#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 1.73 -0.15 2.41 0.00 0.11 0.15 121.76 126.01 1lud s ALA 2 Ca 0.00 -1.35 -0.05 0.00 0.00 0.00 0.00 51.96 50.56 1lud s ALA 2 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.94 1lud s ALA 2 CO 0.00 0.19 0.01 -0.06 0.00 0.00 0.00 175.76 175.90 1lud s PHE 3 N -1.94 3.15 -0.33 0.00 0.40 0.48 0.19 117.98 119.94 1lud s PHE 3 Ca 0.11 -0.04 -0.00 0.00 -0.60 0.00 0.00 56.93 56.40 1lud s PHE 3 Cb -0.06 -1.97 0.11 0.00 0.51 0.00 0.00 43.02 41.60 1lud s PHE 3 CO 0.05 0.15 0.12 -1.17 0.70 0.00 0.00 175.22 175.07 1lud s LEU 4 N 0.10 2.28 0.22 -0.37 2.96 -0.86 0.12 118.68 123.14 1lud s LEU 4 Ca 0.02 -1.78 -0.00 0.00 -0.22 0.00 0.00 54.13 52.16 1lud s LEU 4 Cb -0.13 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.64 1lud s LEU 4 CO 0.02 -0.40 0.12 -1.66 -1.32 0.00 0.00 176.35 173.11 1lud s TRP 5 N 1.45 1.31 -0.41 5.38 -2.14 -0.48 -4.61 118.94 119.43 1lud s TRP 5 Ca 0.11 -1.32 0.02 0.00 2.66 0.00 0.00 56.10 57.57 1lud s TRP 5 Cb -0.18 -0.68 0.12 0.00 -3.10 0.00 0.00 33.47 29.63 1lud s TRP 5 CO -0.21 -0.54 0.18 0.00 -2.66 0.00 0.00 176.95 173.72 1lud s ALA 6 N -4.00 2.39 0.17 2.67 0.00 -1.26 -1.52 121.76 120.21 1lud s ALA 6 Ca 0.39 -2.54 -0.01 0.00 0.00 0.00 0.00 51.96 49.79 1lud s ALA 6 Cb 0.07 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 1lud s ALA 6 CO 0.13 -1.91 0.36 1.14 0.00 0.00 0.00 175.76 175.48 1lud s GLN 7 N 0.57 3.53 0.00 0.00 -2.07 0.55 -4.67 119.66 117.57 1lud s GLN 7 Ca 0.15 -0.31 0.00 0.00 -1.82 0.00 0.00 55.36 53.38 1lud s GLN 7 Cb -0.22 -2.87 0.00 0.00 -1.09 0.00 0.00 33.01 28.83 1lud s GLN 7 CO -0.06 0.44 0.00 -0.40 -1.32 0.00 0.00 175.29 173.95 1lud n ASP 8 N -0.39 0.00 -0.17 12.60 5.68 -1.17 -1.81 116.55 131.29 1lud n ASP 8 Ca -0.04 -0.33 -0.08 0.00 -0.50 0.00 0.00 54.79 53.84 1lud n ASP 8 Cb 0.53 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.53 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 0.69 -0.10 0.11 -0.00 -1.50 -2.71 114.38 110.88 1lud h ARG 9 Ca 0.00 -0.08 -0.14 0.00 -0.00 0.00 0.00 59.98 59.76 1lud h ARG 9 Cb 0.00 -0.14 -0.01 0.00 -0.00 0.00 0.00 29.97 29.82 1lud h ARG 9 CO 0.00 0.54 -0.55 -0.44 -0.00 0.00 0.00 179.97 179.52 1lud h ASP 10 N 0.66 0.32 0.00 0.08 3.32 -1.90 -3.47 116.42 115.43 1lud h ASP 10 Ca 0.18 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1lud h ASP 10 Cb 0.05 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1lud h ASP 10 CO -0.03 0.81 0.00 0.61 -1.72 0.00 0.00 179.24 178.91 1lud n GLY 11 N 0.17 1.07 3.92 2.75 0.00 -1.02 -5.10 105.19 106.97 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 3.62 0.06 0.99 2.96 -1.26 -3.63 118.68 121.42 1lud s LEU 12 Ca 0.00 0.73 0.00 0.00 -0.22 0.00 0.00 54.13 54.64 1lud s LEU 12 Cb 0.00 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 43.05 1lud s LEU 12 CO 0.00 -0.64 0.00 2.30 -1.32 0.00 0.00 176.35 176.69 1lud n ILE 13 N -2.22 0.21 -3.61 6.68 -5.35 -1.21 -3.04 119.36 110.82 1lud n ILE 13 Ca 0.01 0.07 -0.16 0.00 -0.27 0.00 0.00 62.75 62.39 1lud n ILE 13 Cb 0.56 -0.70 -0.07 0.00 -1.74 0.00 0.00 39.64 37.69 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 -3.78 -0.43 -0.02 3.28 0.00 -1.24 -4.66 107.32 100.48 1lud s GLY 14 Ca 0.00 1.02 0.03 0.00 0.00 0.00 0.00 44.72 45.78 1lud s GLY 14 CO 0.00 0.72 -0.11 1.25 0.00 0.00 0.00 173.10 174.97 1lud s LYS 15 N -1.11 1.01 -1.26 2.90 2.20 -1.18 -4.17 119.74 118.12 1lud s LYS 15 Ca -0.11 -0.38 -0.07 0.00 -0.36 0.00 0.00 55.97 55.05 1lud s LYS 15 Cb -0.02 -0.95 -0.01 0.00 -1.51 0.00 0.00 37.83 35.35 1lud s LYS 15 CO 0.07 0.19 0.66 -0.25 -0.36 0.00 0.00 175.35 175.67 1lud n ASP 16 N 3.03 -2.56 0.00 1.43 9.92 -1.26 -3.65 116.55 123.46 1lud n ASP 16 Ca -0.16 -0.93 0.00 0.00 -0.53 0.00 0.00 54.79 53.17 1lud n ASP 16 Cb 0.55 -3.63 0.00 0.00 -0.64 0.00 0.00 41.12 37.40 1lud n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1lud n GLY 17 N -1.70 1.80 1.05 0.44 0.00 -1.26 -4.87 105.19 100.65 1lud n GLY 17 Ca -0.22 0.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.00 -4.33 1.61 1.44 -1.24 -5.00 115.22 105.70 1lud n HIS 18 Ca 0.00 -0.14 -0.24 0.00 -2.01 0.00 0.00 57.72 55.34 1lud n HIS 18 Cb 0.00 -0.44 -0.08 0.00 0.12 0.00 0.00 29.99 29.58 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 3.03 0.03 2.39 1.43 -1.26 -3.13 118.68 121.17 1lud s LEU 19 Ca 0.17 -0.72 -0.16 0.00 -1.03 0.00 0.00 54.13 52.39 1lud s LEU 19 Cb -0.03 -1.57 -0.35 0.00 0.03 0.00 0.00 46.19 44.27 1lud s LEU 19 CO 0.14 0.02 1.01 1.55 0.23 0.00 0.00 176.35 179.31 1lud h PRO 20 N 2.12 0.56 -5.73 1.29 0.14 -1.88 -3.45 132.00 125.03 1lud h PRO 20 Ca -0.44 -0.92 -0.67 0.00 0.14 0.00 0.00 66.00 64.12 1lud h PRO 20 Cb 1.25 0.34 -0.24 0.00 0.14 0.00 0.00 31.00 32.48 1lud h PRO 20 CO 0.59 1.44 -0.75 1.67 0.14 0.00 0.00 178.00 181.09 1lud s TRP 21 N -2.65 2.82 -0.68 1.56 -2.14 -1.26 -5.07 118.94 111.52 1lud s TRP 21 Ca -0.09 -0.36 -0.20 0.00 2.66 0.00 0.00 56.10 58.10 1lud s TRP 21 Cb 0.04 -1.77 0.10 0.00 -3.10 0.00 0.00 33.47 28.74 1lud s TRP 21 CO 0.95 0.01 0.88 -1.58 -2.66 0.00 0.00 176.95 174.54 1lud s HIS 22 N -0.14 2.91 -0.28 1.66 2.46 -1.26 -4.98 115.29 115.66 1lud s HIS 22 Ca -0.00 -0.90 0.02 0.00 0.47 0.00 0.00 55.06 54.65 1lud s HIS 22 Cb -0.13 -4.17 0.08 0.00 -0.13 0.00 0.00 32.58 28.23 1lud s HIS 22 CO 0.03 -1.47 0.01 -1.17 -2.47 0.00 0.00 174.74 169.67 1lud s LEU 23 N 3.17 3.22 0.22 8.88 2.96 -1.26 -4.98 