#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 1.42 -0.15 2.41 0.00 -0.16 0.17 121.76 125.46 1lud s ALA 2 Ca 0.00 -1.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.72 1lud s ALA 2 Cb 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1lud s ALA 2 CO 0.00 0.18 0.12 -0.06 0.00 0.00 0.00 175.76 175.99 1lud s PHE 3 N -1.60 3.46 -0.39 0.00 0.08 -0.01 0.14 117.98 119.67 1lud s PHE 3 Ca 0.04 0.38 0.01 0.00 0.12 0.00 0.00 56.93 57.48 1lud s PHE 3 Cb -0.08 -2.01 0.12 0.00 -0.57 0.00 0.00 43.02 40.48 1lud s PHE 3 CO 0.03 0.50 0.18 -1.17 -0.10 0.00 0.00 175.22 174.66 1lud s LEU 4 N -0.41 2.66 -0.02 -0.37 2.96 -0.84 0.13 118.68 122.80 1lud s LEU 4 Ca 0.11 -2.28 -0.02 0.00 -0.22 0.00 0.00 54.13 51.72 1lud s LEU 4 Cb -0.12 -1.01 0.00 0.00 0.50 0.00 0.00 46.19 45.56 1lud s LEU 4 CO 0.01 -0.32 0.06 -1.66 -1.32 0.00 0.00 176.35 173.12 1lud s TRP 5 N 0.79 -0.05 -0.19 5.38 -2.14 -0.56 -4.61 118.94 117.56 1lud s TRP 5 Ca 0.15 0.12 -0.10 0.00 2.66 0.00 0.00 56.10 58.93 1lud s TRP 5 Cb -0.22 0.01 -0.05 0.00 -3.10 0.00 0.00 33.47 30.11 1lud s TRP 5 CO -0.08 -0.04 0.15 0.00 -2.66 0.00 0.00 176.95 174.31 1lud s ALA 6 N -0.07 3.69 0.15 2.67 0.00 -1.26 -2.45 121.76 124.49 1lud s ALA 6 Ca -0.01 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.33 1lud s ALA 6 Cb -0.01 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.88 1lud s ALA 6 CO 0.00 0.17 -0.10 1.14 0.00 0.00 0.00 175.76 176.97 1lud s GLN 7 N 0.32 1.08 0.00 0.00 -2.07 0.14 -4.69 119.66 114.44 1lud s GLN 7 Ca 0.09 -1.47 0.00 0.00 -1.82 0.00 0.00 55.36 52.16 1lud s GLN 7 Cb -0.11 -0.63 0.00 0.00 -1.09 0.00 0.00 33.01 31.18 1lud s GLN 7 CO -0.01 0.06 0.00 -0.40 -1.32 0.00 0.00 175.29 173.62 1lud n ASP 8 N -0.21 0.00 -0.25 12.60 5.68 -1.23 -1.31 116.55 131.83 1lud n ASP 8 Ca -0.10 -0.88 -0.03 0.00 -0.50 0.00 0.00 54.79 53.28 1lud n ASP 8 Cb 0.61 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.67 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 0.84 -0.06 0.11 -0.00 -1.58 -2.18 114.38 111.51 1lud h ARG 9 Ca 0.00 -0.05 -0.14 0.00 -0.00 0.00 0.00 59.98 59.79 1lud h ARG 9 Cb 0.00 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.97 29.77 1lud h ARG 9 CO 0.00 0.56 -0.60 -0.44 -0.00 0.00 0.00 179.97 179.49 1lud h ASP 10 N 0.87 0.23 0.00 0.08 3.32 -1.89 -3.47 116.42 115.55 1lud h ASP 10 Ca 0.28 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1lud h ASP 10 Cb 0.02 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1lud h ASP 10 CO -0.11 0.77 0.00 0.61 -1.72 0.00 0.00 179.24 178.79 1lud n GLY 11 N 0.23 1.16 3.89 2.75 0.00 -0.82 -5.07 105.19 107.33 1lud n GLY 11 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1lud n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lud s LEU 12 N 0.00 4.29 0.16 0.99 2.96 -1.26 -3.36 118.68 122.46 1lud s LEU 12 Ca 0.00 0.61 0.00 0.00 -0.22 0.00 0.00 54.13 54.52 1lud s LEU 12 Cb 0.00 -3.18 0.00 0.00 0.50 0.00 0.00 46.19 43.51 1lud s LEU 12 CO 0.00 0.10 0.00 2.30 -1.32 0.00 0.00 176.35 177.43 1lud n ILE 13 N 0.34 0.29 -2.67 6.68 -5.35 -0.83 -3.50 119.36 114.32 1lud n ILE 13 Ca -0.04 0.10 -0.42 0.00 -0.27 0.00 0.00 62.75 62.11 1lud n ILE 13 Cb 0.52 -0.86 -0.03 0.00 -1.74 0.00 0.00 39.64 37.53 1lud n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1lud s GLY 14 N -4.77 2.82 -0.44 3.28 0.00 -1.03 -4.66 107.32 102.52 1lud s GLY 14 Ca 0.00 0.57 0.05 0.00 0.00 0.00 0.00 44.72 45.33 1lud s GLY 14 CO 0.00 1.75 0.38 1.17 0.00 0.00 0.00 173.10 176.40 1lud n LYS 15 N 3.98 0.42 -3.58 2.90 0.00 -1.23 -3.59 118.16 117.06 1lud n LYS 15 Ca 0.07 -3.32 -0.23 0.00 0.00 0.00 0.00 58.31 54.82 1lud n LYS 15 Cb 0.50 -1.68 0.05 0.00 0.00 0.00 0.00 35.03 33.90 1lud n LYS 15 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1lud n ASP 16 N 2.58 -4.09 0.00 3.14 9.92 -1.26 -3.67 116.55 123.17 1lud n ASP 16 Ca 0.28 -0.86 0.00 0.00 -0.53 0.00 0.00 54.79 53.68 1lud n ASP 16 Cb 0.47 -4.12 0.00 0.00 -0.64 0.00 0.00 41.12 36.84 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 -1.52 2.28 0.00 0.44 0.00 -1.26 -4.87 105.19 100.26 1lud n GLY 17 Ca -0.17 -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 -1.24 -4.06 1.61 1.44 -1.24 -5.02 115.22 106.71 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 -0.05 0.00 0.12 0.00 0.00 29.99 30.06 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 3.56 0.11 2.39 1.43 -1.26 -3.52 118.68 121.39 1lud s LEU 19 Ca 0.00 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.61 1lud s LEU 19 Cb 0.00 -2.11 -0.17 0.00 0.03 0.00 0.00 46.19 43.95 1lud s LEU 19 CO 0.00 -0.15 1.24 1.55 0.23 0.00 0.00 176.35 179.22 1lud h PRO 20 N 1.50 0.30 -6.19 1.29 0.14 -1.83 -3.46 132.00 123.74 1lud h PRO 20 Ca -0.46 -0.40 -0.60 0.00 0.14 0.00 0.00 66.00 64.68 1lud h PRO 20 Cb 1.25 0.13 -0.26 0.00 0.14 0.00 0.00 31.00 32.26 1lud h PRO 20 CO 0.60 1.13 -0.85 1.67 0.14 0.00 0.00 178.00 180.69 1lud s TRP 21 N -2.96 1.90 -0.71 1.56 -2.14 -1.26 -5.05 118.94 110.29 1lud s TRP 21 Ca -0.04 -0.38 -0.18 0.00 2.66 0.00 0.00 56.10 58.16 1lud s TRP 21 Cb 0.08 -1.14 0.13 0.00 -3.10 0.00 0.00 33.47 29.44 1lud s TRP 21 CO 0.87 0.09 0.81 -1.58 -2.66 0.00 0.00 176.95 174.48 1lud s HIS 22 N -0.78 3.16 -0.29 1.66 2.46 -1.26 -4.99 115.29 115.26 1lud s HIS 22 Ca 0.08 -1.25 0.02 0.00 0.47 0.00 0.00 55.06 54.38 1lud s HIS 22 Cb -0.09 -4.04 0.08 0.00 -0.13 0.00 0.00 32.58 28.40 1lud s HIS 22 CO 0.02 -1.29 0.00 -1.17 -2.47 0.00 0.00 174.74 169.83 1lud s LEU 23 N 2.23 3.31 