#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 1.52 -0.14 2.41 0.00 0.03 0.14 121.76 125.71 1lud s ALA 2 Ca 0.00 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 50.68 1lud s ALA 2 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 1lud s ALA 2 CO 0.00 0.19 0.07 -0.06 0.00 0.00 0.00 175.76 175.95 1lud s PHE 3 N -1.67 3.31 -0.43 0.00 0.40 0.53 0.16 117.98 120.28 1lud s PHE 3 Ca 0.06 0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.62 1lud s PHE 3 Cb -0.08 -1.98 0.14 0.00 0.51 0.00 0.00 43.02 41.62 1lud s PHE 3 CO 0.03 0.37 0.26 -1.17 0.70 0.00 0.00 175.22 175.41 1lud s LEU 4 N -0.25 2.12 -0.01 -0.37 2.96 -0.93 0.11 118.68 122.30 1lud s LEU 4 Ca 0.08 -2.63 0.03 0.00 -0.22 0.00 0.00 54.13 51.38 1lud s LEU 4 Cb -0.12 -0.79 -0.01 0.00 0.50 0.00 0.00 46.19 45.77 1lud s LEU 4 CO 0.01 -0.25 -0.09 -1.66 -1.32 0.00 0.00 176.35 173.05 1lud s TRP 5 N 0.41 0.77 -0.15 5.38 -2.14 -0.90 -4.67 118.94 117.65 1lud s TRP 5 Ca 0.20 -0.15 -0.13 0.00 2.66 0.00 0.00 56.10 58.69 1lud s TRP 5 Cb -0.18 -0.50 -0.05 0.00 -3.10 0.00 0.00 33.47 29.64 1lud s TRP 5 CO -0.04 -0.02 0.27 0.00 -2.66 0.00 0.00 176.95 174.51 1lud s ALA 6 N -0.18 3.63 0.12 2.67 0.00 -1.26 -2.48 121.76 124.27 1lud s ALA 6 Ca 0.03 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1lud s ALA 6 Cb -0.04 -2.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 1lud s ALA 6 CO -0.00 0.17 -0.09 1.14 0.00 0.00 0.00 175.76 176.98 1lud s GLN 7 N 0.22 0.96 0.00 0.00 -2.07 0.18 -4.55 119.66 114.39 1lud s GLN 7 Ca 0.16 -1.36 0.00 0.00 -1.82 0.00 0.00 55.36 52.34 1lud s GLN 7 Cb -0.13 -0.49 0.00 0.00 -1.09 0.00 0.00 33.01 31.30 1lud s GLN 7 CO 0.04 0.05 0.00 -0.40 -1.32 0.00 0.00 175.29 173.66 1lud n ASP 8 N -0.01 0.00 -0.21 12.60 5.75 -1.23 -1.41 116.55 132.05 1lud n ASP 8 Ca -0.12 -0.66 -0.05 0.00 -0.01 0.00 0.00 54.79 53.95 1lud n ASP 8 Cb 0.60 0.00 0.05 0.00 -1.03 0.00 0.00 41.12 40.75 1lud n ASP 8 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1lud h ARG 9 N 0.00 0.71 0.00 0.11 -0.00 -1.53 -1.83 114.38 111.84 1lud h ARG 9 Ca 0.00 -0.04 -0.08 0.00 -0.00 0.00 0.00 59.98 59.86 1lud h ARG 9 Cb 0.00 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.97 29.80 1lud h ARG 9 CO 0.00 0.47 -0.38 -0.44 -0.00 0.00 0.00 179.97 179.62 1lud h ASP 10 N 0.74 0.00 0.00 0.08 3.32 -1.91 -3.47 116.42 115.18 1lud h ASP 10 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1lud h ASP 10 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1lud h ASP 10 CO -0.10 0.38 0.00 0.61 -1.72 0.00 0.00 179.24 178.41 1lud n GLY 11 N 0.17 0.99 3.89 2.75 0.00 -0.69 -5.03 105.19 107.26 1lud n GLY 11 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 3.27 0.00 0.99 2.96 -1.26 -2.86 118.68 121.78 1lud s LEU 12 Ca 0.00 1.15 0.00 0.00 -0.22 0.00 0.00 54.13 55.06 1lud s LEU 12 Cb 0.00 -4.10 0.00 0.00 0.50 0.00 0.00 46.19 42.59 1lud s LEU 12 CO 0.00 -0.91 0.00 2.30 -1.32 0.00 0.00 176.35 176.42 1lud n ILE 13 N -2.65 0.00 0.00 6.68 -5.35 -1.04 -3.47 119.36 113.53 1lud n ILE 13 Ca 0.05 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 1lud n ILE 13 Cb 0.55 0.63 0.00 0.00 -1.74 0.00 0.00 39.64 39.08 1lud n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lud n GLY 14 N 0.68 4.35 3.09 3.28 0.00 -1.23 -4.85 105.19 110.51 1lud n GLY 14 Ca 0.00 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 1lud n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lud s LYS 15 N -2.72 1.75 -1.60 1.61 2.36 -1.22 -3.51 119.74 116.41 1lud s LYS 15 Ca 0.00 -0.54 0.00 0.00 -2.55 0.00 0.00 55.97 52.88 1lud s LYS 15 Cb 0.00 -1.48 0.00 0.00 -1.05 0.00 0.00 37.83 35.30 1lud s LYS 15 CO 0.00 0.16 0.00 -0.25 1.55 0.00 0.00 175.35 176.81 1lud n ASP 16 N 3.38 -4.87 0.00 1.43 9.92 -1.26 -3.63 116.55 121.52 1lud n