118.68 130.90 1lud s LEU 23 Ca 0.19 -1.58 -0.04 0.00 -0.22 0.00 0.00 54.13 52.49 1lud s LEU 23 Cb -0.18 -1.27 0.21 0.00 0.50 0.00 0.00 46.19 45.46 1lud s LEU 23 CO 0.05 -0.31 1.65 1.55 -1.32 0.00 0.00 176.35 177.96 1lud h PRO 24 N 7.87 0.76 0.00 0.98 0.14 -1.98 -2.71 132.00 137.05 1lud h PRO 24 Ca -0.13 -0.29 -0.04 0.00 0.14 0.00 0.00 66.00 65.68 1lud h PRO 24 Cb 1.04 -0.04 -0.01 0.00 0.14 0.00 0.00 31.00 32.13 1lud h PRO 24 CO 0.46 0.90 -0.19 0.22 0.14 0.00 0.00 178.00 179.53 1lud h ASP 25 N 0.67 0.00 -0.07 1.44 3.58 -1.96 -2.49 116.42 117.59 1lud h ASP 25 Ca 0.10 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.34 1lud h ASP 25 Cb 0.70 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.76 1lud h ASP 25 CO 0.05 0.19 -0.77 -0.78 -2.88 0.00 0.00 179.24 175.05 1lud h ASP 26 N 0.00 0.79 -0.43 2.28 3.58 -1.89 -2.99 116.42 117.78 1lud h ASP 26 Ca -0.00 -0.69 0.06 0.00 0.42 0.00 0.00 57.03 56.82 1lud h ASP 26 Cb 0.39 -0.24 -0.06 0.00 1.72 0.00 0.00 39.33 41.14 1lud h ASP 26 CO 0.02 1.37 0.10 -0.07 -2.88 0.00 0.00 179.24 177.79 1lud h LEU 27 N 0.29 0.05 -1.07 2.28 3.38 -1.33 0.10 115.31 119.01 1lud h LEU 27 Ca -0.08 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.06 1lud h LEU 27 Cb 1.43 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.19 1lud h LEU 27 CO 0.16 0.06 0.62 0.45 0.09 0.00 0.00 178.44 179.82 1lud h HIS 28 N 0.24 1.10 -0.33 1.13 3.86 -1.50 0.14 115.15 119.79 1lud h HIS 28 Ca 0.21 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.40 1lud h HIS 28 Cb 0.24 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1lud h HIS 28 CO -0.19 0.49 0.01 -0.92 0.86 0.00 0.00 177.93 178.19 1lud h TYR 29 N 1.01 0.51 -0.09 2.45 3.20 -0.86 -0.81 116.97 122.37 1lud h TYR 29 Ca 0.45 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.26 1lud h TYR 29 Cb 0.38 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 1lud h TYR 29 CO -0.00 0.49 -0.02 0.35 -1.64 0.00 0.00 178.16 177.34 1lud h PHE 30 N 0.48 0.20 0.79 -3.82 3.57 0.33 -1.82 116.94 116.68 1lud h PHE 30 Ca 0.11 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1lud h PHE 30 Cb 0.29 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 38.99 1lud h PHE 30 CO 0.01 0.49 -0.38 -0.09 -2.23 0.00 0.00 178.31 176.10 1lud h ARG 31 N -0.14 -1.03 -0.99 1.11 2.43 -1.10 -2.37 114.38 112.29 1lud h ARG 31 Ca 0.02 0.07 0.26 0.00 -0.81 0.00 0.00 59.98 59.53 1lud h ARG 31 Cb 0.42 0.23 -0.13 0.00 -0.42 0.00 0.00 29.97 30.07 1lud h ARG 31 CO 0.01 -0.68 0.57 0.00 -1.51 0.00 0.00 179.97 178.36 1lud h ALA 32 N -1.30 1.80 0.00 2.80 0.00 -1.24 0.62 119.26 121.94 1lud h ALA 32 Ca -0.11 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1lud h ALA 32 Cb 0.82 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1lud h ALA 32 CO 0.18 -0.35 0.00 1.04 0.00 0.00 0.00 179.25 180.12 1lud n GLN 33 N -4.94 0.21 -0.50 0.00 1.13 -0.68 -3.36 117.38 109.24 1lud n GLN 33 Ca 0.28 0.30 0.07 0.00 -1.94 0.00 0.00 57.00 55.70 1lud n GLN 33 Cb 0.79 -1.81 0.18 0.00 0.11 0.00 0.00 30.24 29.51 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 -2.19 1.95 -2.67 5.09 -2.24 0.21 -4.90 114.28 109.52 1lud n THR 34 Ca 0.04 -2.78 -0.43 0.00 -2.27 0.00 0.00 64.05 58.61 1lud n THR 34 Cb 0.33 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.38 1lud n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1lud s VAL 35 N -2.89 4.49 -0.08 2.28 -7.23 -0.58 -3.17 120.40 113.22 1lud s VAL 35 Ca 0.35 1.58 0.00 0.00 -1.81 0.00 0.00 61.98 62.10 1lud s VAL 35 Cb 0.34 -4.42 0.00 0.00 0.56 0.00 0.00 36.38 32.86 1lud s VAL 35 CO -0.05 -0.55 0.00 0.61 -0.31 0.00 0.00 175.10 174.81 1lud n GLY 36 N 4.08 0.48 3.53 2.32 0.00 -1.26 -5.02 105.19 109.32 1lud n GLY 36 Ca 0.11 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 1lud n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lud s LYS 37 N -0.86 1.84 -0.18 1.61 1.02 -1.19 -4.47 119.74 117.51 1lud s LYS 37 Ca 0.00 -1.79 -0.29 0.00 0.02 0.00 0.00 55.97 53.91 1lud s LYS 37 Cb 0.00 -1.80 -0.00 0.00 -0.52 0.00 0.00 37.83 35.50 1lud s LYS 37 CO 0.00 0.24 1.10 0.42 -0.92 0.00 0.00 175.35 176.19 1lud s ILE 38 N -2.53 4.58 -0.38 2.17 1.01 -1.05 -3.74 121.20 121.26 1lud s ILE 38 Ca 0.32 1.89 -0.12 0.00 0.00 0.00 0.00 60.65 62.74 1lud s ILE 38 Cb -0.02 -4.22 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1lud s ILE 38 CO 0.17 -0.13 0.23 -0.32 0.00 0.00 0.00 174.94 174.89 1lud s MET 39 N 3.01 2.96 -0.32 2.79 1.75 -0.32 -0.33 119.30 128.84 1lud s MET 39 Ca 0.48 -1.00 -0.20 0.00 -1.25 0.00 0.00 55.69 53.72 1lud s MET 39 Cb -0.18 -3.80 -0.01 0.00 2.84 0.00 0.00 34.83 33.69 1lud s MET 39 CO 0.11 -0.67 0.63 0.08 -0.65 0.00 0.00 175.02 174.52 1lud s VAL 40 N 1.61 4.93 -0.05 10.11 1.01 0.11 0.25 120.40 138.36 1lud s VAL 40 Ca 0.03 0.76 0.02 0.00 0.00 0.00 0.00 61.98 62.80 1lud s VAL 40 Cb -0.19 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.19 1lud s VAL 40 CO 0.08 -0.19 -0.09 0.68 0.00 0.00 0.00 175.10 175.58 1lud s VAL 41 N 2.63 0.84 0.74 2.92 -7.23 -0.56 -0.31 120.40 119.43 1lud s VAL 41 Ca 0.25 -0.31 -0.13 0.00 -1.81 0.00 0.00 61.98 59.97 1lud s VAL 41 Cb -0.15 -0.80 0.04 0.00 0.56 0.00 0.00 36.38 36.04 1lud s VAL 41 CO 0.13 0.29 1.14 -0.83 -0.31 0.00 0.00 175.10 175.51 1lud s GLY 42 N 0.72 2.05 0.66 2.32 0.00 -0.54 -1.87 107.32 110.67 1lud s GLY 42 Ca -0.12 0.60 0.25 0.00 0.00 0.00 0.00 44.72 45.44 1lud s GLY 42 CO 0.02 0.97 1.77 -0.09 0.00 0.00 