#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 1.56 -0.16 2.41 0.00 0.11 0.12 121.76 125.80 1lud s ALA 2 Ca 0.00 -1.28 -0.07 0.00 0.00 0.00 0.00 51.96 50.61 1lud s ALA 2 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 1lud s ALA 2 CO 0.00 0.16 0.07 -0.06 0.00 0.00 0.00 175.76 175.93 1lud s PHE 3 N -1.91 3.31 -0.50 0.00 0.40 0.01 0.18 117.98 119.47 1lud s PHE 3 Ca 0.08 0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.63 1lud s PHE 3 Cb -0.06 -2.03 0.16 0.00 0.51 0.00 0.00 43.02 41.59 1lud s PHE 3 CO 0.04 0.29 0.34 -1.17 0.70 0.00 0.00 175.22 175.41 1lud s LEU 4 N 0.02 2.82 0.02 -0.37 2.96 -0.87 0.15 118.68 123.41 1lud s LEU 4 Ca 0.06 -3.08 0.03 0.00 -0.22 0.00 0.00 54.13 50.93 1lud s LEU 4 Cb -0.12 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.56 1lud s LEU 4 CO 0.01 -0.19 -0.10 -1.66 -1.32 0.00 0.00 176.35 173.08 1lud s TRP 5 N -0.21 0.91 -0.20 5.38 -2.14 -0.89 -4.66 118.94 117.14 1lud s TRP 5 Ca 0.24 -0.29 -0.11 0.00 2.66 0.00 0.00 56.10 58.60 1lud s TRP 5 Cb -0.10 -0.55 -0.05 0.00 -3.10 0.00 0.00 33.47 29.66 1lud s TRP 5 CO -0.10 -0.01 0.17 0.00 -2.66 0.00 0.00 176.95 174.35 1lud s ALA 6 N -0.69 3.66 0.14 2.67 0.00 -1.26 -2.63 121.76 123.65 1lud s ALA 6 Ca -0.00 -0.67 0.05 0.00 0.00 0.00 0.00 51.96 51.34 1lud s ALA 6 Cb -0.06 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 1lud s ALA 6 CO 0.00 0.09 -0.11 1.14 0.00 0.00 0.00 175.76 176.88 1lud s GLN 7 N 0.49 1.03 0.06 0.00 -2.07 -0.02 -4.56 119.66 114.59 1lud s GLN 7 Ca 0.10 -1.36 -0.01 0.00 -1.82 0.00 0.00 55.36 52.27 1lud s GLN 7 Cb -0.12 -0.70 0.01 0.00 -1.09 0.00 0.00 33.01 31.12 1lud s GLN 7 CO 0.00 0.10 0.08 -0.40 -1.32 0.00 0.00 175.29 173.76 1lud n ASP 8 N 0.09 0.05 -0.29 12.60 5.68 -1.19 -1.53 116.55 131.97 1lud n ASP 8 Ca -0.12 -1.06 -0.00 0.00 -0.50 0.00 0.00 54.79 53.10 1lud n ASP 8 Cb 0.59 -0.06 0.12 0.00 -1.14 0.00 0.00 41.12 40.64 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 0.89 0.00 0.11 -0.00 -1.38 -1.89 114.38 112.11 1lud h ARG 9 Ca -0.03 -0.05 -0.14 0.00 -0.00 0.00 0.00 59.98 59.76 1lud h ARG 9 Cb 0.09 -0.20 -0.02 0.00 -0.00 0.00 0.00 29.97 29.84 1lud h ARG 9 CO 0.02 0.59 -0.67 -0.44 -0.00 0.00 0.00 179.97 179.48 1lud h ASP 10 N 0.92 0.00 0.00 0.08 3.32 -1.90 -3.47 116.42 115.36 1lud h ASP 10 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1lud h ASP 10 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1lud h ASP 10 CO -0.16 0.67 0.00 0.61 -1.72 0.00 0.00 179.24 178.63 1lud n GLY 11 N 0.46 0.99 3.93 2.75 0.00 -0.71 -5.09 105.19 107.51 1lud n GLY 11 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 3.50 0.07 0.99 2.96 -1.26 -3.43 118.68 121.51 1lud s LEU 12 Ca 0.00 0.58 0.00 0.00 -0.22 0.00 0.00 54.13 54.49 1lud s LEU 12 Cb 0.00 -3.45 0.00 0.00 0.50 0.00 0.00 46.19 43.24 1lud s LEU 12 CO 0.00 -0.80 0.00 2.30 -1.32 0.00 0.00 176.35 176.53 1lud n ILE 13 N -2.29 0.17 -3.64 6.68 -5.35 -1.23 -3.18 119.36 110.52 1lud n ILE 13 Ca 0.02 0.06 -0.15 0.00 -0.27 0.00 0.00 62.75 62.40 1lud n ILE 13 Cb 0.57 -0.60 -0.07 0.00 -1.74 0.00 0.00 39.64 37.79 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 -3.88 -0.40 -0.02 3.28 0.00 -1.24 -4.54 107.32 100.52 1lud s GLY 14 Ca 0.00 1.05 0.03 0.00 0.00 0.00 0.00 44.72 45.80 1lud s GLY 14 CO 0.00 0.77 -0.11 1.25 0.00 0.00 0.00 173.10 175.01 1lud s LYS 15 N -0.88 1.11 -1.42 2.90 2.36 -1.19 -4.07 119.74 118.55 1lud s LYS 15 Ca -0.09 -0.40 -0.00 0.00 -2.55 0.00 0.00 55.97 52.93 1lud s LYS 15 Cb -0.03 -1.03 0.00 0.00 -1.05 0.00 0.00 37.83 35.72 1lud s LYS 15 CO 0.06 0.18 0.00 -0.25 1.55 0.00 0.00 175.35 176.89 1lud n ASP 16 N 3.11 -4.91 0.00 1.43 9.92 -1.26 -3.74 116.55 121.09 1lud n ASP 16 Ca -0.17 -0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.08 1lud n ASP 16 Cb 0.54 -4.02 0.00 0.00 -0.64 0.00 0.00 41.12 37.01 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 -1.02 2.11 0.00 0.44 0.00 -1.26 -4.94 105.19 100.52 1lud n GLY 17 Ca -0.20 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.30 -4.20 1.61 1.44 -1.25 -4.96 115.22 106.57 1lud n HIS 18 Ca 0.00 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.49 1lud n HIS 18 Cb 0.00 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 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 3.46 0.07 2.39 1.43 -1.26 -3.18 118.68 121.58 1lud s LEU 19 Ca 0.00 -0.49 -0.03 0.00 -1.03 0.00 0.00 54.13 52.58 1lud s LEU 19 Cb 0.00 -1.98 -0.27 0.00 0.03 0.00 0.00 46.19 43.96 1lud s LEU 19 CO 0.00 -0.04 1.10 1.55 0.23 0.00 0.00 176.35 179.19 1lud h PRO 20 N 1.69 0.24 -6.45 1.29 0.14 -1.87 -3.45 132.00 123.59 1lud h PRO 20 Ca -0.46 -0.41 -0.65 0.00 0.14 0.00 0.00 66.00 64.63 1lud h PRO 20 Cb 1.25 0.15 -0.27 0.00 0.14 0.00 0.00 31.00 32.27 1lud h PRO 20 CO 0.61 1.17 -0.87 1.67 0.14 0.00 0.00 178.00 180.72 1lud s TRP 21 N -2.65 2.11 -0.69 1.56 -2.14 -1.26 -5.04 118.94 110.83 1lud s TRP 21 Ca -0.04 -0.40 -0.18 0.00 2.66 0.00 0.00 56.10 58.14 1lud s TRP 21 Cb 0.07 -1.28 0.13 0.00 -3.10 0.00 0.00 33.47 29.29 1lud s TRP 21 CO 0.87 0.08 0.77 -1.58 -2.66 0.00 0.00 176.95 174.44 1lud s HIS 22 N -0.75 3.18 -0.27 1.66 2.46 -1.26 -4.99 115.29 115.33 1lud s HIS 22 Ca 0.10 -1.26 0.01 0.00 0.47 0.00 0.00 55.06 54.38 1lud s HIS 22 Cb -0.09 -4.01 0.07 0.00 -0.13 0.00 0.00 32.58 28.42 1lud s HIS 22 CO 0.01 -1.25 -0.01 -1.17 -2.47 0.00 0.00 174.74 169.86 1lud s LEU 23 N 2.12 2.85 0.17 8.88 2.96 -1.26 -4.98 118.68 129.41 1lud s