ASP 16 Ca -0.20 0.29 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1lud n ASP 16 Cb 0.53 -3.82 0.00 0.00 -0.64 0.00 0.00 41.12 37.19 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 -1.03 2.06 3.75 0.44 0.00 -1.26 -4.97 105.19 104.18 1lud n GLY 17 Ca -0.17 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1lud n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1lud s HIS 18 N 0.00 3.09 0.97 1.61 -3.43 -1.24 -4.92 115.29 111.37 1lud s HIS 18 Ca 0.00 1.14 -0.14 0.00 -0.80 0.00 0.00 55.06 55.26 1lud s HIS 18 Cb 0.00 -3.74 0.01 0.00 -1.43 0.00 0.00 32.58 27.43 1lud s HIS 18 CO 0.00 -2.32 0.18 1.28 -2.00 0.00 0.00 174.74 171.88 1lud n LEU 19 N 2.18 -1.23 0.07 5.38 4.77 -1.26 -3.38 117.00 123.53 1lud n LEU 19 Ca 0.06 0.27 -0.02 0.00 -0.03 0.00 0.00 56.01 56.28 1lud n LEU 19 Cb 0.41 -1.12 -0.07 0.00 -2.33 0.00 0.00 43.42 40.32 1lud n LEU 19 CO 0.60 -3.91 0.05 1.55 -1.33 0.00 0.00 177.39 174.35 1lud h PRO 20 N -1.52 0.00 0.00 3.23 0.14 -1.89 -3.44 132.00 128.51 1lud h PRO 20 Ca -0.44 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.70 1lud h PRO 20 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.43 1lud h PRO 20 CO 0.33 0.59 0.00 -2.67 0.14 0.00 0.00 178.00 176.39 1lud n TRP 21 N -3.16 0.00 -3.39 1.56 2.14 -1.26 -4.93 117.44 108.40 1lud n TRP 21 Ca -0.04 0.00 -0.20 0.00 2.07 0.00 0.00 57.50 59.33 1lud n TRP 21 Cb 0.86 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 31.27 1lud n TRP 21 CO 0.00 0.00 0.00 -1.58 2.07 0.00 0.00 177.69 178.18 1lud s HIS 22 N 1.37 -0.05 -0.32 -2.67 2.46 -1.26 -5.09 115.29 109.72 1lud s HIS 22 Ca 0.00 -0.96 0.03 0.00 0.47 0.00 0.00 55.06 54.61 1lud s HIS 22 Cb 0.00 -0.55 0.09 0.00 -0.13 0.00 0.00 32.58 32.00 1lud s HIS 22 CO 0.00 -0.93 0.03 -1.17 -2.47 0.00 0.00 174.74 170.21 1lud s LEU 23 N 1.45 4.30 0.22 8.88 2.96 -1.26 -4.96 118.68 130.28 1lud s LEU 23 Ca 0.16 -1.99 -0.03 0.00 -0.22 0.00 0.00 54.13 52.04 1lud s LEU 23 Cb -0.17 -1.53 0.20 0.00 0.50 0.00 0.00 46.19 45.19 1lud s LEU 23 CO -0.06 -0.36 1.62 1.55 -1.32 0.00 0.00 176.35 177.78 1lud h PRO 24 N 7.69 0.71 0.00 0.98 0.14 -1.98 -2.67 132.00 136.86 1lud h PRO 24 Ca -0.07 -0.31 -0.05 0.00 0.14 0.00 0.00 66.00 65.72 1lud h PRO 24 Cb 1.02 -0.02 -0.01 0.00 0.14 0.00 0.00 31.00 32.13 1lud h PRO 24 CO 0.51 0.91 -0.22 0.22 0.14 0.00 0.00 178.00 179.55 1lud h ASP 25 N 0.61 0.00 -0.01 1.44 3.58 -1.97 -2.93 116.42 117.13 1lud h ASP 25 Ca 0.08 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 1lud h ASP 25 Cb 0.78 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.84 1lud h ASP 25 CO 0.06 0.22 -0.14 -0.78 -2.88 0.00 0.00 179.24 175.73 1lud h ASP 26 N 0.00 0.14 -0.55 2.28 3.58 -1.90 -2.93 116.42 117.04 1lud h ASP 26 Ca -0.00 -0.73 0.11 0.00 0.42 0.00 0.00 57.03 56.83 1lud h ASP 26 Cb 0.51 -0.04 -0.10 0.00 1.72 0.00 0.00 39.33 41.43 1lud h ASP 26 CO 0.03 0.85 -0.04 -0.07 -2.88 0.00 0.00 179.24 177.13 1lud h LEU 27 N -0.56 -0.32 -1.28 2.28 3.38 -1.35 0.28 115.31 117.75 1lud h LEU 27 Ca -0.01 0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1lud h LEU 27 Cb 0.86 0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.83 1lud h LEU 27 CO 0.03 -0.12 0.51 0.45 0.09 0.00 0.00 178.44 179.40 1lud h HIS 28 N 0.08 0.90 -0.29 1.13 3.86 -1.58 0.39 115.15 119.64 1lud h HIS 28 Ca 0.28 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.46 1lud h HIS 28 Cb 0.43 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 1lud h HIS 28 CO -0.37 0.51 -0.02 -0.92 0.86 0.00 0.00 177.93 177.98 1lud h TYR 29 N 0.92 0.45 -0.17 2.45 3.20 -0.31 -1.42 116.97 122.10 1lud h TYR 29 Ca 0.32 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1lud h TYR 29 Cb 0.11 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1lud h TYR 29 CO -0.00 0.47 0.00 