 0.00 176.35 176.65 1lud s VAL 115 N 1.27 1.82 -0.31 -1.59 0.11 -0.57 -1.41 120.40 119.73 1lud s VAL 115 Ca -0.01 -0.98 -0.07 0.00 -2.93 0.00 0.00 61.98 57.99 1lud s VAL 115 Cb -0.19 -1.52 0.02 0.00 -1.53 0.00 0.00 36.38 33.16 1lud s VAL 115 CO -0.08 0.51 0.08 -0.89 -3.33 0.00 0.00 175.10 171.39 1lud s THR 116 N -0.48 3.88 -0.32 5.04 2.01 -0.97 -1.04 115.64 123.75 1lud s THR 116 Ca 0.07 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.10 1lud s THR 116 Cb -0.09 -3.05 -0.02 0.00 0.01 0.00 0.00 72.50 69.34 1lud s THR 116 CO -0.00 0.02 0.35 -0.13 -0.69 0.00 0.00 174.62 174.16 1lud s ARG 117 N 1.47 3.68 0.41 4.92 0.52 -0.85 0.13 118.95 129.22 1lud s ARG 117 Ca 0.01 -0.33 -0.14 0.00 -0.52 0.00 0.00 55.73 54.76 1lud s ARG 117 Cb -0.18 -3.77 -0.08 0.00 0.52 0.00 0.00 34.95 31.45 1lud s ARG 117 CO 0.02 -0.45 0.83 -0.51 0.02 0.00 0.00 175.30 175.21 1lud s LEU 118 N 2.01 3.85 0.23 2.53 1.02 -0.27 -1.88 118.68 126.16 1lud s LEU 118 Ca 0.12 1.32 0.14 0.00 0.02 0.00 0.00 54.13 55.73 1lud s LEU 118 Cb -0.16 -4.19 0.00 0.00 0.02 0.00 0.00 46.19 41.86 1lud s LEU 118 CO 0.11 -0.39 1.33 0.00 0.02 0.00 0.00 176.35 177.42 1lud h ALA 119 N 1.48 0.64 -2.49 4.21 0.00 -0.45 -2.89 119.26 119.74 1lud h ALA 119 Ca -0.47 -0.57 -0.46 0.00 0.00 0.00 0.00 54.91 53.41 1lud h ALA 119 Cb 1.18 -0.03 0.13 0.00 0.00 0.00 0.00 17.79 19.07 1lud h ALA 119 CO 0.63 0.74 0.30 0.20 0.00 0.00 0.00 179.25 181.13 1lud s GLY 120 N -4.54 1.58 -0.18 0.00 0.00 -1.18 -4.74 107.32 98.26 1lud s GLY 120 Ca 0.03 -0.52 0.01 0.00 0.00 0.00 0.00 44.72 44.24 1lud s GLY 120 CO 0.76 0.03 -0.14 -1.35 0.00 0.00 0.00 173.10 172.40 1lud s SER 121 N -4.04 3.14 0.30 1.64 1.04 -1.26 -2.98 113.70 111.54 1lud s SER 121 Ca 0.64 -0.72 0.09 0.00 0.48 0.00 0.00 55.95 56.44 1lud s SER 121 Cb -0.15 -1.30 -0.04 0.00 0.10 0.00 0.00 66.02 64.63 1lud s SER 121 CO 0.53 -0.08 0.05 -0.36 0.98 0.00 0.00 173.24 174.37 1lud s PHE 122 N 1.38 2.68 0.26 5.02 0.40 -1.26 -5.05 117.98 121.42 1lud s PHE 122 Ca 0.02 -0.31 0.09 0.00 -0.60 0.00 0.00 56.93 56.13 1lud s PHE 122 Cb -0.14 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.94 1lud s PHE 122 CO -0.10 0.50 0.01 -1.83 0.70 0.00 0.00 175.22 174.50 1lud s GLU 123 N -3.74 2.35 0.00 0.44 -1.05 -1.26 -4.86 118.70 110.57 1lud s GLU 123 Ca 0.34 -1.37 0.00 0.00 -0.15 0.00 0.00 54.97 53.79 1lud s GLU 123 Cb -0.04 -2.21 0.00 0.00 -0.44 0.00 0.00 34.13 31.44 1lud s GLU 123 CO 0.21 0.37 0.00 0.41 0.95 0.00 0.00 175.26 177.20 1lud n GLY 124 N -0.87 1.12 0.00 -3.83 0.00 -1.26 -4.91 105.19 95.45 1lud n GLY 124 Ca -0.07 