0.00 173.10 175.77 1lud h ARG 43 N -0.56 0.00 0.05 2.90 1.12 -0.21 0.16 114.38 117.84 1lud h ARG 43 Ca -0.46 0.00 -0.09 0.00 -1.11 0.00 0.00 59.98 58.32 1lud h ARG 43 Cb 1.26 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.23 1lud h ARG 43 CO 0.50 0.00 -0.40 0.00 -3.11 0.00 0.00 179.97 176.97 1lud h ARG 44 N 0.00 0.18 -0.05 0.20 2.47 -1.88 -2.61 114.38 112.69 1lud h ARG 44 Ca 0.01 -0.26 -0.03 0.00 -1.26 0.00 0.00 59.98 58.44 1lud h ARG 44 Cb 0.90 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 29.32 1lud h ARG 44 CO -0.00 1.07 -0.08 1.15 0.56 0.00 0.00 179.97 182.67 1lud h THR 45 N -0.58 1.41 -0.72 2.04 2.02 -1.37 -2.01 112.91 113.69 1lud h THR 45 Ca -0.06 -1.34 0.10 0.00 0.77 0.00 0.00 66.41 65.87 1lud h THR 45 Cb 1.25 2.18 -0.07 0.00 -1.74 0.00 0.00 68.15 69.77 1lud h THR 45 CO 0.08 0.37 0.36 0.22 0.37 0.00 0.00 175.52 176.91 1lud h TYR 46 N -0.34 0.64 0.00 3.16 3.20 -1.27 0.70 116.97 123.06 1lud h TYR 46 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1lud h TYR 46 Cb 0.63 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1lud h TYR 46 CO 0.11 0.22 0.00 0.93 -1.64 0.00 0.00 178.16 177.78 1lud h GLU 47 N 0.60 0.00 0.00 1.82 5.08 -1.43 -2.74 114.58 117.92 1lud h GLU 47 Ca 0.36 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.67 1lud h GLU 47 Cb 0.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1lud h GLU 47 CO -0.28 0.00 -1.79 0.45 -1.00 0.00 0.00 179.01 176.39 1lud n SER 48 N -2.41 0.23 -4.36 1.42 2.88 0.15 -4.97 113.62 106.56 1lud n SER 48 Ca 0.02 0.09 -0.33 0.00 -1.33 0.00 0.00 58.87 57.32 1lud n SER 48 Cb 0.26 1.46 0.11 0.00 -0.75 0.00 0.00 64.21 65.30 1lud n SER 48 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1lud n PHE 49 N -2.43 -1.92 -0.07 0.66 3.72 0.20 -4.96 117.46 112.65 1lud n PHE 49 Ca -0.06 0.20 -0.07 0.00 -0.05 0.00 0.00 57.45 57.46 1lud n PHE 49 Cb 0.64 -1.73 -0.05 0.00 -0.94 0.00 0.00 39.48 37.41 1lud n PHE 49 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1lud h PRO 50 N -1.52 0.00 -4.63 -1.08 0.14 -1.91 -3.44 132.00 119.56 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 1.29 0.00 -0.40 0.00 0.14 0.00 0.00 31.00 32.03 1lud h PRO 50 CO 0.33 0.34 -0.72 0.15 0.14 0.00 0.00 178.00 178.24 1lud s LYS 51 N -1.99 1.48 -0.11 0.86 1.02 -1.26 -5.09 119.74 114.65 1lud s LYS 51 Ca -0.12 -1.89 -0.00 0.00 0.02 0.00 0.00 55.97 53.98 1lud s LYS 51 Cb 0.01 -3.19 -0.02 0.00 -0.52 0.00 0.00 37.83 34.10 1lud s LYS 51 CO 0.28 -0.95 -0.09 1.03 -0.92 0.00 0.00 175.35 174.71 1lud s ARG 52 N 0.88 3.17 0.81 1.68 3.00 -1.26 -3.77 118.95 123.46 1lud s ARG 52 Ca 0.11 -0.60 -0.08 0.00 0.00 0.00 0.00 55.73 55.16 1lud s ARG 52 Cb -0.19 -2.67 0.14 0.00 0.00 0.00 0.00 34.95 32.23 1lud s ARG 52 CO -0.08 0.40 1.13 -1.25 0.00 0.00 0.00 175.30 175.50 1lud s PRO 53 N -0.12 1.40 0.28 3.54 0.04 -1.26 -5.09 135.00 133.79 1lud s PRO 53 Ca 0.00 -0.64 -0.29 0.00 0.04 0.00 0.00 61.00 60.11 1lud s PRO 53 Cb -0.13 -2.10 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 1lud s PRO 53 CO 0.03 -1.77 1.13 -0.51 0.04 0.00 0.00 177.00 175.91 1lud s LEU 54 N -5.46 4.54 -0.06 -3.56 1.43 -1.25 -4.94 118.68 109.38 1lud s LEU 54 Ca 0.68 2.32 -0.35 0.00 -1.03 0.00 0.00 54.13 55.74 1lud s LEU 54 Cb -0.06 -3.63 -0.13 0.00 0.03 0.00 0.00 46.19 42.40 1lud s LEU 54 CO 0.48 -0.19 1.76 -2.65 0.23 0.00 0.00 176.35 175.97 1lud n PRO 55 N 1.17 1.92 -3.99 1.29 -0.02 -1.26 -2.26 135.00 131.85 1lud n PRO 55 Ca -0.01 0.70 -0.29 0.00 -2.02 0.00 0.00 63.50 61.88 1lud n PRO 55 Cb 0.44 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.43 1lud n PRO 55 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1lud n GLU 56 N 5.46 -3.90 -3.78 -0.52 1.02 -1.26 -4.96 120.64 112.68 1lud n GLU 56 Ca 0.22 0.46 -0.13 0.00 -0.02 0.00 0.00 57.16 57.69 1lud n GLU 56 Cb 0.26 -4.95 -0.13 0.00 -0.02 0.00 0.00 31.44 26.59 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 -6.60 0.16 -0.21 3.49 0.52 -0.96 -4.12 118.95 111.23 1lud s ARG 57 Ca 0.33 0.30 -0.25 0.00 -0.52 0.00 0.00 55.73 55.59 1lud s ARG 57 Cb -0.17 -0.02 -0.01 0.00 0.52 0.00 0.00 34.95 35.27 1lud s ARG 57 CO 0.88 -0.08 0.84 0.99 0.02 0.00 0.00 175.30 177.95 1lud s THR 58 N 0.56 4.84 0.07 0.02 2.01 -1.25 -4.51 115.64 117.38 1lud s THR 58 Ca -0.04 1.62 0.08 0.00 0.31 0.00 0.00 61.69 63.66 1lud s THR 58 Cb -0.05 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 1lud s THR 58 CO -0.03 -0.04 -0.21 0.20 -0.69 0.00 0.00 174.62 173.85 1lud s ASN 59 N 1.26 2.57 -0.05 3.53 0.02 -1.26 -1.17 114.94 119.83 1lud s ASN 59 Ca 0.37 -0.61 0.05 0.00 -1.02 0.00 0.00 52.86 51.65 1lud s ASN 59 Cb -0.16 -0.18 -0.01 0.00 0.02 0.00 0.00 41.25 40.93 1lud s ASN 59 CO 0.09 0.12 -0.21 -0.69 0.02 0.00 0.00 177.10 176.43 1lud s VAL 60 N -0.97 1.76 0.05 1.60 1.01 0.14 -1.73 120.40 122.26 1lud s VAL 60 Ca 0.07 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1lud s VAL 60 Cb -0.09 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 1lud s VAL 60 CO 0.03 0.50 0.17 -0.69 0.00 0.00 0.00 175.10 175.11 1lud s VAL 61 N -0.04 5.20 -0.17 2.92 1.01 -1.08 -1.50 120.40 126.74 1lud s VAL 61 Ca -0.05 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1lud s VAL 61 Cb -0.13 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1lud s VAL 61 CO 0.03 0.18 -0.17 -0.22 0.00 0.00 0.00 175.10 174.92 1lud s LEU 62 N -2.36 2.33 0.06 3.92 2.96 -0.78 -2.27 118.68 122.53 1lud s LEU 62 Ca 0.32 -0.56 -0.08 0.00 -0.22 0.00 0.00 54.13 53.59 1lud s LEU 62 Cb -0.13 -1.54 -0.00 0.00 0.50 0.00 0.00 46.19 45.03 1lud s LEU 62 CO 0.25 0.03 0.18 0.28 -1.32 0.00 0.00 176.35 175.76 1lud s THR 63 N 1.13 0.13 -2.74 3.68 -1.32 -1.09 0.58 115.64 116.01 1lud s THR 63 Ca 0.01 -1.06 0.24 0.00 -1.21 0.00 0.00 61.69 59.66 1lud s THR 63 Cb -0.14 -1.11 0.32 0.00 -1.51 0.00 0.00 72.50 70.06 1lud s THR 63 CO -0.07 -0.59 1.36 1.41 -2.21 0.00 0.00 174.62 174.53 1lud n HIS 64 N 0.37 0.20 -1.73 9.09 8.25 -1.26 -4.28 115.22 125.86 1lud n HIS 64 Ca -0.17 -0.10 -0.29 0.00 -0.26 0.00 0.00 57.72 56.89 1lud n HIS 64 Cb 0.60 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.87 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 -1.80 0.82 -0.02 -0.41 1.11 -1.26 -5.01 119.66 113.10 1lud s GLN 65 Ca 0.33 -0.10 0.03 0.00 0.01 0.00 0.00 55.36 55.64 1lud s GLN 65 Cb 0.21 -1.84 -0.05 0.00 -1.01 0.00 0.00 33.01 30.33 1lud s GLN 65 CO 0.31 -2.34 0.05 -1.91 0.01 0.00 0.00 175.29 171.41 1lud n GLU 66 N -3.79 1.53 -1.03 2.91 0.00 -1.26 -4.65 120.64 114.35 1lud n GLU 66 Ca 0.11 -0.02 -0.14 0.00 0.00 0.00 0.00 57.16 57.12 1lud n GLU 66 Cb 0.60 -1.08 0.18 0.00 0.00 0.00 0.00 31.44 31.14 1lud n GLU 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1lud n ASP 67 N -1.83 3.27 -4.63 4.31 2.03 -1.26 -4.99 116.55 113.45 1lud n ASP 67 Ca -0.03 -3.73 -0.43 0.00 0.52 0.00 0.00 54.79 51.12 1lud n ASP 67 Cb 0.31 -0.72 -0.03 0.00 -0.72 0.00 0.00 41.12 39.96 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 -3.32 1.30 -0.45 -0.67 5.04 -1.26 -4.93 117.35 113.06 1lud s TYR 68 Ca 0.50 0.12 -0.15 0.00 -2.44 0.00 0.00 57.07 55.10 1lud s TYR 68 Cb 0.44 -4.07 0.06 0.00 0.35 0.00 0.00 41.96 38.74 1lud s TYR 68 CO 0.04 -4.59 0.37 -0.65 -1.34 0.00 0.00 175.55 169.37 1lud s GLN 69 N 5.41 2.98 -0.42 4.97 -1.52 -1.26 -4.98 119.66 124.83 1lud s GLN 69 Ca 0.93 -1.25 0.03 0.00 -1.95 0.00 0.00 55.36 53.12 1lud s GLN 69 Cb -0.36 -4.09 0.16 0.00 -0.22 0.00 0.00 33.01 28.51 1lud s GLN 69 CO 0.37 -0.94 0.32 0.00 -0.25 0.00 0.00 175.29 174.79 1lud s ALA 70 N 1.65 1.53 0.22 6.09 0.00 -1.26 -5.11 121.76 124.88 1lud s ALA 70 Ca 0.04 -2.45 -0.30 0.00 0.00 0.00 0.00 51.96 49.26 1lud s ALA 70 Cb -0.23 -1.65 -0.08 0.00 0.00 0.00 0.00 23.12 21.16 1lud s ALA 70 CO 0.08 -2.01 1.02 -0.65 0.00 0.00 0.00 175.76 174.20 1lud s GLN 71 N 0.16 4.72 0.00 0.00 -0.21 -1.26 -3.33 119.66 119.74 1lud s GLN 71 Ca 0.29 1.62 0.00 0.00 0.02 0.00 0.00 55.36 57.29 1lud s GLN 71 Cb -0.04 -3.27 0.00 0.00 1.00 0.00 0.00 33.01 30.71 1lud s GLN 71 CO -0.14 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.73 1lud n GLY 72 N 1.65 3.03 3.56 3.09 0.00 -1.26 -5.01 105.19 110.26 1lud n GLY 72 Ca -0.00 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.49 2.91 0.86 4.61 0.00 -1.21 -4.93 121.76 122.51 1lud s ALA 73 Ca 0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 1lud s ALA 73 Cb 0.00 -1.07 0.11 0.00 0.00 0.00 0.00 23.12 22.16 1lud s ALA 73 CO 0.00 0.60 1.13 0.28 0.00 0.00 0.00 175.76 177.77 1lud n VAL 74 N 1.72 1.01 -3.72 0.00 0.31 -0.70 -4.83 118.33 112.12 1lud n VAL 74 Ca -0.16 -0.12 -0.12 0.00 -0.01 0.00 0.00 64.34 63.93 1lud n VAL 74 Cb 0.52 -1.07 -0.12 0.00 -0.91 0.00 0.00 33.84 32.26 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 -2.37 -0.03 0.20 2.52 1.01 -1.26 -2.63 120.40 117.84 1lud s VAL 75 Ca 0.70 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.70 1lud s VAL 75 Cb -0.26 -0.43 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1lud s VAL 75 CO 0.55 0.05 0.35 0.68 0.00 0.00 0.00 175.10 176.73 1lud s VAL 76 N 1.22 0.03 -0.10 2.92 -7.23 -0.96 -4.93 120.40 111.35 1lud s VAL 76 Ca -0.09 -1.44 0.24 0.00 -1.81 0.00 0.00 61.98 58.88 1lud s VAL 76 Cb -0.09 -2.05 0.46 0.00 0.56 0.00 0.00 36.38 35.26 1lud s VAL 76 CO -0.09 -0.14 1.15 1.41 -0.31 0.00 0.00 175.10 177.12 1lud n HIS 77 N -0.29 0.46 -3.15 2.82 8.25 -1.26 -2.68 115.22 119.37 1lud n HIS 77 Ca -0.04 -1.10 0.05 0.00 -0.26 0.00 0.00 57.72 56.37 1lud n HIS 77 Cb 0.63 -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 0.34 0.64 0.00 0.00 176.34 177.32 1lud s ASP 78 N -2.66 -0.89 0.52 0.41 -1.08 -1.26 -4.92 116.67 106.79 1lud s ASP 78 Ca 0.32 0.54 0.43 0.00 -0.52 0.00 0.00 52.55 53.33 1lud s ASP 78 Cb 0.37 1.74 1.64 0.00 -1.46 0.00 0.00 42.92 45.21 1lud s ASP 78 CO -0.12 -0.17 1.60 0.58 0.52 0.00 0.00 175.17 177.58 1lud h VAL 79 N 5.62 0.05 -0.75 1.11 2.07 -1.99 0.81 116.25 123.17 1lud h VAL 79 Ca -0.17 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.39 1lud h VAL 79 Cb 1.17 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1lud h VAL 79 CO 0.06 0.00 0.46 0.00 0.02 0.00 0.00 177.57 178.11 1lud h ALA 80 N 1.23 0.99 -0.20 1.67 0.00 -2.01 -2.13 119.26 118.82 1lud h ALA 80 Ca 0.89 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.76 1lud h ALA 80 Cb 3.