0.35 -1.64 0.00 0.00 178.16 177.34 1lud h PHE 30 N 0.42 0.32 0.65 -3.82 3.57 0.51 -1.35 116.94 117.24 1lud h PHE 30 Ca 0.09 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1lud h PHE 30 Cb 0.31 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 38.98 1lud h PHE 30 CO 0.01 0.51 -0.31 -0.09 -2.23 0.00 0.00 178.31 176.19 1lud h ARG 31 N 0.04 -0.84 -1.06 1.11 2.43 -1.10 -2.23 114.38 112.72 1lud h ARG 31 Ca 0.05 0.06 0.28 0.00 -0.81 0.00 0.00 59.98 59.56 1lud h ARG 31 Cb 0.38 0.19 -0.10 0.00 -0.42 0.00 0.00 29.97 30.02 1lud h ARG 31 CO 0.01 -0.56 0.67 0.00 -1.51 0.00 0.00 179.97 178.58 1lud h ALA 32 N -1.45 2.22 0.00 2.80 0.00 -1.34 0.70 119.26 122.19 1lud h ALA 32 Ca -0.09 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1lud h ALA 32 Cb 0.67 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1lud h ALA 32 CO 0.15 -0.66 0.00 1.96 0.00 0.00 0.00 179.25 180.69 1lud h GLN 33 N 0.38 0.00 0.00 0.00 1.08 -1.09 -3.23 115.11 112.26 1lud h GLN 33 Ca 0.63 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.83 1lud h GLN 33 Cb 1.58 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.01 1lud h GLN 33 CO -0.34 0.00 -0.49 0.25 -0.95 0.00 0.00 178.83 177.30 1lud n THR 34 N -2.73 2.18 -2.77 -0.54 -2.24 0.24 -4.94 114.28 103.48 1lud n THR 34 Ca 0.03 -3.20 -0.42 0.00 -2.27 0.00 0.00 64.05 58.18 1lud n THR 34 Cb 0.37 -0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 1lud n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1lud s VAL 35 N -3.20 4.75 -0.15 2.28 -7.23 -0.72 -3.36 120.40 112.77 1lud s VAL 35 Ca 0.38 1.79 0.00 0.00 -1.81 0.00 0.00 61.98 62.34 1lud s VAL 35 Cb 0.37 -4.22 0.00 0.00 0.56 0.00 0.00 36.38 33.09 1lud s VAL 35 CO -0.07 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1lud n GLY 36 N 3.55 0.51 3.57 2.32 0.00 -1.25 -5.02 105.19 108.87 1lud n GLY 36 Ca 0.09 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.12 1.86 -0.18 1.61 1.02 -1.22 -4.54 119.74 117.18 1lud s LYS 37 Ca 0.00 -2.03 -0.23 0.00 0.02 0.00 0.00 55.97 53.72 1lud s LYS 37 Cb 0.00 -1.51 -0.02 0.00 -0.52 0.00 0.00 37.83 35.79 1lud s LYS 37 CO 0.00 -0.03 0.75 0.42 -0.92 0.00 0.00 175.35 175.57 1lud s ILE 38 N -2.80 4.94 -0.30 2.17 1.01 -1.02 -3.45 121.20 121.75 1lud s ILE 38 Ca 0.34 1.45 -0.08 0.00 0.00 0.00 0.00 60.65 62.36 1lud s ILE 38 Cb 0.08 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1lud s ILE 38 CO 0.17 0.06 0.11 -0.32 0.00 0.00 0.00 174.94 174.96 1lud s MET 39 N 2.08 3.20 -0.29 2.79 1.75 -0.36 0.16 119.30 128.63 1lud s MET 39 Ca 0.34 -0.79 -0.18 0.00 -1.25 0.00 0.00 55.69 53.81 1lud s MET 39 Cb -0.16 -3.46 -0.02 0.00 2.84 0.00 0.00 34.83 34.03 1lud s MET 39 CO 0.11 -0.43 0.52 0.08 -0.65 0.00 0.00 175.02 174.66 1lud s VAL 40 N 1.55 5.04 -0.10 10.11 1.01 0.17 -0.53 120.40 137.65 1lud s VAL 40 Ca 0.04 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.75 1lud s VAL 40 Cb -0.17 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.35 1lud s VAL 40 CO 0.04 -0.02 -0.12 0.68 0.00 0.00 0.00 175.10 175.68 1lud s VAL 41 N 2.37 1.25 0.71 2.92 -7.23 -0.68 -0.20 120.40 119.53 1lud s VAL 41 Ca 0.21 -0.48 -0.16 0.00 -1.81 0.00 0.00 61.98 59.74 1lud s VAL 41 Cb -0.15 -1.18 0.03 0.00 0.56 0.00 0.00 36.38 35.63 1lud s VAL 41 CO 0.11 0.40 1.21 -0.83 -0.31 0.00 0.00 175.10 175.68 1lud s GLY 42 N 1.19 2.42 0.61 2.32 0.00 0.21 -2.07 107.32 112.01 1lud s GLY 42 Ca -0.04 0.92 0.26 0.00 0.00 0.00 0.00 44.72 45.86 1lud s GLY 42 CO -0.03 1.32 1.66 -0.09 0.00 0.00 0.00 173.10 175.96 1lud h ARG 43 N -0.13 0.00 -0.01 2.90 1.12 -1.02 0.10 114.38 117.35 1lud h ARG 43 Ca -0.48 0.00 -0.11 0.00 -1.11 0.00 0.00 59.98 58.27 1lud h ARG 43 Cb 1.30 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.27 1lud h ARG 43 CO 0.50 0.00 -0.44 0.00 -3.11 0.00 