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 0.38 -4.37 1.61 9.92 -1.26 -5.04 116.55 117.79 1lud n ASP 125 Ca 0.00 -0.02 -0.35 0.00 -0.53 0.00 0.00 54.79 53.89 1lud n ASP 125 Cb 0.00 0.12 -0.13 0.00 -0.64 0.00 0.00 41.12 40.47 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 -0.20 3.63 0.28 -3.53 2.01 -1.26 -5.10 115.64 111.47 1lud s THR 126 Ca 0.00 -0.41 0.05 0.00 0.31 0.00 0.00 61.69 61.64 1lud s THR 126 Cb 0.00 -2.65 -0.06 0.00 0.01 0.00 0.00 72.50 69.80 1lud s THR 126 CO 0.00 0.42 -0.01 -0.54 -0.69 0.00 0.00 174.62 173.80 1lud s LYS 127 N 1.32 1.51 0.79 4.92 1.02 -1.26 -2.98 119.74 125.06 1lud s LYS 127 Ca 0.04 -1.78 -0.12 0.00 0.02 0.00 0.00 55.97 54.12 1lud s LYS 127 Cb -0.14 -0.91 0.07 0.00 -0.52 0.00 0.00 37.83 36.32 1lud s LYS 127 CO -0.01 -0.06 1.15 1.41 -0.92 0.00 0.00 175.35 176.92 1lud s MET 128 N -3.81 1.91 0.94 1.68 1.75 -1.24 -4.80 119.30 115.73 1lud s MET 128 Ca 0.31 1.51 -0.12 0.00 -1.25 0.00 0.00 55.69 56.14 1lud s MET 128 Cb 0.06 -1.83 0.15 0.00 2.84 0.00 0.00 34.83 36.05 1lud s MET 128 CO 0.12 -1.96 1.12 0.96 -0.65 0.00 0.00 175.02 174.61 1lud s ILE 129 N -2.44 2.12 -0.62 10.11 -4.36 -1.26 -4.94 121.20 119.81 1lud s ILE 129 Ca 0.68 0.04 -0.27 0.00 -0.26 0.00 0.00 60.65 60.84 1lud s ILE 129 Cb -0.23 -2.68 0.00 0.00 1.25 0.00 0.00 42.46 40.79 1lud s ILE 129 CO 0.51 -0.05 1.60 -2.16 0.24 0.00 0.00 174.94 175.08 1lud s PRO 130 N -5.15 2.96 0.30 0.37 0.05 -1.26 -5.01 135.00 127.27 1lud s PRO 130 Ca 0.64 0.39 -0.09 0.00 0.05 0.00 0.00 61.00 62.00 1lud s PRO 130 Cb -0.16 -4.26 -0.06 0.00 0.05 0.00 0.00 34.50 30.06 1lud s PRO 130 CO 0.55 -2.35 0.62 -0.51 0.05 0.00 0.00 177.00 175.36 1lud s LEU 131 N 7.40 4.04 -1.20 -3.56 1.43 -1.26 -5.00 118.68 120.54 1lud s LEU 131 Ca 0.56 0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 54.53 1lud s LEU 131 Cb -0.11 -3.75 0.22 0.00 0.03 0.00 0.00 46.19 42.58 1lud s LEU 131 CO 0.21 -0.21 1.83 -3.20 0.23 0.00 0.00 176.35 175.21 1lud n ASN 132 N -0.72 6.28 -0.07 2.29 4.05 -1.26 -4.78 115.26 121.04 1lud n ASN 132 Ca 0.00 -3.28 0.25 0.00 0.45 0.00 0.00 54.58 52.01 1lud n ASN 132 Cb 0.53 -1.36 0.72 0.00 1.23 0.00 0.00 39.78 40.90 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 5.27 0.00 0.00 1.20 4.06 -1.94 0.41 115.95 124.95 1lud h TRP 133 Ca 0.40 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.32 1lud h TRP 133 Cb 0.53 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.69 1lud h TRP 133 CO 1.25 0.00 -0.16 0.22 -3.56 0.00 0.00 178.44 176.19 1lud h ASP 134 N 0.00 0.00 0.33 -3.49 1.82 -2.04 -1.60 116.42 111.44 1lud h ASP 134 Ca 0.33 