0.19 8.88 2.96 -1.26 -4.98 118.68 130.01 1lud s LEU 23 Ca 0.17 -1.61 -0.07 0.00 -0.22 0.00 0.00 54.13 52.41 1lud s LEU 23 Cb -0.17 -1.30 0.11 0.00 0.50 0.00 0.00 46.19 45.33 1lud s LEU 23 CO 0.00 -0.31 1.59 1.55 -1.32 0.00 0.00 176.35 177.86 1lud h PRO 24 N 7.85 0.85 0.00 0.98 0.14 -1.98 -2.77 132.00 137.08 1lud h PRO 24 Ca -0.13 -0.36 -0.01 0.00 0.14 0.00 0.00 66.00 65.65 1lud h PRO 24 Cb 1.04 -0.03 -0.00 0.00 0.14 0.00 0.00 31.00 32.15 1lud h PRO 24 CO 0.46 1.00 -0.03 0.22 0.14 0.00 0.00 178.00 179.79 1lud h ASP 25 N 0.74 0.00 0.06 1.44 3.58 -1.96 -2.13 116.42 118.15 1lud h ASP 25 Ca 0.10 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.38 1lud h ASP 25 Cb 0.78 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.85 1lud h ASP 25 CO 0.06 0.03 -0.70 -0.78 -2.88 0.00 0.00 179.24 174.97 1lud h ASP 26 N 0.00 0.51 -0.94 2.28 3.58 -1.90 -2.99 116.42 116.95 1lud h ASP 26 Ca -0.00 -0.85 0.11 0.00 0.42 0.00 0.00 57.03 56.72 1lud h ASP 26 Cb 0.06 -0.16 -0.08 0.00 1.72 0.00 0.00 39.33 40.87 1lud h ASP 26 CO 0.00 1.30 0.57 -0.07 -2.88 0.00 0.00 179.24 178.17 1lud h LEU 27 N -0.22 0.83 -0.83 2.28 3.38 -1.28 0.97 115.31 120.45 1lud h LEU 27 Ca -0.11 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1lud h LEU 27 Cb 1.46 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 1lud h LEU 27 CO 0.13 0.45 0.40 0.45 0.09 0.00 0.00 178.44 179.96 1lud h HIS 28 N 0.92 1.19 -0.27 1.13 3.86 -1.48 -1.02 115.15 119.48 1lud h HIS 28 Ca 0.47 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.60 1lud h HIS 28 Cb 0.46 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 1lud h HIS 28 CO -0.03 0.86 0.10 -0.92 0.86 0.00 0.00 177.93 178.80 1lud h TYR 29 N 1.17 0.36 -0.00 2.45 3.20 -0.71 0.82 116.97 124.27 1lud h TYR 29 Ca 0.28 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 1lud h TYR 29 Cb 0.11 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1lud h TYR 29 CO 0.01 0.30 -0.00 0.35 -1.64 0.00 0.00 178.16 177.18 1lud h PHE 30 N 0.37 0.00 -0.70 -3.82 3.57 -0.03 0.40 116.94 116.73 1lud h PHE 30 Ca 0.09 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1lud h PHE 30 Cb 0.10 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1lud h PHE 30 CO 0.00 0.55 0.23 -0.09 -2.23 0.00 0.00 178.31 176.78 1lud h ARG 31 N -0.55 1.08 -0.26 1.11 2.43 -0.94 -2.07 114.38 115.19 1lud h ARG 31 Ca 0.00 -0.23 -0.17 0.00 -0.81 0.00 0.00 59.98 58.78 1lud h ARG 31 Cb 0.55 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1lud h ARG 31 CO 0.00 0.92 -0.49 0.00 -1.51 0.00 0.00 179.97 178.90 1lud h ALA 32 N 1.11 0.41 0.00 2.80 0.00 -0.87 -2.94 119.26 119.77 1lud h ALA 32 Ca 0.23 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1lud h ALA 32 Cb 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lud h ALA 32 CO -0.01 0.58 0.00 1.04 0.00 0.00 0.00 179.25 180.86 1lud n GLN 33 N -4.10 0.13 -0.58 0.00 1.13 0.13 -2.80 117.38 111.30 1lud n GLN 33 Ca -0.05 0.36 0.04 0.00 -1.94 0.00 0.00 57.00 55.41 1lud n GLN 33 Cb 0.59 -1.75 0.20 0.00 0.11 0.00 0.00 30.24 29.39 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 -2.00 2.25 -2.76 5.09 -2.24 -0.79 -4.92 114.28 108.91 1lud n THR 34 Ca 0.03 -2.98 -0.42 0.00 -2.27 0.00 0.00 64.05 58.41 1lud n THR 34 Cb 0.22 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.16 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 -3.19 4.70 -0.15 2.28 -7.23 -1.12 -3.40 120.40 112.29 1lud s VAL 35 Ca 0.39 1.72 0.00 0.00 -1.81 0.00 0.00 61.98 62.28 1lud s VAL 35 Cb 0.37 -4.26 0.00 0.00 0.56 0.00 0.00 36.38 33.05 1lud s VAL 35 CO -0.04 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1lud n GLY 36 N 3.68 0.49 3.62 2.32 0.00 -1.25 -5.01 105.19 109.04 1lud n GLY 36 Ca 0.09 -0.23 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.04 2.01 -0.14 1.61 1.02 -1.22 -4.32 119.74 117.66 1lud s LYS 37 Ca 0.00 -1.87 -0.24 0.00 0.02 0.00 0.00 55.97 53.88 1lud s LYS 37 Cb 0.00 -1.83 -0.02 0.00 -0.52 0.00 0.00 37.83 35.46 1lud s LYS 37 CO 0.00 0.07 0.77 0.42 -0.92 0.00 0.00 175.35 175.69 1lud s ILE 38 N -2.59 4.95 -0.46 2.17 1.01 -1.01 -3.29 121.20 121.99 1lud s ILE 38 Ca 0.35 1.53 -0.14 0.00 0.00 0.00 0.00 60.65 62.40 1lud s ILE 38 Cb 0.03 -4.09 0.08 0.00 0.01 0.00 0.00 42.46 38.48 1lud s ILE 38 CO 0.19 0.10 0.36 -0.32 0.00 0.00 0.00 174.94 175.27 1lud s MET 39 N 1.70 2.88 -0.25 2.79 1.75 0.42 -0.17 119.30 128.43 1lud s MET 39 Ca 0.37 -1.39 -0.19 0.00 -1.25 0.00 0.00 55.69 53.24 1lud s MET 39 Cb -0.17 -4.04 -0.03 0.00 2.84 0.00 0.00 34.83 33.43 1lud s MET 39 CO 0.14 -1.01 0.55 0.08 -0.65 0.00 0.00 175.02 174.12 1lud s VAL 40 N 1.58 5.05 0.21 10.11 1.01 0.24 0.50 120.40 139.11 1lud s VAL 40 Ca 0.04 0.96 0.01 0.00 0.00 0.00 0.00 61.98 62.98 1lud s VAL 40 Cb -0.24 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 1lud s VAL 40 CO 0.05 0.08 0.03 1.33 0.00 0.00 0.00 175.10 176.59 1lud n VAL 41 N 5.09 0.00 -4.47 2.92 0.24 -0.53 0.86 118.33 122.43 1lud n VAL 41 Ca -0.03 -1.08 -0.30 0.00 -2.04 0.00 0.00 64.34 60.89 1lud n VAL 41 Cb 0.50 0.29 -0.12 0.00 -1.47 0.00 0.00 33.84 33.04 1lud n VAL 41 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1lud s GLY 42 N -2.21 1.65 0.59 7.63 0.00 1.00 -1.69 107.32 114.29 1lud s GLY 42 Ca 0.04 -1.25 0.32 0.00 0.00 0.00 0.00 44.72 43.83 1lud s GLY 42 CO 0.03 -1.18 1.60 -0.09 0.00 0.00 0.00 173.10 173.45 1lud h ARG 43 N 4.13 0.00 0.04 2.90 1.12 -1.13 0.31 114.38 121.76 1lud h ARG 43 Ca -0.49 0.00 -0.16 0.00 -1.11 0.00 0.00 