0.00 179.97 176.93 1lud h ARG 44 N 0.00 0.32 -0.01 0.20 2.47 -1.88 -2.63 114.38 112.84 1lud h ARG 44 Ca 0.23 -0.33 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 1lud h ARG 44 Cb 1.62 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 30.03 1lud h ARG 44 CO -0.00 1.01 -0.02 1.15 0.56 0.00 0.00 179.97 182.67 1lud h THR 45 N -0.25 1.41 -0.72 2.04 2.02 -1.17 -2.24 112.91 114.00 1lud h THR 45 Ca -0.05 -1.25 0.17 0.00 0.77 0.00 0.00 66.41 66.04 1lud h THR 45 Cb 1.16 2.23 -0.04 0.00 -1.74 0.00 0.00 68.15 69.76 1lud h THR 45 CO 0.09 0.33 0.49 0.22 0.37 0.00 0.00 175.52 177.02 1lud h TYR 46 N -0.47 0.31 0.00 3.16 3.20 -1.35 0.70 116.97 122.52 1lud h TYR 46 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1lud h TYR 46 Cb 0.55 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1lud h TYR 46 CO 0.11 0.11 0.00 0.93 -1.64 0.00 0.00 178.16 177.67 1lud h GLU 47 N 0.26 0.00 0.00 1.82 5.08 -1.33 -3.20 114.58 117.20 1lud h GLU 47 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1lud h GLU 47 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1lud h GLU 47 CO -0.08 0.00 -1.67 0.45 -1.00 0.00 0.00 179.01 176.71 1lud n SER 48 N -2.93 0.28 -4.56 1.42 2.88 0.19 -4.96 113.62 105.93 1lud n SER 48 Ca 0.04 -0.09 -0.40 0.00 -1.33 0.00 0.00 58.87 57.10 1lud n SER 48 Cb 0.50 1.57 0.03 0.00 -0.75 0.00 0.00 64.21 65.56 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 -2.20 0.46 -0.07 0.66 3.72 0.18 -4.89 117.46 115.31 1lud n PHE 49 Ca -0.02 0.51 -0.11 0.00 -0.05 0.00 0.00 57.45 57.78 1lud n PHE 49 Cb 0.53 -2.11 -0.09 0.00 -0.94 0.00 0.00 39.48 36.86 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 0.88 0.00 -4.94 -1.08 0.14 -1.91 -3.44 132.00 121.66 1lud h PRO 50 Ca -0.45 0.00 -0.67 0.00 0.14 0.00 0.00 66.00 65.02 1lud h PRO 50 Cb 1.37 0.00 -0.30 0.00 0.14 0.00 0.00 31.00 32.20 1lud h PRO 50 CO 0.52 0.69 -0.74 0.15 0.14 0.00 0.00 178.00 178.77 1lud s LYS 51 N -2.07 3.03 -0.03 0.86 -0.14 -1.26 -5.09 119.74 115.05 1lud s LYS 51 Ca -0.15 -0.85 0.02 0.00 -1.36 0.00 0.00 55.97 53.63 1lud s LYS 51 Cb -0.01 -2.99 0.01 0.00 -1.68 0.00 0.00 37.83 33.16 1lud s LYS 51 CO 0.48 -0.33 -0.06 1.03 -0.76 0.00 0.00 175.35 175.71 1lud s ARG 52 N 1.38 0.69 0.77 1.68 0.52 -1.26 -4.32 118.95 118.42 1lud s ARG 52 Ca 0.02 -0.17 -0.05 0.00 -0.52 0.00 0.00 55.73 55.02 1lud s ARG 52 Cb -0.16 -0.69 0.14 0.00 0.52 0.00 0.00 34.95 34.76 1lud s ARG 52 CO -0.04 0.03 1.07 -1.25 0.02 0.00 0.00 175.30 175.13 1lud s PRO 53 N 0.41 1.50 0.56 3.54 0.04 -1.26 -5.12 135.00 134.66 1lud s PRO 53 Ca -0.05 -0.84 -0.17 0.00 0.04 0.00 0.00 61.00 59.98 1lud s PRO 53 Cb -0.09 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1lud s PRO 53 CO 0.00 -1.64 1.06 -0.51 0.04 0.00 0.00 177.00 175.95 1lud s LEU 54 N -5.33 3.61 0.07 -3.56 1.43 -1.26 -4.99 118.68 108.66 1lud s LEU 54 Ca 0.67 1.88 -0.30 0.00 -1.03 0.00 0.00 54.13 55.35 1lud s LEU 54 Cb -0.06 -4.54 -0.06 0.00 0.03 0.00 0.00 46.19 41.56 1lud s LEU 54 CO 0.46 -1.07 1.18 -2.16 0.23 0.00 0.00 176.35 174.99 1lud s PRO 55 N -3.77 4.45 -1.64 1.29 0.04 -1.26 -3.57 135.00 130.53 1lud s PRO 55 Ca 0.65 1.76 -0.17 0.00 0.04 0.00 0.00 61.00 63.29 1lud s PRO 55 Cb -0.17 -3.34 0.13 0.00 0.04 0.00 0.00 34.50 31.16 1lud s PRO 55 CO 0.31 -0.22 0.85 0.39 0.04 0.00 0.00 177.00 178.38 1lud n GLU 56 N 3.73 -3.98 -3.76 4.56 1.02 -1.26 -4.94 120.64 116.02 1lud n GLU 56 Ca 0.08 0.45 -0.13 0.00 -0.02 0.00 0.00 57.16 57.54 1lud n GLU 56 Cb 0.46 -5.22 -0.14 0.00 -0.02 0.00 0.00 31.44 26.52 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 -6.82 0.11 -0.16 3.49 0.52 -1.23 -3.83 118.95 111.03 1lud s ARG 57 Ca 0.70 0.36 -0.28 0.00 -0.52 0.00 0.00 55.73 55.99 1lud s ARG 57 Cb -0.37 -0.14 -0.01 0.00 0.52 0.00 0.00 34.95 34.95 1lud s ARG 57 CO 