LEU 23 Ca 0.16 -1.42 -0.09 0.00 -0.22 0.00 0.00 54.13 52.56 1lud s LEU 23 Cb -0.19 -1.18 0.03 0.00 0.50 0.00 0.00 46.19 45.35 1lud s LEU 23 CO 0.00 -0.30 1.54 1.55 -1.32 0.00 0.00 176.35 177.83 1lud h PRO 24 N 7.93 0.94 -0.07 0.98 0.14 -1.99 -2.81 132.00 137.12 1lud h PRO 24 Ca -0.15 -0.43 0.02 0.00 0.14 0.00 0.00 66.00 65.59 1lud h PRO 24 Cb 1.05 -0.02 -0.00 0.00 0.14 0.00 0.00 31.00 32.17 1lud h PRO 24 CO 0.44 1.09 0.07 0.22 0.14 0.00 0.00 178.00 179.96 1lud h ASP 25 N 0.80 0.00 0.20 1.44 3.58 -1.97 -1.55 116.42 118.92 1lud h ASP 25 Ca 0.09 0.00 -0.26 0.00 0.42 0.00 0.00 57.03 57.28 1lud h ASP 25 Cb 0.84 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.92 1lud h ASP 25 CO 0.07 0.00 -1.16 -0.78 -2.88 0.00 0.00 179.24 174.50 1lud h ASP 26 N 0.00 0.66 -0.74 2.28 3.58 -1.91 -3.01 116.42 117.27 1lud h ASP 26 Ca 0.03 -0.94 0.07 0.00 0.42 0.00 0.00 57.03 56.62 1lud h ASP 26 Cb 0.18 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 40.95 1lud h ASP 26 CO -0.00 1.56 0.42 -0.07 -2.88 0.00 0.00 179.24 178.27 1lud h LEU 27 N -0.12 0.61 -0.74 2.28 3.38 -1.19 0.41 115.31 119.94 1lud h LEU 27 Ca -0.20 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1lud h LEU 27 Cb 1.91 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 42.54 1lud h LEU 27 CO 0.21 0.38 0.44 0.45 0.09 0.00 0.00 178.44 180.01 1lud h HIS 28 N 0.74 0.99 -0.26 1.13 3.86 -1.44 -0.42 115.15 119.75 1lud h HIS 28 Ca 0.34 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.51 1lud h HIS 28 Cb 0.26 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 1lud h HIS 28 CO -0.07 0.67 -0.01 -0.92 0.86 0.00 0.00 177.93 178.46 1lud h TYR 29 N 1.02 0.40 0.01 2.45 3.20 -1.01 0.13 116.97 123.16 1lud h TYR 29 Ca 0.27 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1lud h TYR 29 Cb -0.02 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.13 1lud h TYR 29 CO -0.01 0.41 -0.00 0.35 -1.64 0.00 0.00 178.16 177.27 1lud h PHE 30 N 0.38 -0.01 -0.68 -3.82 3.57 0.31 0.57 116.94 117.25 1lud h PHE 30 Ca 0.09 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1lud h PHE 30 Cb 0.27 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1lud h PHE 30 CO 0.01 0.41 0.18 -0.09 -2.23 0.00 0.00 178.31 176.58 1lud h ARG 31 N -0.43 1.09 -0.41 1.11 2.43 -0.83 -2.49 114.38 114.85 1lud h ARG 31 Ca -0.00 -0.25 -0.09 0.00 -0.81 0.00 0.00 59.98 58.82 1lud h ARG 31 Cb 0.42 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1lud h ARG 31 CO 0.00 0.96 -0.11 0.00 -1.51 0.00 0.00 179.97 179.31 1lud h ALA 32 N 1.08 0.56 0.00 2.80 0.00 -0.71 -2.69 119.26 120.30 1lud h ALA 32 Ca 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1lud h ALA 32 Cb 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lud h ALA 32 CO 0.00 0.45 0.00 1.04 0.00 0.00 0.00 179.25 180.74 1lud n GLN 33 N -4.31 0.07 -0.51 0.00 1.13 0.19 -2.77 117.38 111.17 1lud n GLN 33 Ca -0.01 0.31 0.06 0.00 -1.94 0.00 0.00 57.00 55.42 1lud n GLN 33 Cb 0.37 -1.63 0.20 0.00 0.11 0.00 0.00 30.24 29.29 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 -1.75 2.18 -2.62 5.09 -2.24 -0.95 -4.91 114.28 109.08 1lud n THR 34 Ca 0.03 -2.97 -0.43 0.00 -2.27 0.00 0.00 64.05 58.40 1lud n THR 34 Cb 0.19 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.15 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 -3.16 4.40 -0.11 2.28 -7.23 -1.11 -3.29 120.40 112.18 1lud s VAL 35 Ca 0.37 1.56 0.00 0.00 -1.81 0.00 0.00 61.98 62.10 1lud s VAL 35 Cb 0.35 -4.47 0.00 0.00 0.56 0.00 0.00 36.38 32.83 1lud s VAL 35 CO -0.04 -0.65 0.00 0.61 -0.31 0.00 0.00 175.10 174.71 1lud n GLY 36 N 4.20 0.49 3.55 2.32 0.00 -1.23 -5.03 105.19 109.50 1lud n GLY 36 Ca 0.12 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.01 1.81 -0.20 1.61 1.02 -1.21 -4.64 119.74 117.12 1lud s LYS 37 Ca 0.00 -1.97 -0.29 0.00 0.02 0.00 0.00 55.97 53.74 1lud s LYS 37 Cb 0.00 -1.56 0.00 0.00 -0.52 0.00 0.00 37.83 35.75 1lud s LYS 37 CO 0.00 0.05 1.01 0.42 -0.92 0.00 0.00 175.35 175.91 1lud s ILE 38 N -2.73 4.72 -0.36 2.17 1.01 -1.08 -3.47 121.20 121.46 1lud s ILE 38 Ca 0.33 1.99 -0.11 0.00 0.00 0.00 0.00 60.65 62.86 1lud s ILE 38 Cb 0.05 -4.29 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1lud s ILE 38 CO 0.16 -0.13 0.20 -0.32 0.00 0.00 0.00 174.94 174.85 1lud s MET 39 N 2.91 2.99 -0.27 2.79 1.75 -0.28 0.59 119.30 129.77 1lud s MET 39 Ca 0.44 -0.97 -0.18 0.00 -1.25 0.00 0.00 55.69 53.73 1lud s MET 39 Cb -0.16 -3.70 -0.02 0.00 2.84 0.00 0.00 34.83 33.79 1lud s MET 39 CO 0.09 -0.62 0.53 0.08 -0.65 0.00 0.00 175.02 174.45 1lud s VAL 40 N 1.58 5.05 -0.05 10.11 1.01 0.46 0.38 120.40 138.94 1lud s VAL 40 Ca 0.03 0.88 0.01 0.00 0.00 0.00 0.00 61.98 62.90 1lud s VAL 40 Cb -0.19 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.36 1lud s VAL 40 CO 0.07 0.05 -0.07 0.68 0.00 0.00 0.00 175.10 175.83 1lud s VAL 41 N 2.35 0.77 0.69 2.92 -7.23 -0.34 0.12 120.40 119.68 1lud s VAL 41 Ca 0.22 -0.26 -0.16 0.00 -1.81 0.00 0.00 61.98 59.97 1lud s VAL 41 Cb -0.16 -0.75 0.02 0.00 0.56 0.00 0.00 36.38 36.05 1lud s VAL 41 CO 0.09 0.28 1.17 -0.83 -0.31 0.00 0.00 175.10 175.50 1lud s GLY 42 N 0.82 2.33 0.65 2.32 0.00 -0.49 -1.84 107.32 111.11 1lud s GLY 42 Ca -0.12 0.78 0.26 0.00 0.00 0.00 0.00 44.72 45.64 1lud s GLY 42 CO 0.01 1.17 1.79 -0.09 0.00 0.00 0.00 173.10 175.98 1lud h ARG 43 N -0.01 0.00 0.09 2.90 1.12 -1.45 0.36 114.38 117.39 1lud h ARG 43 Ca -0.48 0.00 -0.14 0.00 -1.11 0.00 0.00 59.98 