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.97 1lud h ASP 134 Cb 1.51 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.52 1lud h ASP 134 CO -0.00 0.16 -0.37 0.47 -1.61 0.00 0.00 179.24 177.88 1lud n ASP 135 N -4.07 0.82 -4.63 2.28 8.00 0.14 -4.90 116.55 114.19 1lud n ASP 135 Ca -0.02 -0.64 -0.26 0.00 0.71 0.00 0.00 54.79 54.58 1lud n ASP 135 Cb 0.24 0.20 -0.09 0.00 -0.02 0.00 0.00 41.12 41.44 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1lud s PHE 136 N -2.71 2.52 -0.03 1.24 0.40 -0.60 -3.51 117.98 115.30 1lud s PHE 136 Ca 0.19 -0.55 0.01 0.00 -0.60 0.00 0.00 56.93 55.98 1lud s PHE 136 Cb 0.18 -1.65 0.02 0.00 0.51 0.00 0.00 43.02 42.09 1lud s PHE 136 CO 0.60 0.43 -0.03 0.99 0.70 0.00 0.00 175.22 177.91 1lud s THR 137 N -2.61 0.40 -0.07 0.64 2.01 -1.06 -4.89 115.64 110.06 1lud s THR 137 Ca 0.36 -0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.98 1lud s THR 137 Cb 0.04 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 1lud s THR 137 CO 0.19 0.18 1.46 -0.75 -0.69 0.00 0.00 174.62 175.01 1lud s LYS 138 N 0.75 4.22 -0.10 4.92 2.36 -1.26 -1.93 119.74 128.71 1lud s LYS 138 Ca -0.09 1.96 0.19 0.00 -2.55 0.00 0.00 55.97 55.48 1lud s LYS 138 Cb -0.12 -3.80 -0.26 0.00 -1.05 0.00 0.00 37.83 32.60 1lud s LYS 138 CO -0.00 -0.73 0.34 1.33 1.55 0.00 0.00 175.35 177.84 1lud n VAL 139 N 5.22 0.91 -3.79 4.02 0.24 0.11 -4.95 118.33 120.09 1lud n VAL 139 Ca 0.15 -0.71 -0.13 0.00 -2.04 0.00 0.00 64.34 61.61 1lud n VAL 139 Cb 0.44 -0.37 -0.12 0.00 -1.47 0.00 0.00 33.84 32.31 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 -5.24 -0.22 -0.18 -1.34 0.01 -1.20 -5.03 113.70 100.50 1lud s SER 140 Ca -0.08 0.43 -0.16 0.00 1.31 0.00 0.00 55.95 57.45 1lud s SER 140 Cb 0.09 0.43 0.05 0.00 0.21 0.00 0.00 66.02 66.79 1lud s SER 140 CO 0.85 -0.08 0.48 -0.55 0.41 0.00 0.00 173.24 174.35 1lud s SER 141 N 0.21 -0.51 -0.03 2.44 0.15 -1.26 -0.96 113.70 113.75 1lud s SER 141 Ca -0.01 0.97 0.02 0.00 0.70 0.00 0.00 55.95 57.63 1lud s SER 141 Cb -0.02 0.97 0.01 0.00 -1.71 0.00 0.00 66.02 65.26 1lud s SER 141 CO -0.00 -0.17 -0.07 -0.60 1.20 0.00 0.00 173.24 173.59 1lud s ARG 142 N 0.35 0.85 -0.11 5.44 6.06 -0.95 -4.94 118.95 125.65 1lud s ARG 142 Ca -0.01 -0.24 -0.01 0.00 -2.50 0.00 0.00 55.73 52.98 1lud s ARG 142 Cb -0.04 -0.81 -0.03 0.00 0.06 0.00 0.00 34.95 34.14 1lud s ARG 142 CO -0.01 0.07 -0.08 0.99 -2.50 0.00 0.00 175.30 173.77 1lud s THR 143 N 0.32 3.56 -0.06 4.11 2.01 -1.26 -0.74 115.64 123.58 1lud s THR 143 Ca -0.05 -0.50 0.02 0.00 0.31 0.00 0.00 61.69 61.47 1lud s THR 143 Cb -0.09 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 