0.89 -0.15 0.95 0.99 0.02 0.00 0.00 175.30 178.01 1lud s THR 58 N 1.05 4.79 -0.01 0.02 2.01 -1.22 -4.56 115.64 117.71 1lud s THR 58 Ca -0.08 1.89 0.07 0.00 0.31 0.00 0.00 61.69 63.88 1lud s THR 58 Cb -0.10 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 68.14 1lud s THR 58 CO -0.05 -0.03 -0.22 0.20 -0.69 0.00 0.00 174.62 173.82 1lud s ASN 59 N 1.15 2.58 -0.04 3.53 0.02 -1.26 -1.23 114.94 119.68 1lud s ASN 59 Ca 0.44 -0.41 0.05 0.00 -1.02 0.00 0.00 52.86 51.92 1lud s ASN 59 Cb -0.17 -0.28 -0.01 0.00 0.02 0.00 0.00 41.25 40.81 1lud s ASN 59 CO 0.13 0.26 -0.19 -0.69 0.02 0.00 0.00 177.10 176.63 1lud s VAL 60 N -0.54 1.60 0.05 1.60 1.01 0.31 -1.77 120.40 122.67 1lud s VAL 60 Ca 0.08 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 1lud s VAL 60 Cb -0.08 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 1lud s VAL 60 CO -0.01 0.46 0.25 -0.69 0.00 0.00 0.00 175.10 175.11 1lud s VAL 61 N -0.08 5.33 -0.18 2.92 1.01 0.12 -1.69 120.40 127.84 1lud s VAL 61 Ca -0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 1lud s VAL 61 Cb -0.12 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1lud s VAL 61 CO 0.02 0.22 -0.15 -0.22 0.00 0.00 0.00 175.10 174.96 1lud s LEU 62 N -2.22 2.40 0.07 3.92 2.96 -0.88 -2.62 118.68 122.31 1lud s LEU 62 Ca 0.33 -0.54 -0.13 0.00 -0.22 0.00 0.00 54.13 53.57 1lud s LEU 62 Cb -0.13 -1.56 0.02 0.00 0.50 0.00 0.00 46.19 45.02 1lud s LEU 62 CO 0.22 0.03 0.30 0.28 -1.32 0.00 0.00 176.35 175.86 1lud s THR 63 N 1.14 0.09 -2.45 3.68 -1.32 -1.12 -0.30 115.64 115.36 1lud s THR 63 Ca 0.01 -0.78 0.23 0.00 -1.21 0.00 0.00 61.69 59.93 1lud s THR 63 Cb -0.14 -1.09 0.42 0.00 -1.51 0.00 0.00 72.50 70.18 1lud s THR 63 CO -0.06 -0.43 1.46 1.41 -2.21 0.00 0.00 174.62 174.79 1lud n HIS 64 N 0.24 0.31 -2.30 9.09 8.25 -1.26 -4.19 115.22 125.35 1lud n HIS 64 Ca -0.17 -0.16 -0.27 0.00 -0.26 0.00 0.00 57.72 56.87 1lud n HIS 64 Cb 0.61 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.76 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 -1.69 2.70 -0.00 -0.41 1.11 -1.26 -5.01 119.66 115.10 1lud s GLN 65 Ca 0.35 -0.05 0.07 0.00 0.01 0.00 0.00 55.36 55.74 1lud s GLN 65 Cb 0.20 -2.23 -0.09 0.00 -1.01 0.00 0.00 33.01 29.89 1lud s GLN 65 CO 0.29 -0.88 0.29 0.39 0.01 0.00 0.00 175.29 175.39 1lud n GLU 66 N -2.71 3.76 -0.70 2.91 4.71 -1.26 -4.53 120.64 122.82 1lud n GLU 66 Ca 0.06 -0.01 0.07 0.00 -0.01 0.00 0.00 57.16 57.27 1lud n GLU 66 Cb 0.58 -0.91 0.33 0.00 -1.01 0.00 0.00 31.44 30.44 1lud n GLU 66 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1lud n ASP 67 N -1.28 4.82 -4.61 1.62 9.92 -1.26 -4.96 116.55 120.80 1lud n ASP 67 Ca 0.01 -3.00 -0.43 0.00 -0.53 0.00 0.00 54.79 50.84 1lud n ASP 67 Cb 0.13 -0.62 -0.03 0.00 -0.64 0.00 0.00 41.12 39.96 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1lud s TYR 68 N -2.82 1.29 -0.35 1.24 5.04 -1.26 -4.93 117.35 115.55 1lud s TYR 68 Ca 0.49 0.47 -0.12 0.00 -2.44 0.00 0.00 57.07 55.47 1lud s TYR 68 Cb 0.38 -3.98 0.00 0.00 0.35 0.00 0.00 41.96 38.72 1lud s TYR 68 CO 0.12 -4.01 0.22 -0.65 -1.34 0.00 0.00 175.55 169.90 1lud s GLN 69 N 6.06 3.19 -0.37 4.97 -1.52 -1.26 -5.00 119.66 125.73 1lud s GLN 69 Ca 0.96 -0.84 0.00 0.00 -1.95 0.00 0.00 55.36 53.53 1lud s GLN 69 Cb -0.32 -3.76 0.14 0.00 -0.22 0.00 0.00 33.01 28.85 1lud s GLN 69 CO 0.35 -0.56 0.21 0.00 -0.25 0.00 0.00 175.29 175.05 1lud s ALA 70 N 1.65 1.14 -0.11 6.09 0.00 -1.26 -5.10 121.76 124.17 1lud s ALA 70 Ca 0.05 -1.98 -0.30 0.00 0.00 0.00 0.00 51.96 49.73 1lud s ALA 70 Cb -0.18 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.25 1lud s ALA 70 CO 0.08 -2.10 1.42 -0.65 0.00 0.00 0.00 175.76 174.51 1lud s GLN 71 N 0.96 4.22 0.00 0.00 -0.21 -1.26 -2.73 119.66 120.64 1lud s GLN 71 Ca 0.18 1.88 0.00 0.00 