58.25 1lud h ARG 43 Cb 1.28 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.25 1lud h ARG 43 CO 0.52 0.00 -0.67 0.00 -3.11 0.00 0.00 179.97 176.71 1lud h ARG 44 N 0.00 0.20 -0.23 0.20 3.08 -1.88 -2.90 114.38 112.84 1lud h ARG 44 Ca 0.07 -0.34 -0.15 0.00 0.07 0.00 0.00 59.98 59.62 1lud h ARG 44 Cb 1.01 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 1lud h ARG 44 CO -0.00 1.16 -0.49 1.15 -1.07 0.00 0.00 179.97 180.72 1lud h THR 45 N -0.57 1.31 0.06 2.04 2.02 -1.52 -2.29 112.91 113.96 1lud h THR 45 Ca -0.13 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.35 1lud h THR 45 Cb 1.46 1.66 -0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1lud h THR 45 CO 0.08 0.54 -0.05 0.22 0.37 0.00 0.00 175.52 176.68 1lud h TYR 46 N 0.49 -0.13 0.00 3.16 3.20 -1.10 0.44 116.97 123.03 1lud h TYR 46 Ca 0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1lud h TYR 46 Cb 1.03 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.35 1lud h TYR 46 CO 0.05 -0.08 0.00 0.93 -1.64 0.00 0.00 178.16 177.41 1lud h GLU 47 N -0.12 0.00 0.00 1.82 3.07 -1.48 -2.04 114.58 115.83 1lud h GLU 47 Ca 0.00 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.70 1lud h GLU 47 Cb 0.11 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.00 1lud h GLU 47 CO -0.01 0.00 -1.49 -1.13 -1.40 0.00 0.00 179.01 174.98 1lud n SER 48 N -2.50 0.76 -4.45 1.42 3.41 -0.23 -4.94 113.62 107.09 1lud n SER 48 Ca 0.00 0.33 -0.42 0.00 -0.26 0.00 0.00 58.87 58.52 1lud n SER 48 Cb 0.18 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 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 -2.83 -0.48 0.05 7.33 3.72 0.14 -4.93 117.46 120.45 1lud n PHE 49 Ca -0.10 0.63 -0.04 0.00 -0.05 0.00 0.00 57.45 57.90 1lud n PHE 49 Cb 0.83 -1.99 -0.02 0.00 -0.94 0.00 0.00 39.48 37.36 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 0.86 -0.22 -4.37 -1.08 0.13 -1.90 -3.43 132.00 121.99 1lud h PRO 50 Ca -0.39 0.02 -0.65 0.00 -0.87 0.00 0.00 66.00 64.10 1lud h PRO 50 Cb 1.40 0.05 -0.40 0.00 0.13 0.00 0.00 31.00 32.18 1lud h PRO 50 CO 0.52 -0.15 -0.70 0.21 -0.23 0.00 0.00 178.00 177.65 1lud s LYS 51 N -2.29 1.56 0.06 0.86 2.47 -1.26 -5.09 119.74 116.05 1lud s LYS 51 Ca -0.03 -2.01 0.05 0.00 -1.56 0.00 0.00 55.97 52.41 1lud s LYS 51 Cb 0.00 -3.19 -0.03 0.00 -1.46 0.00 0.00 37.83 33.16 1lud s LYS 51 CO 0.10 -0.98 -0.14 -0.98 0.16 0.00 0.00 175.35 173.51 1lud s ARG 52 N 0.67 0.88 0.84 4.03 1.70 -1.26 -4.31 118.95 121.50 1lud s ARG 52 Ca 0.12 -0.88 -0.13 0.00 -0.47 0.00 0.00 55.73 54.38 1lud s ARG 52 Cb -0.20 -0.90 0.11 0.00 -0.57 0.00 0.00 34.95 33.39 1lud s ARG 52 CO -0.07 0.21 1.21 -1.25 -1.08 0.00 0.00 175.30 174.32 1lud s PRO 53 N -1.48 1.62 0.33 3.89 0.04 -1.26 -5.14 135.00 133.00 1lud s PRO 53 Ca -0.00 -0.05 -0.12 0.00 0.04 0.00 0.00 61.00 60.87 1lud s PRO 53 Cb -0.09 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.44 1lud s PRO 53 CO 0.02 -1.80 0.71 -0.51 0.04 0.00 0.00 177.00 175.46 1lud s LEU 54 N -5.65 4.01 0.36 -3.56 1.43 -1.26 -5.06 118.68 108.96 1lud s LEU 54 Ca 0.65 1.15 -0.25 0.00 -1.03 0.00 0.00 54.13 54.65 1lud s LEU 54 Cb -0.09 -3.97 -0.09 0.00 0.03 0.00 0.00 46.19 42.06 1lud s LEU 54 CO 0.50 -0.24 1.03 -2.16 0.23 0.00 0.00 176.35 175.71 1lud s PRO 55 N -3.24 4.36 -0.97 1.29 0.04 -1.26 -3.61 135.00 131.61 1lud s PRO 55 Ca 0.52 1.51 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 1lud s PRO 55 Cb -0.10 -2.72 0.03 0.00 0.04 0.00 0.00 34.50 31.75 1lud s PRO 55 CO 0.23 0.03 0.19 0.39 0.04 0.00 0.00 177.00 177.88 1lud n GLU 56 N 0.31 -2.75 -3.85 4.56 1.02 -1.26 -4.92 120.64 113.75 1lud n GLU 56 Ca 0.03 0.43 -0.12 0.00 -0.02 0.00 0.00 57.16 57.48 1lud n GLU 56 Cb 0.49 -5.05 -0.13 0.00 -0.02 0.00 0.00 31.44 26.73 1lud n GLU 56 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1lud s ARG 57 N -5.44 0.13 -0.18 3.49 3.00 -1.24 -3.55 118.95 115.16 1lud s ARG 57 Ca 0.17 0.03 -0.17 0.00 0.00 0.00 0.00 55.73 55.75 1lud s ARG 57 Cb -0.09 0.06 -0.04 0.00 0.00 0.00 0.00 34.95 34.88 1lud s ARG 57 CO 0.20 -0.02 0.46 0.99 0.00 0.00 0.00 175.30 176.93 1lud s THR 58 N -0.15 5.16 -0.07 0.02 2.01 -1.23 -4.67 115.64 116.71 1lud s THR 58 Ca -0.02 0.85 0.05 0.00 0.31 0.00 0.00 61.69 62.88 1lud s THR 58 Cb -0.02 -3.79 -0.00 0.00 0.01 0.00 0.00 72.50 68.70 1lud s THR 58 CO 0.00 0.24 -0.22 0.20 -0.69 0.00 0.00 174.62 174.15 1lud s ASN 59 N 0.99 2.82 -0.08 3.53 0.01 -1.26 -1.13 114.94 119.82 1lud s ASN 59 Ca 0.22 -0.49 0.04 0.00 -0.71 0.00 0.00 52.86 51.92 1lud s ASN 59 Cb -0.15 -1.02 -0.01 0.00 0.41 0.00 0.00 41.25 40.48 1lud s ASN 59 CO 0.09 0.18 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.97 1lud s VAL 60 N 0.13 2.53 0.03 1.60 1.01 0.16 -0.35 120.40 125.52 1lud s VAL 60 Ca -0.11 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1lud s VAL 60 Cb -0.15 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1lud s VAL 60 CO 0.05 0.56 0.14 -0.69 0.00 0.00 0.00 175.10 175.16 1lud s VAL 61 N -0.05 5.01 -0.18 2.92 1.01 -0.70 -1.20 120.40 127.21 1lud s VAL 61 Ca -0.05 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1lud s VAL 61 Cb -0.14 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.88 1lud s VAL 61 CO 0.04 0.23 -0.19 -0.76 0.00 0.00 0.00 175.10 174.42 1lud s LEU 62 N -2.16 2.18 0.09 3.92 1.02 -0.77 -1.98 118.68 120.99 1lud s LEU 62 Ca 0.29 -0.63 -0.12 0.00 0.02 0.00 0.00 54.13 53.69 1lud s LEU 62 Cb -0.12 -1.50 0.01 0.00 0.02 0.00 0.00 46.19 