59.98 58.23 1lud h ARG 43 Cb 1.16 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.14 1lud h ARG 43 CO 0.48 0.00 -0.63 0.00 -3.11 0.00 0.00 179.97 176.71 1lud h ARG 44 N 0.00 0.35 -0.02 0.20 3.08 -1.94 -2.96 114.38 113.10 1lud h ARG 44 Ca 0.47 -0.44 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1lud h ARG 44 Cb 2.39 0.14 0.00 0.00 0.08 0.00 0.00 29.97 32.58 1lud h ARG 44 CO -0.00 1.13 -0.03 1.15 -1.07 0.00 0.00 179.97 181.14 1lud h THR 45 N -0.22 1.45 -1.00 2.04 2.02 -0.79 -2.21 112.91 114.19 1lud h THR 45 Ca -0.09 -1.37 0.15 0.00 0.77 0.00 0.00 66.41 65.87 1lud h THR 45 Cb 1.39 2.34 -0.09 0.00 -1.74 0.00 0.00 68.15 70.04 1lud h THR 45 CO 0.12 0.36 0.62 0.22 0.37 0.00 0.00 175.52 177.22 1lud h TYR 46 N -0.51 1.10 0.00 3.16 3.20 -1.26 0.99 116.97 123.65 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 0.61 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1lud h TYR 46 CO 0.12 0.35 0.00 0.93 -1.64 0.00 0.00 178.16 177.93 1lud h GLU 47 N 0.88 0.00 0.00 1.82 5.08 -1.50 -3.03 114.58 117.84 1lud h GLU 47 Ca 0.53 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.84 1lud h GLU 47 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1lud h GLU 47 CO -0.31 0.00 -1.66 0.45 -1.00 0.00 0.00 179.01 176.49 1lud n SER 48 N -2.79 0.36 -4.43 1.42 2.88 0.18 -4.96 113.62 106.28 1lud n SER 48 Ca 0.03 0.14 -0.37 0.00 -1.33 0.00 0.00 58.87 57.35 1lud n SER 48 Cb 0.39 1.22 0.05 0.00 -0.75 0.00 0.00 64.21 65.12 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 -2.51 -1.13 -0.07 0.66 3.72 0.29 -4.94 117.46 113.48 1lud n PHE 49 Ca -0.06 0.37 -0.08 0.00 -0.05 0.00 0.00 57.45 57.63 1lud n PHE 49 Cb 0.65 -1.89 -0.05 0.00 -0.94 0.00 0.00 39.48 37.25 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 -0.21 0.00 -4.95 -1.08 0.13 -1.90 -3.45 132.00 120.55 1lud h PRO 50 Ca -0.45 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 1lud h PRO 50 Cb 1.37 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.20 1lud h PRO 50 CO 0.43 0.41 -0.73 0.21 -0.23 0.00 0.00 178.00 178.09 1lud s LYS 51 N -1.99 3.13 -0.03 0.86 2.20 -1.26 -5.09 119.74 117.57 1lud s LYS 51 Ca -0.12 -0.78 0.01 0.00 -0.36 0.00 0.00 55.97 54.71 1lud s LYS 51 Cb 0.00 -3.02 0.02 0.00 -1.51 0.00 0.00 37.83 33.33 1lud s LYS 51 CO 0.31 -0.30 -0.02 1.03 -0.36 0.00 0.00 175.35 176.01 1lud s ARG 52 N 1.42 0.49 0.77 4.03 3.00 -1.26 -4.32 118.95 123.08 1lud s ARG 52 Ca 0.03 -0.03 -0.05 0.00 0.00 0.00 0.00 55.73 55.69 1lud s ARG 52 Cb -0.15 -0.57 0.13 0.00 0.00 0.00 0.00 34.95 34.36 1lud s ARG 52 CO -0.04 -0.07 1.06 -1.25 0.00 0.00 0.00 175.30 175.01 1lud s PRO 53 N 0.76 1.52 0.37 3.54 0.04 -1.26 -5.08 135.00 134.89 1lud s PRO 53 Ca -0.09 -0.86 -0.25 0.00 0.04 0.00 0.00 61.00 59.85 1lud s PRO 53 Cb -0.12 -2.21 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 1lud s PRO 53 CO -0.01 -1.62 1.04 -0.51 0.04 0.00 0.00 177.00 175.94 1lud s LEU 54 N -5.31 4.23 0.27 -3.56 1.43 -1.26 -5.00 118.68 109.48 1lud s LEU 54 Ca 0.67 2.03 -0.29 0.00 -1.03 0.00 0.00 54.13 55.51 1lud s LEU 54 Cb -0.06 -4.09 -0.10 0.00 0.03 0.00 0.00 46.19 41.98 1lud s LEU 54 CO 0.46 -0.37 1.29 -2.16 0.23 0.00 0.00 176.35 175.80 1lud s PRO 55 N -2.29 4.40 -1.28 1.29 0.04 -1.26 -3.24 135.00 132.67 1lud s PRO 55 Ca 0.55 2.11 -0.10 0.00 0.04 0.00 0.00 61.00 63.60 1lud s PRO 55 Cb -0.23 -3.13 0.08 0.00 0.04 0.00 0.00 34.50 31.26 1lud s PRO 55 CO 0.29 -0.18 0.48 0.39 0.04 0.00 0.00 177.00 178.02 1lud n GLU 56 N 1.64 -3.29 -3.78 4.56 -0.58 -1.26 -4.93 120.64 112.99 1lud n GLU 56 Ca 0.03 0.46 -0.13 0.00 -0.42 0.00 0.00 57.16 57.09 1lud n GLU 56 Cb 0.42 -5.15 -0.14 0.00 -0.57 0.00 0.00 31.44 26.00 1lud n GLU 56 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1lud s ARG 57 N -6.02 0.08 -0.14 3.49 0.52 -1.20 -3.81 118.95 111.87 1lud s ARG 57 Ca 0.40 0.26 -0.24 0.00 -0.52 0.00 0.00 55.73 55.63 1lud s ARG 57 Cb -0.21 -0.10 -0.02 0.00 0.52 0.00 0.00 34.95 35.13 1lud s ARG 57 CO 0.49 -0.11 0.76 0.99 0.02 0.00 0.00 175.30 177.45 1lud s THR 58 N 0.75 4.95 0.05 0.02 2.01 -1.21 -4.59 115.64 117.63 1lud s THR 58 Ca -0.06 1.50 0.07 0.00 0.31 0.00 0.00 61.69 63.50 1lud s THR 58 Cb -0.08 -4.07 -0.02 0.00 0.01 0.00 0.00 72.50 68.33 1lud s THR 58 CO -0.03 0.11 -0.18 0.20 -0.69 0.00 0.00 174.62 174.02 1lud s ASN 59 N 1.07 2.19 -0.04 3.53 0.01 -1.26 -0.44 114.94 120.01 1lud s ASN 59 Ca 0.36 -0.52 0.04 0.00 -0.71 0.00 0.00 52.86 52.04 1lud s ASN 59 Cb -0.17 -0.16 -0.00 0.00 0.41 0.00 0.00 41.25 41.33 1lud s ASN 59 CO 0.14 0.10 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.98 1lud s VAL 60 N -0.86 1.37 0.09 1.60 1.01 0.18 -1.83 120.40 121.96 1lud s VAL 60 Ca 0.05 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1lud s VAL 60 Cb -0.09 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1lud s VAL 60 CO 0.02 0.40 0.17 -0.69 0.00 0.00 0.00 175.10 174.99 1lud s VAL 61 N 0.02 5.02 -0.18 2.92 1.01 0.14 -1.46 120.40 127.89 1lud s VAL 61 Ca -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1lud s VAL 61 Cb -0.11 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 32.81 1lud s VAL 61 CO 0.02 0.08 -0.17 -0.76 0.00 0.00 0.00 175.10 174.28 1lud s LEU 62 N -2.62 2.33 0.09 3.92 1.02 -0.68 -2.54 118.68 120.20 1lud s LEU 62 Ca 0.33 -0.56 -0.12 0.00 0.02 0.00 0.00 54.13 53.79 1lud s LEU 62 Cb -0.12 -1.54 0.02 0.00 0.02 0.00 0.00 46.19 44.57 1lud s LEU 62 CO 0.26 0.03 0.29 0.28 0.02 0.00 0.00 176.35 177.22 1lud s THR 63 N 1.15 0.10 -1.94 5.49 -1.32 -1.09 -0.47 115.64 117.55 1lud s THR 63 Ca 0.01 -0.85 0.21 0.00 -1.21 0.00 0.00 61.69 59.86 1lud s THR 63 Cb -0.14 -1.18 0.62 0.00 -1.51 0.00 0.00 72.50 70.29 1lud s THR 63 CO -0.07 -0.47 1.52 1.41 -2.21 0.00 0.00 174.62 174.80 1lud n HIS 64 N 0.04 0.96 -2.22 9.09 8.25 -1.26 -4.23 115.22 125.84 1lud n HIS 64 Ca -0.16 -0.47 -0.26 0.00 -0.26 0.00 0.00 57.72 56.57 1lud n HIS 64 Cb 0.62 -0.02 0.07 0.00 1.12 0.00 0.00 29.99 31.78 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 -1.12 2.22 -0.00 -0.41 1.11 -1.26 -5.02 119.66 115.18 1lud s GLN 65 Ca 0.47 -0.28 0.01 0.00 0.01 0.00 0.00 55.36 55.57 1lud s GLN 65 Cb 0.25 -2.19 -0.01 0.00 -1.01 0.00 0.00 33.01 30.05 1lud s GLN 65 CO 0.31 -1.21 0.03 -1.91 0.01 0.00 0.00 175.29 172.52 1lud n GLU 66 N -2.89 2.27 -0.71 2.91 2.13 -1.26 -4.64 120.64 118.45 1lud n GLU 66 Ca 0.08 -0.01 0.01 0.00 0.66 0.00 0.00 57.16 57.90 1lud n GLU 66 Cb 0.60 -0.86 0.26 0.00 0.27 0.00 0.00 31.44 31.71 1lud n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1lud n ASP 67 N -1.36 3.79 -4.63 4.31 8.00 -1.26 -4.98 116.55 120.42 1lud n ASP 67 Ca -0.00 -3.28 -0.43 0.00 0.71 0.00 0.00 54.79 51.80 1lud n ASP 67 Cb 0.02 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.46 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1lud s TYR 68 N -2.99 1.35 -0.41 1.24 5.04 -1.26 -4.94 117.35 115.38 1lud s TYR 68 Ca 0.47 0.19 -0.13 0.00 -2.44 0.00 0.00 57.07 55.16 1lud s TYR 68 Cb 0.39 -4.05 0.04 0.00 0.35 0.00 0.00 41.96 38.68 1lud s TYR 68 CO 0.08 -4.42 0.28 -0.65 -1.34 0.00 0.00 175.55 169.50 1lud s GLN 69 N 5.45 2.89 -0.36 4.97 -1.52 -1.26 -4.99 119.66 124.84 1lud s GLN 69 Ca 0.92 -1.12 0.01 0.00 -1.95 0.00 0.00 55.36 53.21 1lud s GLN 69 Cb -0.35 -3.91 0.15 0.00 -0.22 0.00 0.00 33.01 28.68 1lud s GLN 69 CO 0.36 -0.79 0.25 0.00 -0.25 0.00 0.00 175.29 174.86 1lud s ALA 70 N 1.61 0.85 0.68 6.09 0.00 -1.26 -5.13 121.76 124.61 1lud s ALA 70 Ca 0.04 -1.87 -0.13 0.00 0.00 0.00 0.00 51.96 50.00 1lud s ALA 70 Cb -0.20 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.27 1lud s ALA 70 CO 0.08 -2.09 1.07 -0.65 0.00 0.00 0.00 175.76 174.17 1lud s GLN 71 N 0.92 2.89 0.00 0.00 -0.21 -1.26 -3.29 119.66 118.71 1lud s GLN 71 Ca 0.21 1.13 0.00 0.00 0.02 0.00 0.00 55.36 56.72 1lud s GLN 71 Cb -0.17 -1.98 0.00 0.00 1.00 0.00 0.00 33.01 31.86 1lud s GLN 71 CO -0.03 -1.15 0.00 0.41 -2.12 0.00 0.00 175.29 172.40 1lud n GLY 72 N -1.35 1.79 3.41 3.09 0.00 -1.26 -4.90 105.19 105.99 1lud n GLY 72 Ca 0.09 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 1lud n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud n ALA 73 N 0.00 1.00 -2.66 4.61 0.00 -1.21 -4.81 120.51 117.44 1lud n ALA 73 Ca 0.00 -1.87 -0.33 0.00 0.00 0.00 0.00 53.44 51.24 1lud n ALA 73 Cb 0.00 0.58 -0.14 0.00 0.00 0.00 0.00 19.45 19.90 1lud n ALA 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1lud s VAL 74 N -2.23 3.00 -0.18 0.00 1.01 -0.76 -4.94 120.40 116.30 1lud s VAL 74 Ca 0.46 -0.73 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 1lud s VAL 74 Cb -0.04 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1lud s VAL 74 CO 0.30 0.57 -0.01 -0.69 0.00 0.00 0.00 175.10 175.27 1lud s VAL 75 N -0.39 4.05 0.05 2.92 1.01 -1.26 -0.68 120.40 126.10 1lud s VAL 75 Ca 0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 1lud s VAL 75 Cb -0.12 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 1lud s VAL 75 CO 0.02 0.46 -0.04 0.68 0.00 0.00 0.00 175.10 176.22 1lud s VAL 76 N 0.63 0.28 -0.08 2.92 -7.23 -1.05 -4.97 120.40 110.89 1lud s VAL 76 Ca -0.01 -1.57 0.22 0.00 -1.81 0.00 0.00 61.98 58.81 1lud s VAL 76 Cb -0.14 -1.19 0.44 0.00 0.56 0.00 0.00 36.38 36.05 1lud s VAL 76 CO 0.02 -0.83 1.17 1.41 -0.31 0.00 0.00 175.10 176.57 1lud n HIS 77 N 0.52 0.28 -3.15 2.82 8.25 -1.26 -2.68 115.22 119.99 1lud n HIS 77 Ca -0.17 -0.97 0.05 0.00 -0.26 0.00 0.00 57.72 56.37 1lud n HIS 77 Cb 0.59 -0.19 -0.01 0.00 1.12 0.00 0.00 29.99 31.51 1lud n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1lud s ASP 78 N -2.53 -1.10 0.51 0.41 1.01 -1.26 -4.92 116.67 108.79 1lud s ASP 78 Ca 0.34 0.48 0.42 0.00 0.71 0.00 0.00 52.55 54.51 1lud s ASP 78 Cb 0.38 1.84 1.63 0.00 1.01 0.00 0.00 42.92 47.77 1lud s ASP 78 CO -0.13 -0.20 1.59 0.58 0.21 0.00 0.00 175.17 177.22 1lud h VAL 79 N 5.66 0.04 -0.85 -1.27 2.07 -1.99 0.88 116.25 120.78 1lud h VAL 79 Ca -0.14 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.42 1lud h VAL 79 Cb 1.17 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 1lud h VAL 79 CO 0.10 0.00 0.54 0.00 0.02 0.00 0.00 177.57 178.24 1lud h ALA 80 N 1.27 1.14 -0.14 1.67 0.00 -2.00 -2.12 119.26 119.08 1lud h ALA 80 Ca 0.89 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.75 1lud h ALA 80 Cb 3.30 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 20.81 1lud h ALA 80 CO -0.19 0.34 -0.02 0.00 0.00 0.00 0.00 179.25 179.38 1lud h ALA 81 N 1.37 0.19 -0.97 0.00 0.00 0.38 -2.95 119.26 117.28 1lud h ALA 81 Ca 0.35 -0.21 0.18 0.00 0.00 0.00 0.00 54.91 55.23 1lud h ALA 81 Cb 0.06 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.70 1lud h ALA 81 CO -0.14 -0.09 0.57 0.28 0.00 0.00 0.00 179.25 179.88 1lud h VAL 82 N -0.04 0.71 -0.86 0.00 2.07 -1.33 0.11 116.25 116.91 1lud h VAL 82 Ca 0.04 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1lud h VAL 82 Cb 0.42 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1lud h VAL 82 CO 0.01 0.13 0.45 -0.26 0.02 0.00 0.00 177.57 