69.94 1lud s THR 143 CO 0.00 0.55 -0.11 0.54 -0.69 0.00 0.00 174.62 174.91 1lud s VAL 144 N -0.15 1.07 -0.41 3.82 0.11 -0.84 -5.02 120.40 118.98 1lud s VAL 144 Ca 0.01 -0.44 -0.14 0.00 -2.93 0.00 0.00 61.98 58.48 1lud s VAL 144 Cb -0.13 -0.99 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 1lud s VAL 144 CO 0.03 0.34 0.29 -1.61 -3.33 0.00 0.00 175.10 170.82 1lud s GLU 145 N 0.70 2.94 0.66 1.54 2.02 -1.26 -2.78 118.70 122.52 1lud s GLU 145 Ca -0.14 -1.05 -0.05 0.00 0.02 0.00 0.00 54.97 53.74 1lud s GLU 145 Cb -0.16 -3.95 0.05 0.00 0.10 0.00 0.00 34.13 30.17 1lud s GLU 145 CO 0.03 -0.76 0.96 0.34 0.02 0.00 0.00 175.26 175.85 1lud s ASP 146 N 1.71 5.04 0.35 -0.19 2.15 -1.26 -4.94 116.67 119.53 1lud s ASP 146 Ca 0.04 0.45 0.25 0.00 0.43 0.00 0.00 52.55 53.72 1lud s ASP 146 Cb -0.19 -1.20 1.28 0.00 -0.30 0.00 0.00 42.92 42.50 1lud s ASP 146 CO 0.09 -1.42 1.76 0.71 -0.17 0.00 0.00 175.17 176.14 1lud h THR 147 N -0.42 0.00 -3.46 1.71 1.35 -1.97 -3.40 112.91 106.72 1lud h THR 147 Ca -0.44 -0.06 -0.64 0.00 -0.55 0.00 0.00 66.41 64.71 1lud h THR 147 Cb 1.30 0.66 -0.21 0.00 -1.73 0.00 0.00 68.15 68.17 1lud h THR 147 CO 0.59 0.00 -0.63 0.21 -0.25 0.00 0.00 175.52 175.44 1lud s ASN 148 N -4.25 5.07 0.28 5.36 3.84 -1.26 -4.98 114.94 119.00 1lud s ASN 148 Ca -0.01 -0.14 0.02 0.00 0.21 0.00 0.00 52.86 52.93 1lud s ASN 148 Cb 0.08 -1.88 0.68 0.00 -0.55 0.00 0.00 41.25 39.58 1lud s ASN 148 CO 0.27 0.06 1.67 -0.65 -2.79 0.00 0.00 177.10 175.66 1lud h PRO 149 N 7.50 0.27 0.09 0.43 0.10 -1.99 0.32 132.00 138.72 1lud h PRO 149 Ca -0.36 -0.02 -0.26 0.00 0.10 0.00 0.00 66.00 65.46 1lud h PRO 149 Cb 1.18 -0.06 -0.00 0.00 0.10 0.00 0.00 31.00 32.21 1lud h PRO 149 CO 0.62 0.18 -1.17 0.00 0.10 0.00 0.00 178.00 177.73 1lud h ALA 150 N 1.73 0.17 0.00 -0.75 0.00 -1.94 -3.20 119.26 115.28 1lud h ALA 150 Ca 0.54 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1lud h ALA 150 Cb 1.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1lud h ALA 150 CO -0.59 1.02 0.00 1.28 0.00 0.00 0.00 179.25 180.95 1lud n LEU 151 N -3.51 0.00 -4.77 0.00 4.77 0.04 -3.10 117.00 110.42 1lud n LEU 151 Ca -0.07 0.36 -0.40 0.00 -0.03 0.00 0.00 56.01 55.87 1lud n LEU 151 Cb 0.99 -0.36 -0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1lud n LEU 151 CO 0.52 -0.19 1.00 -0.89 -1.33 0.00 0.00 177.39 176.50 1lud s THR 152 N -2.72 2.46 0.15 -5.08 2.01 -0.82 -4.56 115.64 107.08 1lud s THR 152 Ca 0.11 0.42 -0.25 0.00 0.31 0.00 0.00 61.69 62.29 1lud s THR 152 Cb 0.09 -3.25 0.06 0.00 0.01 0.00 0.00 72.50 69.41 1lud s THR 152 CO 0.23 