44.60 1lud s LEU 62 CO 0.21 0.00 0.27 0.28 0.02 0.00 0.00 176.35 177.13 1lud s THR 63 N 1.27 0.11 -1.52 5.49 -1.32 -1.10 -1.03 115.64 117.54 1lud s THR 63 Ca 0.04 -0.93 0.16 0.00 -1.21 0.00 0.00 61.69 59.76 1lud s THR 63 Cb -0.13 -1.23 0.55 0.00 -1.51 0.00 0.00 72.50 70.19 1lud s THR 63 CO -0.12 -0.51 1.45 1.41 -2.21 0.00 0.00 174.62 174.64 1lud n HIS 64 N -0.01 1.04 -1.78 9.09 8.25 -1.26 -4.25 115.22 126.29 1lud n HIS 64 Ca -0.16 -0.44 -0.27 0.00 -0.26 0.00 0.00 57.72 56.59 1lud n HIS 64 Cb 0.62 -0.13 0.19 0.00 1.12 0.00 0.00 29.99 31.80 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 0.99 -1.31 0.00 -0.41 3.00 -1.26 -5.03 117.38 113.37 1lud n GLN 65 Ca 0.20 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.34 1lud n GLN 65 Cb 0.64 -1.26 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 0.39 0.00 0.00 0.00 177.06 177.45 1lud n GLU 66 N -3.63 3.05 -1.45 -1.09 1.02 -1.26 -4.75 120.64 112.53 1lud n GLU 66 Ca 0.15 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.08 1lud n GLU 66 Cb 0.53 -0.94 0.09 0.00 -0.02 0.00 0.00 31.44 31.10 1lud n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1lud n ASP 67 N -1.74 4.96 -4.65 1.62 -0.08 -1.26 -5.01 116.55 110.39 1lud n ASP 67 Ca 0.00 -3.77 -0.42 0.00 -1.51 0.00 0.00 54.79 49.09 1lud n ASP 67 Cb 0.37 -0.62 -0.03 0.00 2.34 0.00 0.00 41.12 43.17 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1lud s TYR 68 N -3.56 1.39 -0.40 -0.67 5.04 -1.26 -4.94 117.35 112.96 1lud s TYR 68 Ca 0.53 -0.21 -0.12 0.00 -2.44 0.00 0.00 57.07 54.84 1lud s TYR 68 Cb 0.44 -4.15 0.04 0.00 0.35 0.00 0.00 41.96 38.64 1lud s TYR 68 CO 0.01 -5.05 0.25 -0.65 -1.34 0.00 0.00 175.55 168.77 1lud s GLN 69 N 4.65 2.82 -0.46 4.97 -0.21 -1.26 -5.00 119.66 125.18 1lud s GLN 69 Ca 0.87 -1.16 0.03 0.00 0.02 0.00 0.00 55.36 55.12 1lud s GLN 69 Cb -0.39 -3.82 0.16 0.00 1.00 0.00 0.00 33.01 29.96 1lud s GLN 69 CO 0.39 -0.78 0.32 0.00 -2.12 0.00 0.00 175.29 173.10 1lud s ALA 70 N 1.56 1.88 -0.04 6.09 0.00 -1.26 -5.10 121.76 124.89 1lud s ALA 70 Ca 0.03 -2.61 -0.30 0.00 0.00 0.00 0.00 51.96 49.08 1lud s ALA 70 Cb -0.20 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 1lud s ALA 70 CO 0.06 -2.04 1.33 -0.65 0.00 0.00 0.00 175.76 174.47 1lud s GLN 71 N 0.05 4.30 0.00 0.00 -0.21 -1.26 -2.91 119.66 119.63 1lud s GLN 71 Ca 0.26 1.84 0.00 0.00 0.02 0.00 0.00 55.36 57.48 1lud s GLN 71 Cb -0.08 -3.61 0.00 0.00 1.00 0.00 0.00 33.01 30.32 1lud s GLN 71 CO -0.11 -0.56 0.00 0.41 -2.12 0.00 0.00 175.29 172.91 1lud n GLY 72 N 3.57 2.87 3.60 3.09 0.00 -1.26 -5.03 105.19 112.03 1lud n GLY 72 Ca 0.13 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.96 3.05 0.65 4.61 0.00 -1.14 -4.83 121.76 123.13 1lud s ALA 73 Ca 0.00 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 50.91 1lud s ALA 73 Cb 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.82 1lud s ALA 73 CO 0.00 0.57 1.27 0.28 0.00 0.00 0.00 175.76 177.88 1lud n VAL 74 N 2.23 4.88 -4.24 0.00 0.31 0.52 -4.75 118.33 117.28 1lud n VAL 74 Ca -0.18 -0.50 -0.23 0.00 -0.01 0.00 0.00 64.34 63.42 1lud n VAL 74 Cb 0.53 -1.47 -0.17 0.00 -0.91 0.00 0.00 33.84 31.83 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 -1.40 0.80 0.06 2.52 1.01 -1.26 -1.73 120.40 120.41 1lud s VAL 75 Ca 0.82 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.51 1lud s VAL 75 Cb -0.38 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1lud s VAL 75 CO 0.41 0.29 0.05 0.68 0.00 0.00 0.00 175.10 176.53 1lud s VAL 76 N 1.03 0.18 -0.06 2.92 -7.23 -0.84 -4.94 120.40 111.47 1lud s VAL 76 Ca -0.09 -1.49 0.22 0.00 -1.81 0.00 0.00 61.98 58.82 1lud s VAL 76 Cb -0.14 -1.34 0.43 0.00 0.56 0.00 0.00 36.38 35.89 1lud s VAL 76 CO -0.00 -0.82 1.18 1.41 -0.31 0.00 0.00 175.10 176.55 1lud n HIS 77 N 0.20 0.07 -3.29 2.82 8.25 -1.26 -2.69 115.22 119.32 1lud n HIS 77 Ca -0.15 -0.80 0.03 0.00 -0.26 0.00 0.00 57.72 56.54 1lud n HIS 77 Cb 0.61 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.52 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 -2.35 -0.85 0.45 0.41 2.15 -1.26 -4.86 116.67 110.35 1lud s ASP 78 Ca 0.35 0.78 0.31 0.00 0.43 0.00 0.00 52.55 54.42 1lud s ASP 78 Cb 0.38 1.81 1.44 0.00 -0.30 0.00 0.00 42.92 46.26 1lud s ASP 78 CO -0.14 -0.16 1.63 0.58 -0.17 0.00 0.00 175.17 176.91 1lud h VAL 79 N 5.66 0.14 -0.93 1.11 2.07 -1.98 0.88 116.25 123.20 1lud h VAL 79 Ca -0.17 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.38 1lud h VAL 79 Cb 1.14 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 1lud h VAL 79 CO 0.08 0.02 0.61 0.00 0.02 0.00 0.00 177.57 178.30 1lud h ALA 80 N 1.54 1.48 -0.21 1.67 0.00 -1.99 -1.14 119.26 120.62 1lud h ALA 80 Ca 0.81 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.65 1lud h ALA 80 Cb 2.61 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 20.11 1lud h ALA 80 CO -0.36 0.39 -0.02 0.00 0.00 0.00 0.00 179.25 179.26 1lud h ALA 81 N 1.49 0.28 -0.51 0.00 0.00 0.38 -2.53 119.26 118.38 1lud h ALA 81 Ca 0.40 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1lud h ALA 81 Cb 0.17 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1lud h ALA 81 CO -0.15 0.03 0.29 0.28 0.00 0.00 0.00 179.25 179.70 1lud h VAL 82 N 0.13 1.02 -0.01 0.00 2.07 -1.26 -0.13 116.25 118.06 1lud h VAL 82 Ca 0.06 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1lud h VAL 82 Cb 0.44 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1lud h VAL 82 CO 0.01 0.10 0.01 -0.26 0.02 0.00 0.00 177.57 177.46 1lud h PHE 83 N 0.58 0.00 0.00 1.57 0.04 -1.14 -0.37 116.94 117.62 1lud h PHE 83 Ca 0.21 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.97 1lud h PHE 83 Cb 0.