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 20.91 1lud h ALA 80 CO -0.16 0.21 0.01 0.00 0.00 0.00 0.00 179.25 179.31 1lud h ALA 81 N 1.34 0.26 -0.95 0.00 0.00 0.24 -2.94 119.26 117.22 1lud h ALA 81 Ca 0.31 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.18 1lud h ALA 81 Cb 0.09 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.71 1lud h ALA 81 CO -0.14 -0.03 0.55 0.28 0.00 0.00 0.00 179.25 179.91 1lud h VAL 82 N 0.11 0.76 -0.68 0.00 2.07 -1.34 -0.63 116.25 116.54 1lud h VAL 82 Ca 0.06 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1lud h VAL 82 Cb 0.38 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 1lud h VAL 82 CO 0.01 0.14 0.41 -0.26 0.02 0.00 0.00 177.57 177.89 1lud h PHE 83 N 0.76 0.89 0.14 1.57 0.04 -1.23 -3.05 116.94 116.08 1lud h PHE 83 Ca 0.52 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.30 1lud h PHE 83 Cb 0.72 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 38.53 1lud h PHE 83 CO -0.04 0.60 -0.50 0.00 -0.60 0.00 0.00 178.31 177.78 1lud h ALA 84 N 1.21 -0.93 -0.50 2.45 0.00 -0.99 -1.69 119.26 118.82 1lud h ALA 84 Ca 0.24 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1lud h ALA 84 Cb -0.03 0.83 -0.10 0.00 0.00 0.00 0.00 17.79 18.49 1lud h ALA 84 CO -0.05 -1.09 -0.40 -0.92 0.00 0.00 0.00 179.25 176.80 1lud h TYR 85 N -0.74 -1.14 -0.51 0.00 3.20 -1.43 0.76 116.97 117.11 1lud h TYR 85 Ca 0.00 0.07 0.09 0.00 3.14 0.00 0.00 58.73 62.03 1lud h TYR 85 Cb 0.75 0.57 -0.07 0.00 1.54 0.00 0.00 36.73 39.52 1lud h TYR 85 CO -0.42 -0.42 0.10 0.00 -1.64 0.00 0.00 178.16 175.79 1lud h ALA 86 N 0.66 0.58 0.00 1.82 0.00 -1.41 0.28 119.26 121.18 1lud h ALA 86 Ca 0.18 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1lud h ALA 86 Cb 0.56 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1lud h ALA 86 CO -0.63 -0.31 -0.07 -0.22 0.00 0.00 0.00 179.25 178.02 1lud h LYS 87 N 0.23 0.00 0.00 0.00 1.63 -0.20 -2.62 116.57 115.61 1lud h LYS 87 Ca 0.26 0.00 -0.19 0.00 -0.85 0.00 0.00 60.65 59.87 1lud h LYS 87 Cb 0.35 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.95 1lud h LYS 87 CO -0.34 0.07 -1.35 1.96 -3.45 0.00 0.00 179.45 176.34 1lud h GLN 88 N 0.00 0.00 -5.51 1.90 4.20 0.17 -3.45 115.11 112.42 1lud h GLN 88 Ca -0.00 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.10 1lud h GLN 88 Cb 0.26 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 27.93 1lud h GLN 88 CO 0.01 0.38 0.16 -1.01 -0.67 0.00 0.00 178.83 177.70 1lud s HIS 89 N -2.86 3.25 -2.18 2.96 3.76 0.19 -4.91 115.29 115.51 1lud s HIS 89 Ca -0.02 0.73 0.27 0.00 -0.15 0.00 0.00 55.06 55.88 1lud s HIS 89 Cb 0.08 -2.91 1.34 0.00 1.11 0.00 0.00 32.58 32.21 1lud s HIS 89 CO 0.81 -0.39 1.89 -0.35 -0.85 0.00 0.00 174.74 175.85 1lud n PRO 90 N 5.79 1.29 -0.16 8.40 -0.04 -1.26 -3.61 135.00 145.42 1lud n PRO 90 Ca -0.01 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 1lud n PRO 90 Cb 0.49 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.44 0.00 -3.43 3.54 8.00 -1.26 -5.01 116.55 117.95 1lud n ASP 91 Ca 0.19 -1.30 -0.17 0.00 0.71 0.00 0.00 54.79 54.22 1lud n ASP 91 Cb 0.20 -0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 41.13 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1lud s GLN 92 N 0.00 0.27 0.00 -1.24 0.74 -1.24 -4.80 119.66 113.39 1lud s GLN 92 Ca 0.00 0.06 0.00 0.00 0.05 0.00 0.00 55.36 55.47 1lud s GLN 92 Cb 0.00 -0.86 0.00 0.00 1.10 0.00 0.00 33.01 33.25 1lud s GLN 92 CO 0.00 -0.84 0.00 0.39 -0.55 0.00 0.00 175.29 174.29 1lud n GLU 93 N 5.32 0.73 -3.62 1.67 1.02 -1.26 -4.50 120.64 120.00 1lud n GLU 93 Ca -0.04 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.72 1lud n GLU 93 Cb 0.48 0.00 -0.11 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 4.10 -0.10 -4.62 2.96 -1.26 -2.54 118.68 117.23 1lud s LEU 94 Ca 0.00 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1lud s LEU 94 Cb 0.00 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.64 1lud s LEU 94 CO 0.00 -0.15 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.98 1lud s VAL 95 N 1.68 1.90 0.21 1.68 1.01 0.55 -0.71 120.40 126.72 1lud s VAL 95 Ca 0.06 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 1lud s VAL 95 Cb -0.17 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.48 1lud s VAL 95 CO 0.08 0.52 0.52 -0.63 0.00 0.00 0.00 175.10 175.60 1lud s ILE 96 N 0.49 4.96 0.00 2.22 -1.09 0.50 0.06 121.20 128.34 1lud s ILE 96 Ca -0.16 0.45 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 1lud s ILE 96 Cb -0.17 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1lud s ILE 96 CO 0.06 -0.02 0.28 0.00 -1.23 0.00 0.00 174.94 174.02 1lud n ALA 97 N -0.01 1.31 0.00 9.38 0.00 0.58 -2.02 120.51 129.75 1lud n ALA 97 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.16 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 -0.01 -1.37 0.00 0.00 0.00 -1.14 -4.91 105.19 97.75 1lud n GLY 98 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.22 0.33 -0.02 0.00 -1.26 -1.47 105.19 101.56 1lud n GLY 99 Ca 0.00 -1.13 -0.05 0.00 0.00 0.00 0.00 46.02 44.84 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 1.06 -0.83 4.61 0.00 -1.92 -2.44 119.26 117.74 1lud h ALA 100 Ca 0.00 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1lud h ALA 100 Cb 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.41 1lud h ALA 100 CO 0.00 0.58 0.54 0.37 0.00 0.00 0.00 179.25 180.74 1lud h GLN 101 N 1.16 0.93 0.00 0.00 4.15 -1.95 -1.69 115.11 117.71 1lud h GLN 101 Ca 0.29 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.57 1lud h GLN 101 Cb 0.04 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 1lud h GLN 101 CO -0.05 0.62 -0.40 0.82 -1.93 0.00 0.00 178.83 177.90 1lud h ILE 102 N 0.96 0.76 0.00 2.39 1.08 -1.67 -3.04 117.51 117.98 1lud h ILE 102 Ca 0.34 -1.79 -0.05 0.00 -0.39 0.00 0.00 64.86 62.97 1lud h ILE 102 Cb 0.14 2.17 -0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1lud h ILE 102 CO -0.11 0.39 -0.23 -0.26 -0.69 0.00 0.00 178.15 177.25 1lud h PHE 103 N 0.00 0.00 0.01 1.37 0.04 -1.00 -2.93 116.94 114.43 1lud h PHE 103 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1lud h PHE 103 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.29 1lud h PHE 103 CO 0.00 0.23 -0.04 1.15 -0.60 0.00 0.00 178.31 179.05 1lud h THR 104 N 0.00 1.76 -0.14 -1.55 2.02 -1.37 -0.60 112.91 113.02 1lud h THR 104 Ca -0.00 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 64.90 1lud h THR 104 Cb 0.90 3.31 -0.01 0.00 -1.74 0.00 0.00 68.15 70.60 1lud h THR 104 CO 0.03 0.59 0.09 0.00 0.37 0.00 0.00 175.52 176.61 1lud h ALA 105 N 0.04 1.90 -0.03 6.16 0.00 -1.59 -1.66 119.26 124.07 1lud h ALA 105 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1lud h ALA 105 Cb 1.