177.92 1lud h PHE 83 N 0.73 1.20 0.51 1.57 0.04 -1.23 -3.01 116.94 116.75 1lud h PHE 83 Ca 0.56 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 61.26 1lud h PHE 83 Cb 0.85 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 38.61 1lud h PHE 83 CO -0.03 0.85 -0.38 0.00 -0.60 0.00 0.00 178.31 178.15 1lud h ALA 84 N 1.28 -1.13 -0.62 2.45 0.00 -0.63 -2.04 119.26 118.56 1lud h ALA 84 Ca 0.30 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 55.13 1lud h ALA 84 Cb 0.06 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 1lud h ALA 84 CO -0.04 -1.12 -0.45 -0.92 0.00 0.00 0.00 179.25 176.71 1lud h TYR 85 N -0.85 -1.35 -0.65 0.00 3.20 -1.47 0.93 116.97 116.78 1lud h TYR 85 Ca -0.07 0.09 0.13 0.00 3.14 0.00 0.00 58.73 62.02 1lud h TYR 85 Cb 0.70 0.68 -0.09 0.00 1.54 0.00 0.00 36.73 39.55 1lud h TYR 85 CO -0.12 -0.42 0.15 0.00 -1.64 0.00 0.00 178.16 176.13 1lud h ALA 86 N 0.60 0.80 0.00 1.82 0.00 -1.46 0.70 119.26 121.72 1lud h ALA 86 Ca 0.18 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1lud h ALA 86 Cb 0.56 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1lud h ALA 86 CO -0.72 -0.31 0.00 -0.22 0.00 0.00 0.00 179.25 178.00 1lud h LYS 87 N 0.27 0.00 0.13 0.00 3.64 -0.16 -2.95 116.57 117.49 1lud h LYS 87 Ca 0.35 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.39 1lud h LYS 87 Cb 0.55 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 1lud h LYS 87 CO -0.44 0.00 -1.78 0.37 -2.27 0.00 0.00 179.45 175.34 1lud h GLN 88 N 0.00 0.27 -5.53 1.90 4.15 0.24 -3.45 115.11 112.69 1lud h GLN 88 Ca 0.00 -0.46 -0.61 0.00 0.77 0.00 0.00 58.65 58.35 1lud h GLN 88 Cb 0.31 0.17 -0.11 0.00 0.21 0.00 0.00 27.48 28.06 1lud h GLN 88 CO 0.00 1.14 0.18 -1.01 -1.93 0.00 0.00 178.83 177.21 1lud s HIS 89 N -2.58 3.28 -2.02 3.99 3.76 0.01 -4.92 115.29 116.81 1lud s HIS 89 Ca -0.15 0.84 0.08 0.00 -0.15 0.00 0.00 55.06 55.68 1lud s HIS 89 Cb 0.06 -2.85 0.30 0.00 1.11 0.00 0.00 32.58 31.20 1lud s HIS 89 CO 0.82 -0.33 1.22 -0.35 -0.85 0.00 0.00 174.74 175.25 1lud n PRO 90 N 5.73 1.39 0.00 8.40 -0.04 -1.26 -3.53 135.00 145.69 1lud n PRO 90 Ca -0.00 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 1lud n PRO 90 Cb 0.49 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 1lud n PRO 90 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1lud n ASP 91 N -0.05 0.23 -3.42 3.54 2.03 -1.26 -5.00 116.55 112.62 1lud n ASP 91 Ca 0.07 -1.11 -0.18 0.00 0.52 0.00 0.00 54.79 54.10 1lud n ASP 91 Cb 0.15 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.45 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1lud s GLN 92 N -0.11 0.29 0.00 -0.67 2.00 -1.23 -4.71 119.66 115.23 1lud s GLN 92 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 55.36 53.31 1lud s GLN 92 Cb 0.00 -0.79 0.00 0.00 0.80 0.00 0.00 33.01 33.02 1lud s GLN 92 CO 0.00 -0.93 0.00 0.39 -0.50 0.00 0.00 175.29 174.25 1lud n GLU 93 N 5.31 0.56 -3.57 1.67 1.02 -1.26 -4.64 120.64 119.73 1lud n GLU 93 Ca -0.03 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.71 1lud n GLU 93 Cb 0.47 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.78 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 4.46 -0.15 -4.62 2.96 -1.26 -2.39 118.68 117.68 1lud s LEU 94 Ca 0.00 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.38 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 -0.25 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.91 1lud s VAL 95 N 1.67 2.41 0.30 1.68 1.01 0.76 -0.99 120.40 127.24 1lud s VAL 95 Ca 0.05 -0.86 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 1lud s VAL 95 Cb -0.18 -2.00 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 1lud s VAL 95 CO 0.09 0.53 0.72 -0.63 0.00 0.00 0.00 175.10 175.80 1lud s ILE 96 N 0.83 4.69 0.00 2.22 -1.09 0.37 0.83 121.20 129.05 1lud s ILE 96 Ca -0.06 0.95 0.00 0.00 -2.23 0.00 0.00 60.65 59.32 1lud s ILE 96 Cb -0.15 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1lud s ILE 96 CO -0.01 -0.12 0.21 0.00 -1.23 0.00 0.00 174.94 173.80 1lud n ALA 97 N -0.18 1.38 0.00 9.38 0.00 0.25 -1.98 120.51 129.36 1lud n ALA 97 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.25 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 0.15 -1.44 0.00 0.00 0.00 -1.20 -4.90 105.19 97.81 1lud n GLY 98 Ca 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.13 0.33 -0.02 0.00 -1.26 -0.00 105.19 103.11 1lud n GLY 99 Ca 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 46.02 44.86 1lud n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud h ALA 100 N -2.00 1.23 -0.91 4.61 0.00 -1.92 -2.44 119.26 117.83 1lud h ALA 100 Ca 0.00 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1lud h ALA 100 Cb 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 1lud h ALA 100 CO 0.00 0.57 0.60 1.96 0.00 0.00 0.00 179.25 182.38 1lud h GLN 101 N 0.98 1.08 0.00 0.00 4.20 -1.95 -1.70 115.11 117.72 1lud h GLN 101 Ca 0.23 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.77 1lud h GLN 101 Cb 0.16 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1lud h GLN 101 CO -0.02 0.71 -0.52 0.82 -0.67 0.00 0.00 178.83 179.15 1lud h ILE 102 N 1.11 1.03 0.00 2.54 1.08 -1.68 -3.01 117.51 118.58 1lud h ILE 102 Ca 0.37 -2.06 -0.05 0.00 -0.39 0.00 0.00 64.86 62.73 1lud h ILE 102 Cb 0.07 2.24 -0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1lud h ILE 102 CO -0.12 0.51 -0.24 -0.26 -0.69 0.00 0.00 178.15 177.35 1lud h PHE 103 N 0.00 0.00 0.01 1.37 0.04 -1.00 -2.90 