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1lud h PHE 83 CO -0.08 0.00 -0.06 0.00 -0.60 0.00 0.00 178.31 177.57 1lud h ALA 84 N 1.99 0.97 0.06 2.45 0.00 -0.59 -3.05 119.26 121.09 1lud h ALA 84 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1lud h ALA 84 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1lud h ALA 84 CO -0.00 0.08 -0.03 -0.92 0.00 0.00 0.00 179.25 178.38 1lud h TYR 85 N 0.00 -0.07 -0.90 0.00 3.20 -0.60 -2.67 116.97 115.92 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 0.95 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 39.16 1lud h TYR 85 CO 0.00 0.49 0.53 0.00 -1.64 0.00 0.00 178.16 177.54 1lud h ALA 86 N -0.31 1.34 0.00 1.82 0.00 -1.63 0.40 119.26 120.88 1lud h ALA 86 Ca -0.01 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1lud h ALA 86 Cb 0.59 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1lud h ALA 86 CO 0.01 0.12 -0.17 -0.22 0.00 0.00 0.00 179.25 178.99 1lud h LYS 87 N 0.85 0.00 0.00 0.00 1.63 -1.60 -2.57 116.57 114.88 1lud h LYS 87 Ca 0.45 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 60.03 1lud h LYS 87 Cb 0.46 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.06 1lud h LYS 87 CO -0.27 0.17 -1.23 0.37 -3.45 0.00 0.00 179.45 175.04 1lud h GLN 88 N 0.00 0.00 -5.52 1.90 5.75 0.01 -3.44 115.11 113.81 1lud h GLN 88 Ca -0.00 0.00 -0.62 0.00 -0.15 0.00 0.00 58.65 57.88 1lud h GLN 88 Cb 0.33 0.00 -0.12 0.00 1.07 0.00 0.00 27.48 28.76 1lud h GLN 88 CO 0.02 0.67 0.17 -1.01 -2.65 0.00 0.00 178.83 176.03 1lud s HIS 89 N -2.73 3.21 -2.28 3.99 3.76 0.41 -4.91 115.29 116.74 1lud s HIS 89 Ca -0.01 0.59 0.30 0.00 -0.15 0.00 0.00 55.06 55.78 1lud s HIS 89 Cb 0.09 -3.02 1.42 0.00 1.11 0.00 0.00 32.58 32.17 1lud s HIS 89 CO 0.81 -0.49 1.95 -0.35 -0.85 0.00 0.00 174.74 175.81 1lud n PRO 90 N 5.92 1.37 -0.05 8.40 -0.04 -1.26 -3.76 135.00 145.59 1lud n PRO 90 Ca -0.01 -0.54 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 1lud n PRO 90 Cb 0.49 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 -0.34 0.13 -3.49 3.54 8.00 -1.26 -5.02 116.55 118.12 1lud n ASP 91 Ca 0.21 -1.17 -0.16 0.00 0.71 0.00 0.00 54.79 54.38 1lud n ASP 91 Cb 0.25 -0.02 -0.12 0.00 -0.02 0.00 0.00 41.12 41.20 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 -0.08 0.21 0.00 -1.24 0.74 -1.25 -4.92 119.66 113.12 1lud s GLN 92 Ca 0.00 0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.72 1lud s GLN 92 Cb 0.00 -0.99 0.00 0.00 1.10 0.00 0.00 33.01 33.12 1lud s GLN 92 CO 0.00 -0.62 0.00 0.39 -0.55 0.00 0.00 175.29 174.51 1lud n GLU 93 N 5.33 1.13 -3.78 1.67 1.02 -1.26 -4.54 120.64 120.20 1lud n GLU 93 Ca -0.05 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.72 1lud n GLU 93 Cb 0.50 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 3.40 -0.14 -4.62 2.96 -1.26 -2.63 118.68 116.40 1lud s LEU 94 Ca 0.00 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1lud s LEU 94 Cb 0.00 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.81 1lud s LEU 94 CO 0.00 -0.05 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.08 1lud s VAL 95 N 1.58 2.24 0.31 1.68 1.01 0.20 0.10 120.40 127.52 1lud s VAL 95 Ca 0.06 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 1lud s VAL 95 Cb -0.15 -1.90 -0.07 0.00 0.00 0.00 0.00 36.38 34.25 1lud s VAL 95 CO 0.02 0.54 0.67 -0.63 0.00 0.00 0.00 175.10 175.70 1lud s ILE 96 N 0.74 4.82 0.00 2.22 -1.09 0.49 -0.40 121.20 127.97 1lud s ILE 96 Ca -0.08 0.62 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 1lud s ILE 96 Cb -0.16 -3.66 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 1lud s ILE 96 CO 0.00 -0.26 0.24 0.00 -1.23 0.00 0.00 174.94 173.70 1lud n ALA 97 N -0.61 1.35 0.00 9.38 0.00 0.12 -2.05 120.51 128.70 1lud n ALA 97 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1lud n ALA 97 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 0.07 -1.82 0.00 0.00 0.00 -1.10 -4.89 105.19 97.45 1lud n GLY 98 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.14 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 -0.66 0.25 -0.02 0.00 -1.26 -1.40 105.19 102.10 1lud n GLY 99 Ca 0.00 -1.18 0.04 0.00 0.00 0.00 0.00 46.02 44.88 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 1.61 -0.61 4.61 0.00 -1.93 -2.34 119.26 118.61 1lud h ALA 100 Ca 0.00 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1lud h ALA 100 Cb 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1lud h ALA 100 CO 0.00 0.28 0.36 1.96 0.00 0.00 0.00 179.25 181.85 1lud h GLN 101 N 0.22 0.67 0.00 0.00 7.50 -1.96 -1.10 115.11 120.43 1lud h GLN 101 Ca 0.05 -0.04 -0.12 0.00 0.50 0.00 0.00 58.65 59.04 1lud h GLN 101 Cb 0.27 -0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.63 1lud h GLN 101 CO 0.01 0.44 -0.55 0.82 -1.50 0.00 0.00 178.83 178.05 1lud h ILE 102 N 0.69 1.09 0.00 2.54 1.08 -1.66 -2.92 117.51 118.33 1lud h ILE 102 Ca 0.25 -2.15 0.00 0.00 -0.39 0.00 0.00 64.86 62.57 1lud h ILE 102 Cb 0.07 2.28 0.00 0.00 -3.07 0.00 0.00 36.82 36.10 1lud h ILE 102 CO -0.13 0.54 0.00 -0.26 -0.69 0.00 0.00 178.15 177.62 1lud h PHE 103 N 0.00 0.00 0.00 1.37 0.04 -0.85 -2.67 116.94 114.83 1lud h PHE 103 Ca -0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1lud h PHE 