0.07 0.90 -1.38 -0.69 0.00 0.00 174.62 173.75 1lud s HIS 153 N -1.22 -0.19 0.11 4.92 -3.43 -1.12 0.08 115.29 114.44 1lud s HIS 153 Ca 0.56 -0.10 0.04 0.00 -0.80 0.00 0.00 55.06 54.76 1lud s HIS 153 Cb -0.40 0.63 -0.04 0.00 -1.43 0.00 0.00 32.58 31.34 1lud s HIS 153 CO 0.52 -0.84 -0.10 0.99 -2.00 0.00 0.00 174.74 173.31 1lud s THR 154 N -3.37 1.01 -0.19 -5.38 2.01 -0.79 -2.00 115.64 106.93 1lud s THR 154 Ca 0.10 -1.76 -0.04 0.00 0.31 0.00 0.00 61.69 60.30 1lud s THR 154 Cb -0.02 -1.50 -0.02 0.00 0.01 0.00 0.00 72.50 70.97 1lud s THR 154 CO 0.00 -0.61 -0.02 -0.31 -0.69 0.00 0.00 174.62 173.00 1lud s TYR 155 N -2.69 3.02 -0.15 4.92 2.02 0.09 -2.00 117.35 122.56 1lud s TYR 155 Ca 0.09 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 1lud s TYR 155 Cb -0.01 -2.05 0.01 0.00 -0.40 0.00 0.00 41.96 39.50 1lud s TYR 155 CO 0.00 -0.21 -0.19 -1.21 -1.57 0.00 0.00 175.55 172.37 1lud s GLU 156 N 0.86 3.10 -0.16 -0.62 2.02 -0.21 -2.23 118.70 121.46 1lud s GLU 156 Ca 0.00 -0.81 -0.01 0.00 0.02 0.00 0.00 54.97 54.17 1lud s GLU 156 Cb -0.14 -2.52 -0.01 0.00 0.10 0.00 0.00 34.13 31.56 1lud s GLU 156 CO 0.02 -0.01 -0.11 0.08 0.02 0.00 0.00 175.26 175.26 1lud s VAL 157 N 0.83 3.03 0.36 2.63 1.01 -0.13 -1.51 120.40 126.62 1lud s VAL 157 Ca -0.06 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.36 1lud s VAL 157 Cb -0.15 -2.31 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 1lud s VAL 157 CO -0.01 0.50 0.03 0.26 0.00 0.00 0.00 175.10 175.87 1lud s TRP 158 N 0.80 2.54 0.01 5.22 0.52 0.53 0.05 118.94 128.61 1lud s TRP 158 Ca -0.04 -0.50 0.01 0.00 0.02 0.00 0.00 56.10 55.60 1lud s TRP 158 Cb -0.15 -1.59 -0.01 0.00 -1.15 0.00 0.00 33.47 30.57 1lud s TRP 158 CO 0.01 0.44 -0.05 -0.65 0.02 0.00 0.00 176.95 176.72 1lud s GLN 159 N -3.74 0.36 0.03 4.98 -0.21 -0.81 -2.09 119.66 118.19 1lud s GLN 159 Ca 0.36 -0.35 -0.30 0.00 0.02 0.00 0.00 55.36 55.08 1lud s GLN 159 Cb 0.02 -0.25 -0.04 0.00 1.00 0.00 0.00 33.01 33.74 1lud s GLN 159 CO 0.19 0.06 1.01 0.21 -2.12 0.00 0.00 175.29 174.64 1lud s LYS 160 N -0.64 4.56 0.58 2.91 2.20 -1.06 -2.56 119.74 125.73 1lud s LYS 160 Ca -0.04 1.48 0.05 0.00 -0.36 0.00 0.00 55.97 57.11 1lud s LYS 160 Cb -0.05 -3.43 0.07 0.00 -1.51 0.00 0.00 37.83 32.92 1lud s LYS 160 CO -0.00 -0.04 0.80 0.15 -0.36 0.00 0.00 175.35 175.90 1lud s LYS 161 N 0.83 2.28 0.00 4.03 -0.14 -1.23 -5.01 119.74 120.50 1lud s LYS 161 Ca 0.52 -1.31 0.00 0.00 -1.36 0.00 0.00 55.97 53.83 1lud s LYS 161 Cb -0.23 -2.57 0.00 0.00 -1.68 0.00 0.00 37.83 33.36 1lud s LYS 161 CO 0.29 -0.87 0.13 0.00 -0.76 0.00 0.00 175.35 174.14