0.02 0.00 0.00 55.36 57.44 1lud s GLN 71 Cb -0.23 -3.82 0.00 0.00 1.00 0.00 0.00 33.01 29.96 1lud s GLN 71 CO 0.01 -0.74 0.00 0.41 -2.12 0.00 0.00 175.29 172.85 1lud n GLY 72 N 3.80 2.40 3.69 3.09 0.00 -1.26 -5.05 105.19 111.86 1lud n GLY 72 Ca 0.15 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.94 3.33 0.06 4.61 0.00 -1.11 -4.89 121.76 121.82 1lud s ALA 73 Ca 0.00 -0.79 -0.31 0.00 0.00 0.00 0.00 51.96 50.86 1lud s ALA 73 Cb 0.00 -1.54 -0.08 0.00 0.00 0.00 0.00 23.12 21.51 1lud s ALA 73 CO 0.00 0.56 1.57 0.08 0.00 0.00 0.00 175.76 177.97 1lud s VAL 74 N -0.80 3.21 -0.15 0.00 1.01 -0.73 -4.75 120.40 118.19 1lud s VAL 74 Ca 0.12 0.67 -0.02 0.00 0.00 0.00 0.00 61.98 62.75 1lud s VAL 74 Cb -0.12 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 1lud s VAL 74 CO 0.02 0.00 -0.07 -0.69 0.00 0.00 0.00 175.10 174.37 1lud s VAL 75 N 2.44 3.63 0.09 2.92 1.01 -1.26 0.16 120.40 129.38 1lud s VAL 75 Ca 0.71 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 1lud s VAL 75 Cb -0.38 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1lud s VAL 75 CO 0.30 0.51 0.10 0.68 0.00 0.00 0.00 175.10 176.69 1lud s VAL 76 N 0.33 0.16 -0.12 2.92 -7.23 -1.08 -4.96 120.40 110.42 1lud s VAL 76 Ca -0.06 -1.50 0.22 0.00 -1.81 0.00 0.00 61.98 58.82 1lud s VAL 76 Cb -0.15 -1.52 0.45 0.00 0.56 0.00 0.00 36.38 35.72 1lud s VAL 76 CO 0.04 -0.73 1.16 1.41 -0.31 0.00 0.00 175.10 176.67 1lud n HIS 77 N -0.02 0.54 -3.15 2.82 8.25 -1.26 -2.77 115.22 119.64 1lud n HIS 77 Ca -0.13 -1.21 0.05 0.00 -0.26 0.00 0.00 57.72 56.17 1lud n HIS 77 Cb 0.62 -0.20 -0.01 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 -2.78 -0.97 0.53 0.41 2.15 -1.26 -4.90 116.67 109.86 1lud s ASP 78 Ca 0.34 0.43 0.41 0.00 0.43 0.00 0.00 52.55 54.16 1lud s ASP 78 Cb 0.37 1.74 1.60 0.00 -0.30 0.00 0.00 42.92 46.33 1lud s ASP 78 CO -0.11 -0.18 1.68 0.58 -0.17 0.00 0.00 175.17 176.98 1lud h VAL 79 N 5.55 0.20 -0.97 1.11 2.07 -1.99 0.83 116.25 123.06 1lud h VAL 79 Ca -0.14 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1lud h VAL 79 Cb 1.17 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 1lud h VAL 79 CO 0.06 0.01 0.64 0.00 0.02 0.00 0.00 177.57 178.30 1lud h ALA 80 N 1.27 1.28 -0.25 1.67 0.00 -1.99 -1.22 119.26 120.01 1lud h ALA 80 Ca 0.76 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.58 1lud h ALA 80 Cb 2.93 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 20.36 1lud h ALA 80 CO -0.07 0.54 -0.01 0.00 0.00 0.00 0.00 179.25 179.71 1lud h ALA 81 N 1.39 0.33 -0.91 0.00 0.00 0.29 -2.68 119.26 117.68 1lud h ALA 81 Ca 0.38 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1lud h ALA 81 Cb -0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.61 1lud h ALA 81 CO -0.12 0.08 0.58 0.28 0.00 0.00 0.00 179.25 180.07 1lud h VAL 82 N 0.21 1.07 0.00 0.00 2.07 -1.30 0.60 116.25 118.91 1lud h VAL 82 Ca 0.07 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1lud h VAL 82 Cb 0.43 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1lud h VAL 82 CO 0.01 0.19 -0.11 -0.26 0.02 0.00 0.00 177.57 177.43 1lud h PHE 83 N 1.06 0.00 0.00 1.57 0.04 -1.05 -1.35 116.94 117.21 1lud h PHE 83 Ca 0.39 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.16 1lud h PHE 83 Cb 0.15 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.30 1lud h PHE 83 CO -0.02 0.11 -0.02 0.00 -0.60 0.00 0.00 178.31 177.77 1lud h ALA 84 N 1.89 0.99 0.06 2.45 0.00 -0.56 -2.98 119.26 121.11 1lud h ALA 84 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lud h ALA 84 Cb 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1lud h ALA 84 CO 0.01 0.03 -0.03 -0.92 0.00 0.00 0.00 179.25 178.35 1lud h TYR 85 N 0.00 -0.07 -0.97 0.00 3.20 -0.82 -2.63 116.97 115.67 1lud h TYR 85 Ca -0.00 