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1lud h ALA 105 CO 0.01 0.10 -0.10 1.19 0.00 0.00 0.00 179.25 180.45 1lud n PHE 106 N -4.52 0.00 -0.30 0.00 3.01 -1.11 -4.44 117.46 110.12 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 0.08 -0.00 0.26 0.00 -0.01 0.00 0.00 39.48 39.81 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 4.08 0.94 -0.35 -1.08 2.10 -0.09 -2.05 116.57 120.11 1lud h LYS 107 Ca 0.00 -0.06 -0.13 0.00 -2.00 0.00 0.00 60.65 58.46 1lud h LYS 107 Cb 0.92 -0.21 -0.01 0.00 -0.90 0.00 0.00 32.23 32.02 1lud h LYS 107 CO 0.00 0.62 -0.32 0.22 -2.00 0.00 0.00 179.45 177.97 1lud h ASP 108 N 0.97 0.81 -3.81 7.07 3.58 -1.78 -3.36 116.42 119.90 1lud h ASP 108 Ca 0.40 -0.33 -0.78 0.00 0.42 0.00 0.00 57.03 56.74 1lud h ASP 108 Cb 0.29 -0.22 -0.28 0.00 1.72 0.00 0.00 39.33 40.84 1lud h ASP 108 CO -0.16 1.06 0.10 -1.81 -2.88 0.00 0.00 179.24 175.55 1lud s ASP 109 N -6.81 6.67 0.10 2.28 1.01 -0.77 -5.03 116.67 114.11 1lud s ASP 109 Ca -0.09 -2.91 0.09 0.00 0.71 0.00 0.00 52.55 50.35 1lud s ASP 109 Cb 0.12 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.86 1lud s ASP 109 CO 0.85 -0.48 -0.24 -0.69 0.21 0.00 0.00 175.17 174.82 1lud s VAL 110 N -0.18 1.94 0.00 -1.27 1.01 -1.25 -4.51 120.40 116.14 1lud s VAL 110 Ca 0.20 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.64 1lud s VAL 110 Cb -0.11 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1lud s VAL 110 CO -0.08 0.08 0.00 0.47 0.00 0.00 0.00 175.10 175.57 1lud n ASP 111 N 1.23 1.77 -3.81 3.32 8.00 0.40 -4.82 116.55 122.64 1lud n ASP 111 Ca -0.18 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.18 1lud n ASP 111 Cb 0.53 0.09 -0.15 0.00 -0.02 0.00 0.00 41.12 41.58 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lud s THR 112 N -1.40 -0.03 -0.14 -3.53 2.01 -1.09 -2.18 115.64 109.29 1lud s THR 112 Ca 0.00 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.12 1lud s THR 112 Cb 0.00 -0.08 -0.01 0.00 0.01 0.00 0.00 72.50 72.42 1lud s THR 112 CO 0.00 0.05 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.07 1lud s LEU 113 N 0.62 2.55 -0.28 4.42 1.43 -0.89 -0.38 118.68 126.15 1lud s LEU 113 Ca -0.05 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 1lud s LEU 113 Cb -0.07 -1.57 0.07 0.00 0.03 0.00 0.00 46.19 44.65 1lud s LEU 113 CO -0.02 0.13 -0.03 -0.76 0.23 0.00 0.00 176.35 175.90 1lud s LEU 114 N 0.53 3.50 -0.03 1.79 1.43 0.33 0.12 118.68 126.36 1lud s LEU 114 Ca -0.10 -1.58 0.06 0.00 -1.03 0.00 0.00 54.13 51.48 1lud s LEU 114 Cb -0.16 -1.42 -0.01 0.00 0.03 0.00 0.00 46.19 44.63 1lud s LEU 114 CO 0.04 -0.28 -0.21 0.54 0.23 0.00 0.00 176.35 176.67 1lud s VAL 115 N 1.16 1.71 -0.24 -1.59 0.11 -0.47 -1.38 120.40 119.71 1lud s VAL 115 Ca -0.01 -0.90 -0.07 0.00 -2.93 0.00 0.00 61.98 58.07 1lud s VAL 115 Cb -0.19 -1.44 -0.03 0.00 -1.53 0.00 0.00 36.38 33.19 1lud s VAL 115 CO -0.08 0.48 0.05 -0.89 -3.33 0.00 0.00 175.10 171.34 1lud s THR 116 N -0.30 4.20 -0.36 5.04 2.01 -0.57 -0.95 115.64 124.71 1lud s THR 116 Ca 0.03 -0.21 -0.13 0.00 0.31 0.00 0.00 61.69 61.69 1lud s THR 116 Cb -0.10 -2.95 -0.00 0.00 0.01 0.00 0.00 72.50 69.45 1lud s THR 116 CO 0.01 0.36 0.24 -0.13 -0.69 0.00 0.00 174.62 174.41 1lud s ARG 117 N 1.52 3.29 0.44 4.92 0.52 -0.76 -0.33 118.95 128.55 1lud s ARG 117 Ca 0.06 -0.79 -0.15 0.00 -0.52 0.00 0.00 55.73 54.34 1lud s ARG 117 Cb -0.15 -3.82 -0.08 0.00 0.52 0.00 0.00 34.95 31.42 1lud s ARG 117 CO 0.03 -0.54 0.87 -0.51 0.02 0.00 0.00 175.30 175.16 1lud s LEU 118 N 1.69 3.79 0.13 2.53 1.02 -0.75 -1.70 118.68 125.39 1lud s LEU 118 Ca 0.05 1.38 0.11 0.00 0.02 0.00 0.00 54.13 55.70 1lud s LEU 118 Cb -0.18 -4.27 -0.13 0.00 0.02 0.00 0.00 46.19 41.63 1lud s LEU 118 CO 0.10 -0.45 1.18 0.00 0.02 0.00 0.00 176.35 177.20 1lud h ALA 119 N 1.31 0.54 -2.42 4.21 0.00 -1.02 -2.67 119.26 119.20 1lud h ALA 119 Ca -0.47 -0.86 -0.47 0.00 0.00 0.00 0.00 54.91 53.11 1lud h ALA 119 Cb 1.18 0.01 0.13 0.00 0.00 0.00 0.00 17.79 19.11 1lud h ALA 119 CO 0.63 1.09 0.28 0.20 0.00 0.00 0.00 179.25 181.45 1lud s GLY 120 N -4.71 1.59 -0.19 0.00 0.00 -1.18 -4.75 107.32 98.09 1lud s GLY 120 Ca 0.01 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.40 1lud s GLY 120 CO 0.80 0.18 -0.13 -0.45 0.00 0.00 0.00 173.10 173.51 1lud s SER 121 N -3.79 3.37 0.28 1.64 0.15 -1.26 -3.45 113.70 110.63 1lud s SER 121 Ca 0.63 -0.84 0.09 0.00 0.70 0.00 0.00 55.95 56.52 1lud s SER 121 Cb -0.16 -1.31 -0.04 0.00 -1.71 0.00 0.00 66.02 62.80 1lud s SER 121 CO 0.55 -0.11 0.09 -0.36 1.20 0.00 0.00 173.24 174.61 1lud s PHE 122 N 1.35 2.81 0.28 3.44 0.40 -1.26 -5.08 117.98 119.93 1lud s PHE 122 Ca -0.00 -0.23 0.09 0.00 -0.60 0.00 0.00 56.93 