103 Cb 1.23 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.38 1lud h PHE 103 CO 0.00 0.00 -0.04 1.15 -0.60 0.00 0.00 178.31 178.82 1lud h THR 104 N 0.00 1.11 0.00 -1.55 2.02 -1.04 -0.70 112.91 112.75 1lud h THR 104 Ca 0.00 -1.84 -0.02 0.00 0.77 0.00 0.00 66.41 65.31 1lud h THR 104 Cb 0.66 2.11 -0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1lud h THR 104 CO 0.00 0.38 -0.11 0.00 0.37 0.00 0.00 175.52 176.15 1lud h ALA 105 N -0.38 1.19 0.00 6.16 0.00 -1.60 -3.06 119.26 121.57 1lud h ALA 105 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1lud h ALA 105 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1lud h ALA 105 CO -0.01 0.14 -1.56 1.19 0.00 0.00 0.00 179.25 179.02 1lud n PHE 106 N -3.50 0.00 0.09 0.00 3.72 -1.01 -4.45 117.46 112.31 1lud n PHE 106 Ca -0.01 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.47 1lud n PHE 106 Cb 0.26 -0.30 0.55 0.00 -0.94 0.00 0.00 39.48 39.05 1lud n PHE 106 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1lud h LYS 107 N 0.00 0.25 -0.69 -1.08 2.10 -1.01 -1.80 116.57 114.35 1lud h LYS 107 Ca 0.00 -0.01 -0.05 0.00 -2.00 0.00 0.00 60.65 58.59 1lud h LYS 107 Cb 0.74 -0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 31.98 1lud h LYS 107 CO 0.00 0.16 0.24 0.22 -2.00 0.00 0.00 179.45 178.07 1lud h ASP 108 N 0.26 0.96 -3.58 7.07 1.82 -1.78 -3.32 116.42 117.84 1lud h ASP 108 Ca 0.12 -0.16 -0.67 0.00 -0.39 0.00 0.00 57.03 55.93 1lud h ASP 108 Cb 0.16 -0.25 -0.38 0.00 0.68 0.00 0.00 39.33 39.54 1lud h ASP 108 CO -0.02 0.88 -0.36 -1.81 -1.61 0.00 0.00 179.24 176.32 1lud s ASP 109 N -6.46 5.28 0.22 2.28 1.11 -0.68 -5.07 116.67 113.36 1lud s ASP 109 Ca -0.11 -3.49 0.08 0.00 0.18 0.00 0.00 52.55 49.21 1lud s ASP 109 Cb 0.16 -1.79 -0.04 0.00 1.07 0.00 0.00 42.92 42.32 1lud s ASP 109 CO 0.82 -0.20 0.03 -0.69 1.18 0.00 0.00 175.17 176.31 1lud s VAL 110 N -0.98 3.74 0.00 -1.27 1.01 -1.24 -4.72 120.40 116.94 1lud s VAL 110 Ca 0.23 -1.58 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1lud s VAL 110 Cb -0.12 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1lud s VAL 110 CO -0.10 -0.24 0.00 -0.67 0.00 0.00 0.00 175.10 174.09 1lud n ASP 111 N -0.54 3.29 -3.71 3.32 -0.08 0.33 -4.71 116.55 114.44 1lud n ASP 111 Ca -0.08 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.09 1lud n ASP 111 Cb 0.57 0.14 -0.11 0.00 2.34 0.00 0.00 41.12 44.06 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1lud s THR 112 N -1.75 -0.02 -0.16 5.18 2.01 -1.08 -2.08 115.64 117.74 1lud s THR 112 Ca 0.00 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.03 1lud s THR 112 Cb 0.00 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 1lud s THR 112 CO 0.00 0.04 0.03 -0.76 -0.69 0.00 0.00 174.62 173.24 1lud s LEU 113 N 1.19 3.66 -0.36 4.42 1.43 0.51 -0.81 118.68 128.73 1lud s LEU 113 Ca -0.08 0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1lud s LEU 113 Cb -0.08 -1.90 0.11 0.00 0.03 0.00 0.00 46.19 44.35 1lud s LEU 113 CO -0.10 0.22 0.10 -0.76 0.23 0.00 0.00 176.35 176.04 1lud s LEU 114 N 0.08 3.87 0.07 1.79 1.43 0.39 0.11 118.68 126.42 1lud s LEU 114 Ca 0.03 -2.14 0.09 0.00 -1.03 0.00 0.00 54.13 51.08 1lud s LEU 114 Cb -0.13 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.69 1lud s LEU 114 CO 0.01 -0.37 -0.25 0.54 0.23 0.00 0.00 176.35 176.52 1lud s VAL 115 N 0.93 2.02 -0.21 -1.59 0.11 -0.89 -2.09 120.40 118.68 1lud s VAL 115 Ca 0.12 -1.44 -0.06 0.00 -2.93 0.00 0.00 61.98 57.66 1lud s VAL 115 Cb -0.20 -1.76 -0.03 0.00 -1.53 0.00 0.00 36.38 32.87 1lud s VAL 115 CO -0.11 0.23 0.03 -0.89 -3.33 0.00 0.00 175.10 171.03 1lud s THR 116 N -0.89 4.19 -0.38 5.04 2.01 -1.08 -0.45 115.64 124.08 1lud s THR 116 Ca 0.11 -0.23 -0.16 0.00 0.31 0.00 0.00 61.69 61.72 1lud s THR 116 Cb -0.10 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.50 1lud s THR 116 CO 0.03 0.40 0.39 -0.13 -0.69 0.00 0.00 174.62 174.62 1lud s ARG 117 N 1.11 3.31 0.37 4.92 1.81 -0.29 -0.84 118.95 129.34 1lud s ARG 117 Ca 0.03 -0.61 -0.17 0.00 -1.72 0.00 0.00 55.73 53.26 1lud s ARG 117 Cb -0.14 -3.89 -0.10 0.00 -0.45 0.00 0.00 34.95 30.37 1lud s ARG 117 CO 0.02 -0.68 0.83 -0.51 -0.68 0.00 0.00 175.30 174.28 1lud s LEU 118 N 2.04 4.00 0.18 2.53 1.02 -0.58 -1.16 118.68 126.71 1lud s LEU 118 Ca 0.11 1.46 0.11 0.00 0.02 0.00 0.00 54.13 55.83 1lud s LEU 118 Cb -0.17 -4.28 -0.08 0.00 0.02 0.00 0.00 46.19 41.68 1lud s LEU 118 CO 0.12 -0.28 1.31 0.00 0.02 0.00 0.00 176.35 177.52 1lud h ALA 119 N 2.07 0.53 -2.40 4.21 0.00 -0.90 -2.83 119.26 119.94 1lud h ALA 119 Ca -0.48 -0.72 -0.46 0.00 0.00 0.00 0.00 54.91 53.25 1lud h ALA 119 Cb 1.18 -0.07 0.12 0.00 0.00 0.00 0.00 17.79 19.02 1lud h ALA 119 CO 0.63 0.96 0.41 0.20 0.00 0.00 0.00 179.25 181.46 1lud s GLY 120 N -4.62 1.66 -0.14 0.00 0.00 -1.16 -4.75 107.32 98.31 1lud s GLY 120 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1lud s GLY 120 CO 0.79 -0.27 -0.11 -1.35 0.00 0.00 0.00 173.10 172.16 1lud s SER 121 N -4.69 2.55 0.31 1.64 1.04 -1.26 -2.95 113.70 110.33 1lud s SER 121 Ca 0.66 -0.45 0.08 0.00 0.48 0.00 0.00 55.95 56.73 1lud s SER 121 Cb -0.08 -1.05 -0.04 0.00 0.10 0.00 0.00 66.02 64.95 1lud s SER 121 CO 0.50 -0.09 0.16 -0.36 0.98 0.00 0.00 173.24 174.43 1lud s PHE 122 N 1.57 2.83 0.28 5.02 0.40 -1.26 -5.05 117.98 121.77 1lud s PHE 122 Ca 0.04 -0.28 0.09 0.00 -0.60 0.00 0.00 56.93 56.19 1lud s PHE 122 Cb -0.13 -1.53 -0.06 0.00 0.51 0.00 0.00 43.02 