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.99 1lud h TYR 85 Cb 0.94 0.02 -0.09 0.00 1.54 0.00 0.00 36.73 39.15 1lud h TYR 85 CO 0.00 0.37 0.60 0.00 -1.64 0.00 0.00 178.16 177.49 1lud h ALA 86 N -0.51 1.48 0.00 1.82 0.00 -1.63 0.49 119.26 120.92 1lud h ALA 86 Ca -0.01 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1lud h ALA 86 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1lud h ALA 86 CO 0.01 0.17 -0.20 -0.22 0.00 0.00 0.00 179.25 179.01 1lud h LYS 87 N 0.93 0.00 0.00 0.00 3.64 -1.60 -2.63 116.57 116.91 1lud h LYS 87 Ca 0.49 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.66 1lud h LYS 87 Cb 0.52 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 1lud h LYS 87 CO -0.28 0.20 -1.31 1.96 -2.27 0.00 0.00 179.45 177.75 1lud h GLN 88 N 0.00 0.00 -5.40 1.90 4.20 0.19 -3.44 115.11 112.56 1lud h GLN 88 Ca -0.00 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 58.07 1lud h GLN 88 Cb 0.39 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.04 1lud h GLN 88 CO 0.03 0.54 0.07 -1.01 -0.67 0.00 0.00 178.83 177.79 1lud s HIS 89 N -2.77 3.17 -2.15 2.96 3.76 0.83 -4.91 115.29 116.19 1lud s HIS 89 Ca -0.02 0.33 0.24 0.00 -0.15 0.00 0.00 55.06 55.47 1lud s HIS 89 Cb 0.09 -3.03 1.22 0.00 1.11 0.00 0.00 32.58 31.97 1lud s HIS 89 CO 0.81 -0.56 1.82 -0.35 -0.85 0.00 0.00 174.74 175.60 1lud n PRO 90 N 5.90 1.29 0.00 8.40 -0.04 -1.26 -3.62 135.00 145.66 1lud n PRO 90 Ca -0.02 -0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 1lud n PRO 90 Cb 0.49 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.42 0.26 -3.45 3.54 9.92 -1.26 -5.00 116.55 120.15 1lud n ASP 91 Ca 0.18 -1.11 -0.17 0.00 -0.53 0.00 0.00 54.79 53.16 1lud n ASP 91 Cb 0.19 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.56 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1lud s GLN 92 N -0.11 0.25 0.00 -1.24 0.74 -1.24 -4.83 119.66 113.24 1lud s GLN 92 Ca 0.00 0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.49 1lud s GLN 92 Cb 0.00 -0.94 0.00 0.00 1.10 0.00 0.00 33.01 33.17 1lud s GLN 92 CO 0.00 -0.80 0.00 0.39 -0.55 0.00 0.00 175.29 174.33 1lud n GLU 93 N 5.32 1.75 -3.83 1.67 1.02 -1.26 -4.55 120.64 120.76 1lud n GLU 93 Ca -0.04 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.74 1lud n GLU 93 Cb 0.48 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.77 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 3.19 -0.15 -4.62 2.96 -1.26 -2.42 118.68 116.38 1lud s LEU 94 Ca 0.00 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.63 1lud s LEU 94 Cb 0.00 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.86 1lud s LEU 94 CO 0.00 -0.02 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.14 1lud s VAL 95 N 1.53 2.44 0.27 1.68 1.01 0.42 -0.79 120.40 126.95 1lud s VAL 95 Ca 0.06 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 61.01 1lud s VAL 95 Cb -0.15 -2.01 -0.09 0.00 0.00 0.00 0.00 36.38 34.14 1lud s VAL 95 CO 0.00 0.53 0.74 -0.63 0.00 0.00 0.00 175.10 175.74 1lud s ILE 96 N 0.76 4.59 0.00 2.22 -1.09 0.42 0.45 121.20 128.56 1lud s ILE 96 Ca -0.07 1.19 0.00 0.00 -2.23 0.00 0.00 60.65 59.54 1lud s ILE 96 Cb -0.16 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 36.96 1lud s ILE 96 CO 0.00 0.05 0.28 0.00 -1.23 0.00 0.00 174.94 174.04 1lud n ALA 97 N 0.30 1.62 0.00 9.38 0.00 0.72 -2.19 120.51 130.33 1lud n ALA 97 Ca 0.00 -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 0.11 -1.44 0.00 0.00 0.00 -1.15 -4.90 105.19 97.82 1lud n GLY 98 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.69 0.32 -0.02 0.00 -1.26 -0.62 105.19 102.92 1lud n GLY 99 Ca 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.85 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 1.00 -0.83 4.61 0.00 -1.92 -2.35 119.26 117.76 1lud h ALA 100 Ca 