56.18 1lud s PHE 122 Cb -0.16 -1.37 -0.04 0.00 0.51 0.00 0.00 43.02 41.96 1lud s PHE 122 CO -0.09 0.51 0.06 -1.21 0.70 0.00 0.00 175.22 175.19 1lud s GLU 123 N -3.77 2.40 0.00 0.44 2.02 -1.26 -4.87 118.70 113.66 1lud s GLU 123 Ca 0.34 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 53.92 1lud s GLU 123 Cb -0.06 -2.22 0.00 0.00 0.10 0.00 0.00 34.13 31.95 1lud s GLU 123 CO 0.22 0.30 0.00 0.41 0.02 0.00 0.00 175.26 176.21 1lud n GLY 124 N -1.00 0.90 0.00 -1.39 0.00 -1.26 -4.96 105.19 97.48 1lud n GLY 124 Ca -0.06 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.09 -4.36 1.61 9.92 -1.26 -5.04 116.55 117.51 1lud n ASP 125 Ca 0.00 -0.01 -0.34 0.00 -0.53 0.00 0.00 54.79 53.91 1lud n ASP 125 Cb 0.00 0.03 -0.14 0.00 -0.64 0.00 0.00 41.12 40.38 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 -0.05 3.45 0.29 -3.53 2.01 -1.26 -5.10 115.64 111.45 1lud s THR 126 Ca 0.00 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.54 1lud s THR 126 Cb 0.00 -2.54 -0.06 0.00 0.01 0.00 0.00 72.50 69.91 1lud s THR 126 CO 0.00 0.45 0.07 -0.54 -0.69 0.00 0.00 174.62 173.91 1lud s LYS 127 N 1.10 1.53 0.78 4.92 1.02 -1.26 -3.29 119.74 124.55 1lud s LYS 127 Ca 0.01 -1.84 -0.13 0.00 0.02 0.00 0.00 55.97 54.03 1lud s LYS 127 Cb -0.15 -0.59 0.07 0.00 -0.52 0.00 0.00 37.83 36.65 1lud s LYS 127 CO -0.00 -0.23 1.16 1.41 -0.92 0.00 0.00 175.35 176.77 1lud s MET 128 N -3.95 1.91 0.97 1.68 1.75 -1.24 -4.83 119.30 115.58 1lud s MET 128 Ca 0.37 1.59 -0.13 0.00 -1.25 0.00 0.00 55.69 56.26 1lud s MET 128 Cb 0.08 -1.82 0.17 0.00 2.84 0.00 0.00 34.83 36.10 1lud s MET 128 CO 0.14 -1.97 1.14 0.96 -0.65 0.00 0.00 175.02 174.64 1lud s ILE 129 N -2.33 1.95 -0.70 10.11 -4.36 -1.26 -4.94 121.20 119.67 1lud s ILE 129 Ca 0.70 0.00 -0.27 0.00 -0.26 0.00 0.00 60.65 60.82 1lud s ILE 129 Cb -0.25 -2.68 0.01 0.00 1.25 0.00 0.00 42.46 40.79 1lud s ILE 129 CO 0.50 0.00 1.52 -2.16 0.24 0.00 0.00 174.94 175.04 1lud s PRO 130 N -5.27 2.96 0.34 0.37 0.05 -1.26 -5.01 135.00 127.18 1lud s PRO 130 Ca 0.66 0.08 -0.06 0.00 0.05 0.00 0.00 61.00 61.73 1lud s PRO 130 Cb -0.14 -4.30 -0.05 0.00 0.05 0.00 0.00 34.50 30.06 1lud s PRO 130 CO 0.55 -2.40 0.63 -0.51 0.05 0.00 0.00 177.00 175.31 1lud s LEU 131 N 7.11 3.95 -1.20 -3.56 1.43 -1.26 -5.00 118.68 120.15 1lud s LEU 131 Ca 0.48 0.80 -0.07 0.00 -1.03 0.00 0.00 54.13 54.32 1lud s LEU 131 Cb -0.10 -3.65 0.22 0.00 0.03 0.00 0.00 46.19 42.69 1lud s LEU 131 CO 0.16 -0.30 1.80 -3.20 0.23 0.00 0.00 176.35 175.05 1lud n ASN 132 N -1.27 6.00 -0.17 2.29 5.15 -1.26 -4.79 115.26 121.22 1lud n ASN 132 Ca -0.01 -3.25 0.28 0.00 -0.60 0.00 0.00 54.58 51.00 1lud n ASN 132 Cb 0.54 -1.38 0.72 0.00 -0.53 0.00 0.00 39.78 39.14 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 5.41 0.00 0.00 1.20 4.06 -1.94 0.42 115.95 125.10 1lud h TRP 133 Ca 0.37 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.29 1lud h TRP 133 Cb 0.57 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.72 1lud h TRP 133 CO 1.22 0.00 -0.14 0.22 -3.56 0.00 0.00 178.44 176.18 1lud h ASP 134 N 0.00 0.00 0.39 -3.49 3.58 -2.04 -1.54 116.42 113.32 1lud h ASP 134 Ca 0.42 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.87 1lud h ASP 134 Cb 1.70 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.75 1lud h ASP 134 CO -0.00 0.14 -0.42 -0.67 -2.88 0.00 0.00 179.24 175.40 1lud n ASP 135 N -4.01 0.70 -4.60 2.28 2.03 0.14 -4.90 116.55 108.20 1lud n ASP 135 Ca -0.02 -0.50 -0.25 0.00 0.52 0.00 0.00 54.79 54.54 1lud n ASP 135 Cb 0.22 0.23 -0.09 0.00 -0.72 0.00 0.00 41.12 40.75 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 -2.82 2.49 -0.02 -0.67 0.40 -0.58 -3.74 117.98 113.04 1lud s PHE 136 Ca 0.16 -0.47 0.01 0.00 -0.60 0.00 0.00 56.93 56.02 1lud s PHE 136 Cb 0.18 -1.46 0.02 0.00 0.51 0.00 0.00 43.02 42.27 1lud s PHE 136 CO 0.64 0.52 -0.01 0.99 0.70 0.00 0.00 175.22 178.05 1lud s THR 137 N -2.56 0.22 -0.11 0.64 2.01 -1.10 -4.88 115.64 109.85 1lud s THR 137 Ca 0.34 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 62.04 1lud s THR 137 Cb 0.01 -0.27 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 1lud s THR 137 CO 0.18 0.13 1.49 -0.75 -0.69 0.00 0.00 174.62 174.97 1lud s LYS 138 N 0.66 4.18 -0.03 4.92 2.36 -1.26 -1.66 119.74 128.90 1lud s LYS 138 Ca -0.07 1.93 0.19 0.00 -2.55 0.00 0.00 55.97 55.48 1lud s LYS 138 Cb -0.10 -3.90 -0.23 0.00 -1.05 0.00 0.00 37.83 32.56 1lud s LYS 138 CO -0.01 -0.82 0.51 1.33 1.55 0.00 0.00 175.35 177.91 1lud n VAL 139 N 5.50 0.81 -3.79 4.02 0.24 0.53 -4.94 118.33 120.70 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 -0.39 -0.11 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 -5.25 -0.25 -0.18 -1.34 0.01 -1.16 -5.04 113.70 100.49 1lud s SER 140 Ca -0.06 0.49 -0.19 0.00 1.31 0.00 0.00 55.95 57.49 1lud s SER 140 Cb 0.10 0.50 0.05 0.00 0.21 0.00 0.00 66.02 66.88 1lud s SER 140 CO 0.85 -0.10 0.53 -0.55 0.41 0.00 0.00 173.24 174.38 1lud s SER 141 N 0.09 -0.54 -0.03 2.44 0.15 -1.26 -0.57 113.70 113.98 1lud s SER 141 Ca -0.00 1.01 0.02 0.00 0.70 0.00 0.00 55.95 57.68 1lud s SER 141 Cb -0.02 1.03 0.01 0.00 -1.71 0.00 0.00 66.02 65.32 1lud s SER 141 CO 0.00 -0.22 -0.08 -0.60 1.20 0.00 0.00 173.24 173.55 1lud s ARG 142 N 0.13 0.88 -0.20 5.44 3.52 -0.81 -4.95 118.95 122.95 1lud s ARG 142 Ca -0.01 -0.24 -0.07 0.00 -0.13 0.00 0.00 55.73 55.27 1lud s ARG 142 Cb -0.04 -0.83 -0.04 0.00 -1.56 0.00 0.00 34.95 32.49 