116.94 114.46 1lud h PHE 103 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1lud h PHE 103 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1lud h PHE 103 CO 0.00 0.24 -0.00 1.15 -0.60 0.00 0.00 178.31 179.09 1lud h THR 104 N 0.00 1.56 0.00 -1.55 2.02 -1.29 -0.54 112.91 113.12 1lud h THR 104 Ca -0.00 -1.84 -0.02 0.00 0.77 0.00 0.00 66.41 65.32 1lud h THR 104 Cb 0.89 2.78 -0.00 0.00 -1.74 0.00 0.00 68.15 70.08 1lud h THR 104 CO 0.03 0.47 -0.09 0.00 0.37 0.00 0.00 175.52 176.30 1lud h ALA 105 N 0.13 1.73 -0.09 6.16 0.00 -1.58 -2.20 119.26 123.41 1lud h ALA 105 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1lud h ALA 105 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1lud h ALA 105 CO 0.00 0.11 0.00 1.19 0.00 0.00 0.00 179.25 180.55 1lud n PHE 106 N -4.25 0.09 -0.36 0.00 3.72 -1.10 -4.47 117.46 111.10 1lud n PHE 106 Ca -0.03 -0.05 -0.01 0.00 -0.05 0.00 0.00 57.45 57.32 1lud n PHE 106 Cb 0.17 -0.00 0.14 0.00 -0.94 0.00 0.00 39.48 38.85 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 4.28 1.25 -0.35 -1.08 2.10 -0.42 -2.41 116.57 119.94 1lud h LYS 107 Ca 0.00 -0.07 -0.10 0.00 -2.00 0.00 0.00 60.65 58.48 1lud h LYS 107 Cb 0.92 -0.28 -0.02 0.00 -0.90 0.00 0.00 32.23 31.95 1lud h LYS 107 CO 0.00 0.82 -0.19 0.22 -2.00 0.00 0.00 179.45 178.30 1lud h ASP 108 N 1.28 0.65 -3.76 7.07 3.58 -1.78 -3.35 116.42 120.11 1lud h ASP 108 Ca 0.37 -0.21 -0.73 0.00 0.42 0.00 0.00 57.03 56.88 1lud h ASP 108 Cb -0.08 -0.18 -0.32 0.00 1.72 0.00 0.00 39.33 40.47 1lud h ASP 108 CO -0.10 0.84 -0.07 -1.81 -2.88 0.00 0.00 179.24 175.22 1lud s ASP 109 N -6.76 6.07 0.15 2.28 1.11 -0.91 -5.05 116.67 113.57 1lud s ASP 109 Ca -0.08 -3.20 0.11 0.00 0.18 0.00 0.00 52.55 49.55 1lud s ASP 109 Cb 0.14 -1.99 -0.04 0.00 1.07 0.00 0.00 42.92 42.09 1lud s ASP 109 CO 0.81 -0.34 -0.25 -0.69 1.18 0.00 0.00 175.17 175.88 1lud s VAL 110 N -0.59 2.37 0.00 -1.27 1.01 -1.25 -4.68 120.40 115.99 1lud s VAL 110 Ca 0.22 -1.81 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1lud s VAL 110 Cb -0.13 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1lud s VAL 110 CO -0.08 0.02 0.00 -0.67 0.00 0.00 0.00 175.10 174.37 1lud n ASP 111 N 0.68 2.87 -3.69 3.32 -0.08 0.46 -4.76 116.55 115.35 1lud n ASP 111 Ca -0.16 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.01 1lud n ASP 111 Cb 0.54 0.20 -0.11 0.00 2.34 0.00 0.00 41.12 44.09 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 -1.62 -0.22 -0.15 5.18 2.01 -1.07 -2.60 115.64 117.18 1lud s THR 112 Ca 0.00 0.14 -0.06 0.00 0.31 0.00 0.00 61.69 62.08 1lud s THR 112 Cb 0.00 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 1lud s THR 112 CO 0.00 0.06 0.06 -0.76 -0.69 0.00 0.00 174.62 173.29 1lud s LEU 113 N 1.79 3.88 -0.30 4.42 1.43 -0.48 -0.83 118.68 128.59 1lud s LEU 113 Ca -0.06 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.23 1lud s LEU 113 Cb -0.10 -1.96 0.09 0.00 0.03 0.00 0.00 46.19 44.25 1lud s LEU 113 CO -0.12 0.26 0.01 -0.76 0.23 0.00 0.00 176.35 175.98 1lud s LEU 114 N -0.17 3.77 -0.04 1.79 1.43 0.35 -0.57 118.68 125.24 1lud s LEU 114 Ca 0.07 -1.77 0.07 0.00 -1.03 0.00 0.00 54.13 51.47 1lud s LEU 114 Cb -0.12 -1.42 -0.02 0.00 0.03 0.00 0.00 46.19 44.66 1lud s LEU 114 CO 0.01 -0.32 -0.26 0.54 0.23 0.00 0.00 176.35 176.55 1lud s VAL 115 N 1.13 2.05 -0.30 -1.59 0.11 -0.74 -1.50 120.40 119.56 1lud s VAL 115 Ca 0.04 -1.09 -0.05 0.00 -2.93 0.00 0.00 61.98 57.95 1lud s VAL 115 Cb -0.19 -1.71 0.03 0.00 -1.53 0.00 0.00 36.38 32.97 1lud s VAL 115 CO -0.10 0.57 0.06 -0.89 -3.33 0.00 0.00 175.10 171.41 1lud s THR 116 N -0.41 3.63 -0.31 5.04 2.01 -1.03 -1.08 115.64 123.48 1lud s THR 116 Ca 0.04 -0.95 -0.16 0.00 0.31 0.00 0.00 61.69 60.93 1lud s THR 116 Cb -0.12 -2.94 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 1lud s THR 116 CO 0.01 0.00 0.41 -0.13 -0.69 0.00 0.00 174.62 174.23 1lud s ARG 117 N 1.42 3.79 0.46 4.92 0.52 -0.71 0.28 118.95 129.64 1lud s ARG 117 Ca 0.00 -0.12 -0.13 0.00 -0.52 0.00 0.00 55.73 54.96 1lud s ARG 117 Cb -0.18 -3.74 -0.07 0.00 0.52 0.00 0.00 34.95 31.49 1lud s ARG 117 CO 0.01 -0.44 0.88 -0.51 0.02 0.00 0.00 175.30 175.25 1lud s LEU 118 N 2.15 3.71 0.14 2.53 1.02 -0.43 -1.65 118.68 126.16 1lud s LEU 118 Ca 0.15 1.33 0.11 0.00 0.02 0.00 0.00 54.13 55.75 1lud s LEU 118 Cb -0.16 -4.25 -0.12 0.00 0.02 0.00 0.00 46.19 41.68 1lud s LEU 118 CO 0.11 -0.51 1.21 0.00 0.02 0.00 0.00 176.35 177.19 1lud h ALA 119 N 1.01 0.52 -2.42 4.21 0.00 -1.03 -3.12 119.26 118.44 1lud h ALA 119 Ca -0.47 -0.84 -0.47 0.00 0.00 0.00 0.00 54.91 53.13 1lud h ALA 119 Cb 1.19 -0.02 0.13 0.00 0.00 0.00 0.00 17.79 19.09 1lud h ALA 119 CO 0.63 1.08 0.29 0.20 0.00 0.00 0.00 179.25 181.44 1lud s GLY 120 N -4.69 1.60 -0.21 0.00 0.00 -1.17 -4.80 107.32 98.05 1lud s GLY 120 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 44.72 44.43 1lud s GLY 120 CO 0.80 0.20 -0.15 -0.56 0.00 0.00 0.00 173.10 173.39 1lud s SER 121 N -3.79 3.64 0.30 1.64 0.01 -1.26 -3.52 113.70 110.71 1lud s SER 121 Ca 0.63 -0.96 0.09 0.00 1.31 0.00 0.00 55.95 57.02 1lud s SER 121 Cb -0.16 -1.45 -0.04 0.00 0.21 0.00 0.00 66.02 64.58 1lud s SER 121 CO 0.55 -0.10 0.08 -0.36 0.41 0.00 0.00 173.24 173.82 1lud s PHE 122 N 1.25 2.75 0.33 2.43 0.40 -1.26 -5.06 117.98 118.81 1lud s PHE 122 Ca -0.01 -0.28 0.09 0.00 -0.60 0.00 0.00 56.93 56.13 1lud s PHE 122 Cb -0.16 -1.40 -0.05 0.00 0.51 0.00 0.00 43.02 41.92 1lud s PHE 122 CO -0.09 0.49 0.02 -1.83 0.70 0.00 