41.81 1lud s PHE 122 CO -0.10 0.40 -0.12 -1.83 0.70 0.00 0.00 175.22 174.27 1lud s GLU 123 N -3.84 1.59 0.00 0.44 -1.05 -1.26 -4.83 118.70 109.75 1lud s GLU 123 Ca 0.36 -1.77 0.00 0.00 -0.15 0.00 0.00 54.97 53.41 1lud s GLU 123 Cb -0.05 -1.42 0.00 0.00 -0.44 0.00 0.00 34.13 32.22 1lud s GLU 123 CO 0.23 0.16 0.00 0.41 0.95 0.00 0.00 175.26 177.02 1lud n GLY 124 N -0.60 1.01 0.00 -3.83 0.00 -1.26 -4.95 105.19 95.57 1lud n GLY 124 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 0.37 -4.27 1.61 8.00 -1.26 -5.03 116.55 115.97 1lud n ASP 125 Ca 0.00 -0.12 -0.34 0.00 0.71 0.00 0.00 54.79 55.04 1lud n ASP 125 Cb 0.00 0.32 -0.15 0.00 -0.02 0.00 0.00 41.12 41.27 1lud n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lud s THR 126 N -0.39 2.88 0.26 -3.53 2.01 -1.26 -5.11 115.64 110.51 1lud s THR 126 Ca 0.00 -0.67 0.06 0.00 0.31 0.00 0.00 61.69 61.39 1lud s THR 126 Cb 0.00 -2.26 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 1lud s THR 126 CO 0.00 0.48 -0.06 -0.54 -0.69 0.00 0.00 174.62 173.81 1lud s LYS 127 N 1.15 1.48 0.77 4.92 1.02 -1.26 -3.46 119.74 124.35 1lud s LYS 127 Ca 0.01 -1.74 -0.14 0.00 0.02 0.00 0.00 55.97 54.13 1lud s LYS 127 Cb -0.14 -1.05 0.06 0.00 -0.52 0.00 0.00 37.83 36.18 1lud s LYS 127 CO -0.04 0.03 1.21 1.41 -0.92 0.00 0.00 175.35 177.04 1lud s MET 128 N -3.74 1.90 0.52 1.68 1.75 -1.22 -4.83 119.30 115.35 1lud s MET 128 Ca 0.28 1.75 -0.18 0.00 -1.25 0.00 0.00 55.69 56.29 1lud s MET 128 Cb 0.03 -1.81 -0.07 0.00 2.84 0.00 0.00 34.83 35.83 1lud s MET 128 CO 0.10 -2.02 1.03 0.96 -0.65 0.00 0.00 175.02 174.45 1lud s ILE 129 N -2.07 3.96 -0.66 10.11 -4.36 -1.26 -4.90 121.20 122.02 1lud s ILE 129 Ca 0.74 1.08 -0.27 0.00 -0.26 0.00 0.00 60.65 61.94 1lud s ILE 129 Cb -0.29 -3.48 -0.12 0.00 1.25 0.00 0.00 42.46 39.82 1lud s ILE 129 CO 0.48 -0.40 2.49 -2.65 0.24 0.00 0.00 174.94 175.10 1lud n PRO 130 N -1.37 0.70 -3.12 0.37 -0.01 -1.26 -4.95 135.00 125.37 1lud n PRO 130 Ca 0.08 -0.05 -0.29 0.00 -0.01 0.00 0.00 63.50 63.23 1lud n PRO 130 Cb 0.53 -2.88 -0.03 0.00 -0.01 0.00 0.00 33.50 31.11 1lud n PRO 130 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1lud s LEU 131 N 11.25 3.95 -1.15 2.45 1.43 -1.26 -5.00 118.68 130.35 1lud s LEU 131 Ca 1.09 0.91 -0.06 0.00 -1.03 0.00 0.00 54.13 55.04 1lud s LEU 131 Cb -0.48 -3.75 0.26 0.00 0.03 0.00 0.00 46.19 42.24 1lud s LEU 131 CO 0.32 -0.29 1.61 -3.20 0.23 0.00 0.00 176.35 175.02 1lud n ASN 132 N -1.10 5.96 -0.02 2.29 5.15 -1.26 -4.79 115.26 121.49 1lud n ASN 132 Ca 0.00 -3.30 0.24 0.00 -0.60 0.00 0.00 54.58 50.91 1lud n ASN 132 Cb 0.54 -1.35 0.72 0.00 -0.53 0.00 0.00 39.78 39.16 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 5.58 0.00 0.00 1.20 4.06 -1.94 0.40 115.95 125.24 1lud h TRP 133 Ca 0.27 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.19 1lud h TRP 133 Cb 0.63 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.78 1lud h TRP 133 CO 1.09 0.00 -0.14 -0.44 -3.56 0.00 0.00 178.44 175.39 1lud h ASP 134 N 0.00 0.00 0.35 -3.49 5.19 -2.04 -1.49 116.42 114.94 1lud h ASP 134 Ca 0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 1lud h ASP 134 Cb 1.41 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.92 1lud h ASP 134 CO -0.00 0.14 -0.34 -0.67 -3.12 0.00 0.00 179.24 175.25 1lud n ASP 135 N -4.03 0.79 -4.58 6.45 -0.08 0.14 -4.89 116.55 110.35 1lud n ASP 135 Ca -0.02 -0.62 -0.25 0.00 -1.51 0.00 0.00 54.79 52.39 1lud n ASP 135 Cb 0.23 0.17 -0.09 0.00 2.34 0.00 0.00 41.12 43.76 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1lud s PHE 136 N -2.70 2.48 -0.04 -0.67 0.40 -0.56 -2.72 117.98 114.18 1lud s PHE 136 Ca 0.19 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1lud s PHE 136 Cb 0.19 -1.34 0.01 0.00 0.51 0.00 0.00 43.02 42.39 1lud s PHE 136 CO 0.59 0.56 -0.07 0.99 0.70 0.00 0.00 175.22 177.99 1lud s THR 137 N -2.52 0.68 -0.13 0.64 2.01 -0.97 -4.89 115.64 110.46 1lud s THR 137 Ca 0.33 -0.25 -0.29 0.00 0.31 0.00 0.00 61.69 61.79 1lud s THR 137 Cb -0.01 -0.65 -0.03 0.00 0.01 0.00 0.00 72.50 71.83 1lud s THR 137 CO 0.18 0.24 1.35 -0.75 -0.69 0.00 0.00 174.62 174.95 1lud s LYS 138 N 0.59 4.23 -0.05 4.92 2.36 -1.26 -1.75 119.74 128.78 1lud s LYS 138 Ca -0.09 1.79 0.21 0.00 -2.55 0.00 0.00 55.97 55.33 1lud s LYS 138 Cb -0.12 -3.80 -0.29 0.00 -1.05 0.00 0.00 37.83 32.58 1lud s LYS 138 CO 0.01 -0.72 0.44 1.33 1.55 0.00 0.00 175.35 177.96 1lud n VAL 139 N 5.33 0.42 -3.79 4.02 0.24 0.60 -4.95 118.33 120.21 1lud n VAL 139 Ca 0.14 -0.60 -0.13 0.00 -2.04 0.00 0.00 64.34 61.72 1lud n VAL 139 Cb 0.44 -0.17 -0.12 0.00 -1.47 0.00 0.00 33.84 32.53 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 -4.86 -0.25 -0.14 -1.34 0.01 -1.21 -5.03 113.70 100.87 1lud s SER 140 Ca -0.08 0.48 -0.11 0.00 1.31 0.00 0.00 55.95 57.56 1lud s SER 140 Cb 0.12 0.49 0.04 0.00 0.21 0.00 0.00 66.02 66.88 1lud s SER 140 CO 0.88 -0.08 0.37 -0.55 0.41 0.00 0.00 173.24 174.26 1lud s SER 141 N 0.15 -0.41 -0.06 2.44 0.15 -1.26 -1.09 113.70 113.62 1lud s SER 141 Ca -0.00 0.76 0.02 0.00 0.70 0.00 0.00 55.95 57.44 1lud s SER 141 Cb -0.02 0.72 0.01 0.00 -1.71 0.00 0.00 66.02 65.02 1lud s SER 141 CO 0.00 -0.15 -0.11 -0.60 1.20 0.00 0.00 173.24 173.58 1lud s ARG 142 N 0.72 1.53 -0.21 5.44 3.52 -0.19 -4.95 118.95 124.81 1lud s ARG 142 Ca -0.04 -0.38 -0.08 0.00 -0.13 0.00 0.00 55.73 55.10 1lud s ARG 142 Cb -0.05 -1.30 -0.04 0.00 -1.56 0.00 0.00 34.95 32.00 1lud s ARG 142 CO -0.05 0.04 0.09 0.99 -0.81 0.00 0.00 175.30 175.55 1lud s THR 143 N 0.61 4.79 -0.06 4.11 2.01 -1.26 -0.15 115.64 125.69 1lud s THR 143 Ca -0.13 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.88 1lud s THR 143 Cb -0.15 -3.20 0.01 0.00 0.01 0.00 0.00 72.50 69.18 1lud s THR 143 CO 0.03 0.40 -0.12 0.54 -0.69 0.00 0.00 174.62 174.78 1lud s VAL 144 N 0.85 1.14 0.50 3.82 0.11 -1.00 -5.02 120.40 120.80 1lud s VAL 144 Ca 0.05 -0.48 -0.03 0.00 -2.93 0.00 0.00 61.98 58.58 1lud s VAL 144 Cb -0.13 -1.04 -0.01 0.00 -1.53 0.00 0.00 36.38 33.67 1lud s VAL 144 CO 0.02 0.35 0.77 -1.61 -3.33 0.00 0.00 175.10 171.31 1lud s GLU 145 N 0.64 3.18 0.06 1.54 2.02 -1.26 -2.83 118.70 122.05 1lud s GLU 145 Ca -0.14 -0.11 0.01 0.00 0.02 0.00 0.00 54.97 54.75 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 0.04 -0.37 -0.06 0.34 0.02 0.00 0.00 175.26 175.22 1lud s ASP 146 N -4.20 0.85 0.38 -0.19 2.15 -1.26 -4.90 116.67 109.49 1lud s ASP 146 Ca 0.49 -0.77 0.25 0.00 0.43 0.00 0.00 52.55 52.95 1lud s ASP 146 Cb -0.10 0.09 1.35 0.00 -0.30 0.00 0.00 42.92 43.95 1lud s ASP 146 CO 0.42 -0.36 1.75 0.71 -0.17 0.00 0.00 175.17 177.52 1lud h THR 147 N 3.78 0.00 -3.48 1.71 1.35 -1.99 -3.39 112.91 110.89 1lud h THR 147 Ca -0.35 0.00 -0.64 0.00 -0.55 0.00 0.00 66.41 64.87 1lud h THR 147 Cb 1.18 0.55 -0.23 0.00 -1.73 0.00 0.00 68.15 67.93 1lud h THR 147 CO 0.53 0.00 -0.65 0.21 -0.25 0.00 0.00 175.52 175.36 1lud s ASN 148 N -4.17 4.94 0.28 5.36 3.84 -1.26 -4.99 114.94 118.94 1lud s ASN 148 Ca -0.03 -0.19 -0.01 0.00 0.21 0.00 0.00 52.86 52.84 1lud s ASN 148 Cb 0.07 -1.86 0.61 0.00 -0.55 0.00 0.00 41.25 39.53 1lud s ASN 148 CO 0.23 0.04 1.63 -0.65 -2.79 0.00 0.00 177.10 175.56 1lud h PRO 149 N 7.66 0.13 0.04 0.43 0.10 -2.00 0.54 132.00 138.91 1lud h PRO 149 Ca -0.37 -0.01 -0.23 0.00 0.10 0.00 0.00 66.00 65.49 1lud h PRO 149 Cb 1.18 -0.03 -0.02 0.00 0.10 0.00 0.00 31.00 32.23 1lud h PRO 149 CO 0.61 0.09 -1.10 0.00 0.10 0.00 0.00 178.00 177.70 1lud h ALA 150 N 1.79 0.29 0.00 -0.75 0.00 -1.93 -3.22 119.26 115.44 1lud h ALA 150 Ca 0.51 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1lud h ALA 150 Cb 0.98 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1lud h ALA 150 CO -0.70 1.18 0.00 1.28 0.00 0.00 0.00 179.25 181.01 1lud n LEU 151 N -3.39 0.00 -4.78 0.00 4.77 0.14 -3.00 117.00 110.74 1lud n LEU 151 Ca -0.03 0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.81 1lud n LEU 151 Cb 0.97 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.78 1lud n LEU 151 CO 0.49 -0.15 1.14 -0.89 -1.33 0.00 0.00 177.39 176.65 1lud s THR 152 N -2.55 2.08 0.08 -5.08 2.01 -0.96 -4.64 115.64 106.58 1lud s THR 152 Ca 0.13 0.08 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 1lud s THR 152 Cb 0.09 -3.05 0.04 0.00 0.01 0.00 0.00 72.50 69.59 1lud s THR 152 CO 0.21 0.02 0.45 -1.38 -0.69 0.00 0.00 174.62 173.23 1lud s HIS 153 N -1.02 -0.31 0.08 4.92 -3.43 -1.13 -0.45 115.29 113.94 1lud s HIS 153 Ca 0.53 0.18 0.07 0.00 -0.80 0.00 0.00 55.06 55.05 1lud s HIS 153 Cb -0.46 0.30 -0.03 0.00 -1.43 0.00 0.00 32.58 30.95 1lud s HIS 153 CO 0.61 -0.66 -0.19 0.99 -2.00 0.00 0.00 174.74 173.49 1lud s THR 154 N -3.05 1.57 -0.26 -5.38 2.01 -0.31 -2.37 115.64 107.85 1lud s THR 154 Ca -0.02 -1.39 -0.09 0.00 0.31 0.00 0.00 61.69 60.50 1lud s THR 154 Cb 0.00 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 1lud s THR 154 CO -0.07 -0.02 0.13 -0.31 -0.69 0.00 0.00 174.62 173.66 1lud s TYR 155 N -1.08 3.17 0.18 4.92 2.02 0.79 -1.14 117.35 126.22 1lud s TYR 155 Ca 0.05 -0.11 0.08 0.00 -0.37 0.00 0.00 57.07 56.72 1lud s TYR 155 Cb -0.10 -2.29 -0.04 0.00 -0.40 0.00 0.00 41.96 39.13 1lud s TYR 155 CO 0.03 -0.21 -0.03 -1.21 -1.57 0.00 0.00 175.55 172.57 1lud s GLU 156 N 1.55 2.29 -0.07 -0.62 2.02 0.40 -1.02 118.70 123.25 1lud s GLU 156 Ca 0.06 -1.18 -0.03 0.00 0.02 0.00 0.00 54.97 53.85 1lud s GLU 156 Cb -0.15 -2.28 0.04 0.00 0.10 0.00 0.00 34.13 31.84 1lud s GLU 156 CO 0.07 0.44 0.14 0.08 0.02 0.00 0.00 175.26 176.01 1lud s VAL 157 N -1.77 -0.18 0.33 2.63 1.01 -0.25 -2.10 120.40 120.08 1lud s VAL 157 Ca 0.27 0.31 0.10 0.00 0.00 0.00 0.00 61.98 62.65 1lud s VAL 157 Cb -0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.97 1lud s VAL 157 CO 0.18 0.13 -0.10 0.26 0.00 0.00 0.00 175.10 175.57 1lud s TRP 158 N 1.90 2.41 0.00 5.22 0.52 0.30 -0.29 118.94 129.01 1lud s TRP 158 Ca -0.01 -0.45 0.01 0.00 0.02 0.00 0.00 56.10 55.67 1lud s TRP 158 Cb -0.12 -1.32 -0.01 0.00 -1.15 0.00 0.00 33.47 30.87 1lud s TRP 158 CO -0.05 0.59 -0.04 -0.65 0.02 0.00 0.00 176.95 176.82 1lud s GLN 159 N -3.61 0.34 0.09 4.98 -0.21 -0.72 -0.36 119.66 120.17 1lud s GLN 159 Ca 0.32 -0.23 -0.31 0.00 0.02 0.00 0.00 55.36 55.16 1lud s GLN 159 Cb 0.01 -0.28 -0.07 0.00 1.00 0.00 0.00 33.01 33.67 1lud s GLN 159 CO 0.17 0.07 1.28 0.21 -2.12 0.00 0.00 175.29 174.90 1lud s LYS 160 N -0.33 4.39 0.43 2.91 2.20 -0.88 -2.28 119.74 126.17 1lud s LYS 160 Ca -0.01 1.90 -0.24 0.00 -0.36 0.00 0.00 55.97 57.26 1lud s LYS 160 Cb -0.03 -3.30 -0.08 0.00 -1.51 0.00 0.00 37.83 32.91 1lud s LYS 160 CO -0.00 -0.33 1.16 0.15 -0.36 0.00 0.00 175.35 175.97 1lud s LYS 161 N 1.05 3.93 0.00 4.03 1.02 -1.10 -4.98 119.74 123.68 1lud s LYS 161 Ca 0.61 1.78 0.00 0.00 0.02 0.00 0.00 55.97 58.38 1lud s LYS 161 Cb -0.33 -2.54 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 1lud s LYS 161 CO 0.30 -0.41 0.32 0.00 -0.92 0.00 0.00 175.35 174.64