1lud s ARG 142 CO 0.01 0.07 0.07 0.99 -0.81 0.00 0.00 175.30 175.62 1lud s THR 143 N 0.33 4.69 -0.09 4.11 2.01 -1.26 -0.72 115.64 124.70 1lud s THR 143 Ca -0.05 -0.06 0.02 0.00 0.31 0.00 0.00 61.69 61.91 1lud s THR 143 Cb -0.09 -3.13 0.01 0.00 0.01 0.00 0.00 72.50 69.30 1lud s THR 143 CO 0.00 0.43 -0.16 0.54 -0.69 0.00 0.00 174.62 174.75 1lud s VAL 144 N 0.66 1.47 0.48 3.82 0.11 -0.91 -5.02 120.40 121.02 1lud s VAL 144 Ca 0.03 -0.65 -0.04 0.00 -2.93 0.00 0.00 61.98 58.39 1lud s VAL 144 Cb -0.13 -1.33 -0.02 0.00 -1.53 0.00 0.00 36.38 33.36 1lud s VAL 144 CO 0.02 0.43 0.77 -1.61 -3.33 0.00 0.00 175.10 171.38 1lud s GLU 145 N 0.79 3.37 0.05 1.54 2.02 -1.26 -2.87 118.70 122.33 1lud s GLU 145 Ca -0.11 0.03 -0.00 0.00 0.02 0.00 0.00 54.97 54.91 1lud s GLU 145 Cb -0.16 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1lud s GLU 145 CO 0.02 -0.27 -0.04 0.34 0.02 0.00 0.00 175.26 175.33 1lud s ASP 146 N -4.15 0.50 0.29 -0.19 2.15 -1.26 -4.94 116.67 109.07 1lud s ASP 146 Ca 0.48 -0.86 0.19 0.00 0.43 0.00 0.00 52.55 52.78 1lud s ASP 146 Cb -0.10 0.16 1.01 0.00 -0.30 0.00 0.00 42.92 43.69 1lud s ASP 146 CO 0.43 -0.50 1.56 0.35 -0.17 0.00 0.00 175.17 176.84 1lud n THR 147 N 0.51 1.09 -4.11 1.71 -2.24 -1.26 -4.36 114.28 105.62 1lud n THR 147 Ca -0.17 0.72 -0.35 0.00 -2.27 0.00 0.00 64.05 61.98 1lud n THR 147 Cb 0.59 -1.72 -0.13 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 -3.86 4.60 0.25 3.42 3.84 -1.26 -5.00 114.94 116.92 1lud s ASN 148 Ca -0.02 -0.26 -0.07 0.00 0.21 0.00 0.00 52.86 52.72 1lud s ASN 148 Cb 0.05 -1.78 0.44 0.00 -0.55 0.00 0.00 41.25 39.41 1lud s ASN 148 CO 0.17 0.06 1.64 -0.65 -2.79 0.00 0.00 177.10 175.52 1lud h PRO 149 N 7.55 0.10 0.04 0.43 0.10 -1.99 -0.84 132.00 137.39 1lud h PRO 149 Ca -0.36 -0.01 -0.23 0.00 0.10 0.00 0.00 66.00 65.50 1lud h PRO 149 Cb 1.18 -0.02 -0.02 0.00 0.10 0.00 0.00 31.00 32.24 1lud h PRO 149 CO 0.60 0.07 -1.07 0.00 0.10 0.00 0.00 178.00 177.70 1lud h ALA 150 N 1.71 0.28 0.00 -0.75 0.00 -1.93 -3.20 119.26 115.37 1lud h ALA 150 Ca 0.41 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1lud h ALA 150 Cb 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1lud h ALA 150 CO -0.66 1.13 0.00 1.28 0.00 0.00 0.00 179.25 181.00 1lud n LEU 151 N -3.44 0.00 -4.78 0.00 4.77 -0.36 -3.07 117.00 110.13 1lud n LEU 151 Ca -0.03 0.17 -0.36 0.00 -0.03 0.00 0.00 56.01 55.77 1lud n LEU 151 Cb 0.95 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.86 1lud n LEU 151 CO 0.49 -0.09 0.79 -0.89 -1.33 0.00 0.00 177.39 176.36 1lud s THR 152 N -2.35 3.23 0.13 -5.08 2.01 -0.98 -4.68 115.64 107.92 1lud s THR 152 Ca 0.17 0.83 -0.25 0.00 0.31 0.00 0.00 61.69 62.75 1lud s THR 152 Cb 0.10 -3.38 0.07 0.00 0.01 0.00 0.00 72.50 69.31 1lud s THR 152 CO 0.21 -0.10 1.02 -1.38 -0.69 0.00 0.00 174.62 173.67 1lud s HIS 153 N -1.70 -0.09 0.10 4.92 -3.43 -1.14 -0.71 115.29 113.24 1lud s HIS 153 Ca 0.68 -0.19 0.05 0.00 -0.80 0.00 0.00 55.06 54.79 1lud s HIS 153 Cb -0.25 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.50 1lud s HIS 153 CO 0.29 -0.76 -0.13 0.99 -2.00 0.00 0.00 174.74 173.14 1lud s THR 154 N -3.04 1.12 -0.23 -5.38 2.01 -0.69 -2.14 115.64 107.29 1lud s THR 154 Ca 0.14 -1.55 -0.07 0.00 0.31 0.00 0.00 61.69 60.52 1lud s THR 154 Cb -0.01 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 1lud s THR 154 CO 0.02 -0.40 0.06 -0.31 -0.69 0.00 0.00 174.62 173.30 1lud s TYR 155 N -1.94 3.11 -0.17 4.92 2.02 0.10 -1.82 117.35 123.57 1lud s TYR 155 Ca 0.04 -0.30 -0.00 0.00 -0.37 0.00 0.00 57.07 56.44 1lud s TYR 155 Cb -0.06 -2.18 0.00 0.00 -0.40 0.00 0.00 41.96 39.32 1lud s TYR 155 CO 0.02 -0.22 -0.14 -1.21 -1.57 0.00 0.00 175.55 172.43 1lud s GLU 156 N 1.23 3.20 -0.16 -0.62 2.02 -0.13 -1.92 118.70 122.31 1lud s GLU 156 Ca 0.04 -0.75 -0.01 0.00 0.02 0.00 0.00 54.97 54.28 1lud s GLU 156 Cb -0.14 -2.68 -0.01 0.00 0.10 0.00 0.00 34.13 31.39 1lud s GLU 156 CO 0.03 -0.07 -0.11 0.08 0.02 0.00 0.00 175.26 175.22 1lud s VAL 157 N 1.03 3.12 0.34 2.63 1.01 0.27 -1.37 120.40 127.44 1lud s VAL 157 Ca -0.01 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.44 1lud s VAL 157 Cb -0.15 -2.35 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 1lud s VAL 157 CO -0.03 0.50 0.00 0.26 0.00 0.00 0.00 175.10 175.82 1lud s TRP 158 N 0.72 2.53 0.01 5.22 0.52 0.12 -0.34 118.94 127.72 1lud s TRP 158 Ca -0.05 -0.45 0.01 0.00 0.02 0.00 0.00 56.10 55.64 1lud s TRP 158 Cb -0.15 -1.49 -0.01 0.00 -1.15 0.00 0.00 33.47 30.67 1lud s TRP 158 CO 0.02 0.48 -0.05 -0.65 0.02 0.00 0.00 176.95 176.78 1lud s GLN 159 N -3.71 0.35 0.02 4.98 -0.21 -0.66 -2.11 119.66 118.33 1lud s GLN 159 Ca 0.35 -0.37 -0.30 0.00 0.02 0.00 0.00 55.36 55.06 1lud s GLN 159 Cb 0.00 -0.22 -0.05 0.00 1.00 0.00 0.00 33.01 33.75 1lud s GLN 159 CO 0.19 0.05 1.16 0.21 -2.12 0.00 0.00 175.29 174.78 1lud s LYS 160 N -0.69 4.44 0.55 2.91 2.20 -0.92 -2.72 119.74 125.50 1lud s LYS 160 Ca -0.04 1.68 0.01 0.00 -0.36 0.00 0.00 55.97 57.26 1lud s LYS 160 Cb -0.05 -3.42 0.03 0.00 -1.51 0.00 0.00 37.83 32.89 1lud s LYS 160 CO -0.00 -0.26 0.77 0.15 -0.36 0.00 0.00 175.35 175.65 1lud s LYS 161 N 1.32 2.57 0.00 4.03 1.02 -1.25 -5.01 119.74 122.43 1lud s LYS 161 Ca 0.57 -0.76 0.00 0.00 0.02 0.00 0.00 55.97 55.79 1lud s LYS 161 Cb -0.27 -2.49 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 1lud s LYS 161 CO 0.27 -0.69 0.00 0.00 -0.92 0.00 0.00 175.35 174.01