0.00 175.22 174.51 1lud s GLU 123 N -3.76 2.13 0.00 0.44 1.03 -1.26 -4.87 118.70 112.40 1lud s GLU 123 Ca 0.34 -1.69 0.00 0.00 0.03 0.00 0.00 54.97 53.65 1lud s GLU 123 Cb -0.05 -1.98 0.00 0.00 -0.80 0.00 0.00 34.13 31.30 1lud s GLU 123 CO 0.22 0.16 0.00 0.41 -1.33 0.00 0.00 175.26 174.72 1lud n GLY 124 N -0.96 -0.73 0.00 -3.83 0.00 -1.26 -4.99 105.19 93.41 1lud n GLY 124 Ca -0.04 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 -4.28 1.61 8.00 -1.26 -5.06 116.55 115.56 1lud n ASP 125 Ca 0.00 -0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.16 1lud n ASP 125 Cb 0.00 0.01 -0.15 0.00 -0.02 0.00 0.00 41.12 40.96 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 -0.01 2.71 0.26 -3.53 2.01 -1.24 -5.07 115.64 110.77 1lud s THR 126 Ca 0.00 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1lud s THR 126 Cb 0.00 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.31 1lud s THR 126 CO 0.00 0.52 0.01 -0.54 -0.69 0.00 0.00 174.62 173.92 1lud s LYS 127 N 0.76 1.43 0.83 4.92 1.02 -1.26 -1.96 119.74 125.48 1lud s LYS 127 Ca -0.06 -1.74 -0.12 0.00 0.02 0.00 0.00 55.97 54.07 1lud s LYS 127 Cb -0.15 -0.70 0.10 0.00 -0.52 0.00 0.00 37.83 36.55 1lud s LYS 127 CO 0.01 -0.11 1.15 1.41 -0.92 0.00 0.00 175.35 176.89 1lud s MET 128 N -3.87 1.61 0.84 1.68 1.75 -1.21 -4.83 119.30 115.26 1lud s MET 128 Ca 0.31 1.53 -0.11 0.00 -1.25 0.00 0.00 55.69 56.17 1lud s MET 128 Cb 0.06 -1.79 0.09 0.00 2.84 0.00 0.00 34.83 36.03 1lud s MET 128 CO 0.11 -2.19 1.10 0.96 -0.65 0.00 0.00 175.02 174.34 1lud s ILE 129 N -2.50 2.89 -0.58 10.11 -4.36 -1.26 -4.91 121.20 120.58 1lud s ILE 129 Ca 0.68 0.29 -0.26 0.00 -0.26 0.00 0.00 60.65 61.09 1lud s ILE 129 Cb -0.23 -2.93 -0.04 0.00 1.25 0.00 0.00 42.46 40.51 1lud s ILE 129 CO 0.54 -0.38 2.03 -2.16 0.24 0.00 0.00 174.94 175.21 1lud s PRO 130 N -5.07 2.46 0.29 0.37 0.05 -1.26 -4.98 135.00 126.86 1lud s PRO 130 Ca 0.62 0.84 -0.12 0.00 0.05 0.00 0.00 61.00 62.39 1lud s PRO 130 Cb -0.16 -4.46 -0.08 0.00 0.05 0.00 0.00 34.50 29.86 1lud s PRO 130 CO 0.55 -2.91 0.65 -0.51 0.05 0.00 0.00 177.00 174.83 1lud s LEU 131 N 10.06 4.09 -1.27 -3.56 1.43 -1.26 -4.98 118.68 123.18 1lud s LEU 131 Ca 0.76 1.09 -0.07 0.00 -1.03 0.00 0.00 54.13 54.88 1lud s LEU 131 Cb -0.14 -3.89 0.17 0.00 0.03 0.00 0.00 46.19 42.37 1lud s LEU 131 CO 0.22 -0.16 1.99 0.59 0.23 0.00 0.00 176.35 179.22 1lud n ASN 132 N -0.36 6.15 -0.15 2.29 4.13 -1.26 -4.76 115.26 121.30 1lud n ASN 132 Ca 0.02 -3.16 0.27 0.00 1.68 0.00 0.00 54.58 53.39 1lud n ASN 132 Cb 0.53 -1.42 0.72 0.00 -1.54 0.00 0.00 39.78 38.07 1lud n ASN 132 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1lud h TRP 133 N 5.33 0.00 -0.08 3.10 4.06 -1.94 0.39 115.95 126.81 1lud h TRP 133 Ca 0.47 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.40 1lud h TRP 133 Cb 0.52 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.68 1lud h TRP 133 CO 1.34 0.00 -0.04 0.22 -3.56 0.00 0.00 178.44 176.40 1lud h ASP 134 N 0.00 0.10 0.17 -3.49 3.58 -2.04 -0.27 116.42 114.46 1lud h ASP 134 Ca 0.40 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1lud h ASP 134 Cb 1.60 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.63 1lud h ASP 134 CO -0.00 0.15 -0.12 0.47 -2.88 0.00 0.00 179.24 176.86 1lud n ASP 135 N -4.43 0.97 -4.54 2.28 9.92 0.13 -4.88 116.55 116.01 1lud n ASP 135 Ca -0.02 -1.02 -0.25 0.00 -0.53 0.00 0.00 54.79 52.97 1lud n ASP 135 Cb 0.16 0.03 -0.10 0.00 -0.64 0.00 0.00 41.12 40.57 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1lud s PHE 136 N -2.29 2.40 -0.03 1.24 0.40 -0.11 -3.90 117.98 115.69 1lud s PHE 136 Ca 0.32 -0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.23 1lud s PHE 136 Cb 0.20 -1.28 0.02 0.00 0.51 0.00 0.00 43.02 42.47 1lud s PHE 136 CO 0.44 0.61 -0.05 0.99 0.70 0.00 0.00 175.22 177.91 1lud s THR 137 N -2.56 0.50 -0.16 0.64 2.01 -1.05 -4.90 115.64 110.12 1lud s THR 137 Ca 0.32 -0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.88 1lud s THR 137 Cb -0.00 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.98 1lud s THR 137 CO 0.17 0.19 1.42 -0.75 -0.69 0.00 0.00 174.62 174.96 1lud s LYS 138 N 0.62 4.13 -0.09 4.92 2.36 -1.26 -1.73 119.74 128.68 1lud s LYS 138 Ca -0.08 1.76 0.20 0.00 -2.55 0.00 0.00 55.97 55.30 1lud s LYS 138 Cb -0.11 -3.87 -0.30 0.00 -1.05 0.00 0.00 37.83 32.50 1lud s LYS 138 CO -0.00 -0.86 0.33 1.33 1.55 0.00 0.00 175.35 177.70 1lud n VAL 139 N 5.62 0.60 -3.80 4.02 0.24 -0.18 -4.96 118.33 119.87 1lud n VAL 139 Ca 0.15 -0.65 -0.13 0.00 -2.04 0.00 0.00 64.34 61.68 1lud n VAL 139 Cb 0.44 -0.21 -0.13 0.00 -1.47 0.00 0.00 33.84 32.47 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 -4.95 -0.14 -0.15 -1.34 0.01 -1.19 -5.04 113.70 100.89 1lud s SER 140 Ca -0.09 0.30 -0.11 0.00 1.31 0.00 0.00 55.95 57.36 1lud s SER 140 Cb 0.11 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.64 1lud s SER 140 CO 0.87 -0.08 0.38 -0.44 0.41 0.00 0.00 173.24 174.38 1lud s SER 141 N 0.45 -0.43 -0.04 2.44 0.01 -1.26 -0.80 113.70 114.07 1lud s SER 141 Ca -0.03 0.79 0.02 0.00 1.31 0.00 0.00 55.95 58.04 1lud s SER 141 Cb -0.05 0.75 0.01 0.00 0.21 0.00 0.00 66.02 66.95 1lud s SER 141 CO -0.02 -0.15 -0.09 -0.60 0.41 0.00 0.00 173.24 172.78 1lud s ARG 142 N 0.65 1.21 -0.17 12.44 6.06 -0.90 -4.98 118.95 133.27 1lud s ARG 142 Ca -0.04 -0.31 -0.06 0.00 -2.50 0.00 0.00 55.73 52.83 1lud s ARG 142 Cb -0.05 -1.08 -0.03 0.00 0.06 0.00 0.00 34.95 33.84 1lud s ARG 142 CO -0.04 0.05 0.02 0.99 -2.50 0.00 0.00 175.30 173.81 1lud s THR 143 N 0.51 4.41 -0.10 4.11 2.01 -1.26 -1.04 115.64 124.28 1lud s THR 143 Ca -0.09 -0.17 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1lud s THR 143 Cb -0.13 -2.97 0.01 0.00 0.01 0.00 0.00 72.50 69.43 1lud s THR 143 CO 0.02 0.47 -0.16 0.54 -0.69 0.00 0.00 174.62 174.80 1lud s VAL 144 N 0.40 1.52 0.50 3.82 0.11 -0.97 -5.03 120.40 120.75 1lud s VAL 144 Ca 0.00 -0.67 -0.05 0.00 -2.93 0.00 0.00 61.98 58.34 1lud s VAL 144 Cb -0.13 -1.38 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 1lud s VAL 144 CO 0.01 0.44 0.79 -1.61 -3.33 0.00 0.00 175.10 171.41 1lud s GLU 145 N 0.87 3.36 0.05 1.54 2.02 -1.26 -2.87 118.70 122.41 1lud s GLU 145 Ca -0.09 0.08 -0.00 0.00 0.02 0.00 0.00 54.97 54.97 1lud s GLU 145 Cb -0.15 -2.38 -0.04 0.00 0.10 0.00 0.00 34.13 31.66 1lud s GLU 145 CO 0.00 -0.31 -0.04 0.34 0.02 0.00 0.00 175.26 175.28 1lud s ASP 146 N -4.16 0.51 0.51 -0.19 2.15 -1.26 -4.93 116.67 109.31 1lud s ASP 146 Ca 0.49 -0.87 0.16 0.00 0.43 0.00 0.00 52.55 52.76 1lud s ASP 146 Cb -0.10 0.16 1.26 0.00 -0.30 0.00 0.00 42.92 43.94 1lud s ASP 146 CO 0.44 -0.50 2.13 0.71 -0.17 0.00 0.00 175.17 177.77 1lud h THR 147 N 3.52 0.98 -3.56 1.71 1.35 -1.99 -3.39 112.91 111.54 1lud h THR 147 Ca -0.34 -0.01 -0.61 0.00 -0.55 0.00 0.00 66.41 64.90 1lud h THR 147 Cb 1.16 0.94 -0.12 0.00 -1.73 0.00 0.00 68.15 68.40 1lud h THR 147 CO 0.59 0.01 -0.04 0.20 -0.25 0.00 0.00 175.52 176.03 1lud s ASN 148 N -6.96 6.45 0.27 5.36 -0.87 -1.26 -4.96 114.94 112.98 1lud s ASN 148 Ca -0.05 0.54 0.01 0.00 -1.57 0.00 0.00 52.86 51.78 1lud s ASN 148 Cb 0.17 -2.28 0.63 0.00 -0.02 0.00 0.00 41.25 39.75 1lud s ASN 148 CO 0.68 -0.25 1.70 -0.65 -2.57 0.00 0.00 177.10 176.01 1lud h PRO 149 N 7.87 0.38 0.15 -0.60 0.10 -1.99 -1.09 132.00 136.82 1lud h PRO 149 Ca -0.30 -0.02 -0.28 0.00 0.10 0.00 0.00 66.00 65.49 1lud h PRO 149 Cb 1.15 -0.08 0.01 0.00 0.10 0.00 0.00 31.00 32.17 1lud h PRO 149 CO 0.72 0.25 -1.28 0.00 0.10 0.00 0.00 178.00 177.79 1lud h ALA 150 N 1.66 0.05 0.00 -0.75 0.00 -1.92 -3.21 119.26 115.09 1lud h ALA 150 Ca 0.51 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1lud h ALA 150 Cb 0.91 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1lud h ALA 150 CO -0.51 0.91 0.00 1.28 0.00 0.00 0.00 179.25 180.94 1lud n LEU 151 N -3.58 0.00 -4.78 0.00 4.77 -0.47 -3.04 117.00 109.90 1lud n LEU 151 Ca -0.10 0.19 -0.35 0.00 -0.03 0.00 0.00 56.01 55.72 1lud n LEU 151 Cb 1.03 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.92 1lud n LEU 151 CO 0.55 -0.10 0.77 -0.89 -1.33 0.00 0.00 177.39 176.39 1lud s THR 152 N -2.38 3.35 0.16 -5.08 2.01 -0.88 -4.73 115.64 108.09 1lud s THR 152 Ca 0.16 0.88 -0.25 0.00 0.31 0.00 0.00 61.69 62.80 1lud s THR 152 Cb 0.10 -3.38 0.06 0.00 0.01 0.00 0.00 72.50 69.29 1lud s THR 152 CO 0.20 -0.14 0.92 -1.38 -0.69 0.00 0.00 174.62 173.53 1lud s HIS 153 N -1.78 -0.16 0.09 4.92 -3.43 -1.14 -0.72 115.29 113.07 1lud s HIS 153 Ca 0.69 -0.15 0.05 0.00 -0.80 0.00 0.00 55.06 54.85 1lud s HIS 153 Cb -0.23 0.64 -0.03 0.00 -1.43 0.00 0.00 32.58 31.53 1lud s HIS 153 CO 0.26 -0.85 -0.13 0.99 -2.00 0.00 0.00 174.74 173.01 1lud s THR 154 N -3.35 1.09 -0.21 -5.38 2.01 -0.66 -2.29 115.64 106.85 1lud s THR 154 Ca 0.11 -1.45 -0.06 0.00 0.31 0.00 0.00 61.69 60.61 1lud s THR 154 Cb -0.02 -1.20 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 1lud s THR 154 CO 0.02 -0.34 0.02 -0.31 -0.69 0.00 0.00 174.62 173.31 1lud s TYR 155 N -1.69 3.06 -0.17 4.92 2.02 -0.20 -1.73 117.35 123.56 1lud s TYR 155 Ca 0.01 -0.43 -0.00 0.00 -0.37 0.00 0.00 57.07 56.28 1lud s TYR 155 Cb -0.07 -2.12 0.00 0.00 -0.40 0.00 0.00 41.96 39.37 1lud s TYR 155 CO 0.02 -0.25 -0.15 -1.21 -1.57 0.00 0.00 175.55 172.39 1lud s GLU 156 N 1.10 3.19 -0.17 -0.62 2.02 -0.25 -2.11 118.70 121.88 1lud s GLU 156 Ca 0.03 -0.75 -0.02 0.00 0.02 0.00 0.00 54.97 54.25 1lud s GLU 156 Cb -0.14 -2.66 -0.01 0.00 0.10 0.00 0.00 34.13 31.42 1lud s GLU 156 CO 0.02 -0.04 -0.08 0.08 0.02 0.00 0.00 175.26 175.25 1lud s VAL 157 N 0.96 3.33 0.31 2.63 1.01 0.02 -1.78 120.40 126.89 1lud s VAL 157 Ca -0.02 -0.54 0.10 0.00 0.00 0.00 0.00 61.98 61.51 1lud s VAL 157 Cb -0.15 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 1lud s VAL 157 CO -0.02 0.48 -0.04 0.26 0.00 0.00 0.00 175.10 175.78 1lud s TRP 158 N 0.74 2.52 0.01 5.22 0.52 0.26 -1.02 118.94 127.20 1lud s TRP 158 Ca -0.04 -0.37 0.00 0.00 0.02 0.00 0.00 56.10 55.72 1lud s TRP 158 Cb -0.15 -1.32 -0.01 0.00 -1.15 0.00 0.00 33.47 30.84 1lud s TRP 158 CO 0.02 0.56 -0.03 -0.65 0.02 0.00 0.00 176.95 176.87 1lud s GLN 159 N -3.66 0.22 -0.04 4.98 -0.21 -0.71 -1.38 119.66 118.87 1lud s GLN 159 Ca 0.33 -0.35 -0.30 0.00 0.02 0.00 0.00 55.36 55.06 1lud s GLN 159 Cb -0.02 -0.02 -0.03 0.00 1.00 0.00 0.00 33.01 33.93 1lud s GLN 159 CO 0.18 -0.00 1.08 0.21 -2.12 0.00 0.00 175.29 174.64 1lud s LYS 160 N -0.79 4.44 0.57 2.91 2.20 -1.07 -2.53 119.74 125.49 1lud s LYS 160 Ca -0.08 1.53 -0.18 0.00 -0.36 0.00 0.00 55.97 56.88 1lud s LYS 160 Cb -0.05 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1lud s LYS 160 CO -0.00 -0.27 1.10 0.15 -0.36 0.00 0.00 175.35 175.97 1lud s LYS 161 N 1.64 3.26 0.00 4.03 -0.14 -1.25 -5.01 119.74 122.27 1lud s LYS 161 Ca 0.53 1.45 0.00 0.00 -1.36 0.00 0.00 55.97 56.59 1lud s LYS 161 Cb -0.22 -2.01 0.00 0.00 -1.68 0.00 0.00 37.83 33.92 1lud s LYS 161 CO 0.23 -0.89 0.00 0.00 -0.76 0.00 0.00 175.35 173.93