0.00 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.83 1lud h ALA 100 Cb 0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.43 1lud h ALA 100 CO 0.00 0.56 0.54 0.37 0.00 0.00 0.00 179.25 180.72 1lud h GLN 101 N 1.09 0.87 0.00 0.00 4.15 -1.95 -1.19 115.11 118.08 1lud h GLN 101 Ca 0.27 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.53 1lud h GLN 101 Cb 0.11 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1lud h GLN 101 CO -0.03 0.58 -0.48 0.82 -1.93 0.00 0.00 178.83 177.78 1lud h ILE 102 N 0.90 0.87 0.00 2.39 1.08 -1.67 -3.06 117.51 118.02 1lud h ILE 102 Ca 0.36 -2.09 -0.04 0.00 -0.39 0.00 0.00 64.86 62.70 1lud h ILE 102 Cb 0.25 2.33 -0.01 0.00 -3.07 0.00 0.00 36.82 36.33 1lud h ILE 102 CO -0.13 0.47 -0.18 -0.26 -0.69 0.00 0.00 178.15 177.36 1lud h PHE 103 N 0.00 0.00 0.01 1.37 0.04 -0.74 -2.86 116.94 114.76 1lud h PHE 103 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1lud h PHE 103 Cb 1.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.44 1lud h PHE 103 CO 0.00 0.18 -0.00 1.15 -0.60 0.00 0.00 178.31 179.04 1lud h THR 104 N 0.00 1.53 0.00 -1.55 2.02 -1.31 -1.04 112.91 112.55 1lud h THR 104 Ca -0.00 -2.05 -0.02 0.00 0.77 0.00 0.00 66.41 65.11 1lud h THR 104 Cb 0.81 2.85 -0.00 0.00 -1.74 0.00 0.00 68.15 70.07 1lud h THR 104 CO 0.02 0.50 -0.08 0.00 0.37 0.00 0.00 175.52 176.33 1lud h ALA 105 N -0.08 1.75 -0.02 6.16 0.00 -1.59 -2.19 119.26 123.29 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 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1lud h ALA 105 CO 0.00 0.10 -0.31 1.19 0.00 0.00 0.00 179.25 180.24 1lud n PHE 106 N -4.27 0.00 -0.27 0.00 3.01 -1.08 -4.44 117.46 110.41 1lud n PHE 106 Ca -0.03 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.48 1lud n PHE 106 Cb 0.16 0.00 0.27 0.00 -0.01 0.00 0.00 39.48 39.91 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 3.12 0.92 -0.36 -1.08 2.10 -0.51 -2.34 116.57 118.42 1lud h LYS 107 Ca 0.00 -0.06 -0.12 0.00 -2.00 0.00 0.00 60.65 58.48 1lud h LYS 107 Cb 0.82 -0.21 -0.01 0.00 -0.90 0.00 0.00 32.23 31.92 1lud h LYS 107 CO 0.00 0.61 -0.26 0.22 -2.00 0.00 0.00 179.45 178.02 1lud h ASP 108 N 0.95 0.75 -3.69 7.07 3.58 -1.78 -3.36 116.42 119.94 1lud h ASP 108 Ca 0.37 -0.28 -0.71 0.00 0.42 0.00 0.00 57.03 56.82 1lud h ASP 108 Cb 0.21 -0.21 -0.34 0.00 1.72 0.00 0.00 39.33 40.71 1lud h ASP 108 CO -0.13 0.97 -0.16 -1.81 -2.88 0.00 0.00 179.24 175.23 1lud s ASP 109 N -6.78 5.81 0.16 2.28 1.01 -0.88 -5.05 116.67 113.21 1lud s ASP 109 Ca -0.09 -3.33 0.09 0.00 0.71 0.00 0.00 52.55 49.93 1lud s ASP 109 Cb 0.13 -1.92 -0.04 0.00 1.01 0.00 0.00 42.92 42.10 1lud s ASP 109 CO 0.83 -0.28 -0.15 -0.69 0.21 0.00 0.00 175.17 175.10 1lud s VAL 110 N -0.78 2.96 0.00 -1.27 1.01 -1.25 -4.76 120.40 116.31 1lud s VAL 110 Ca 0.23 -1.64 0.00 0.00 0.00 0.00 0.00 61.98 60.57 1lud s VAL 110 Cb -0.12 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1lud s VAL 110 CO -0.09 -0.03 0.00 -0.67 0.00 0.00 0.00 175.10 174.31 1lud n ASP 111 N 0.36 3.66 -3.71 3.32 2.03 0.37 -4.78 116.55 117.80 1lud n ASP 111 Ca -0.13 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.07 1lud n ASP 111 Cb 0.54 0.13 -0.12 0.00 -0.72 0.00 0.00 41.12 40.95 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1lud s THR 112 N -1.85 -0.03 -0.14 5.18 2.01 -1.06 -2.15 115.64 117.60 1lud s THR 112 Ca 0.00 0.12 -0.04 0.00 0.31 0.00 0.00 61.69 62.08 1lud s THR 112 Cb 0.00 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 71.99 1lud s THR 112 CO 0.00 0.05 0.01 -0.76 -0.69 0.00 0.00 174.62 173.23 1lud s LEU 113 N 1.30 3.57 -0.41 4.42 1.43 -0.64 -0.35 118.68 128.00 1lud s LEU 113 Ca -0.09 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 1lud s LEU 113 Cb -0.09 -1.86 0.12 0.00 0.03 0.00 0.00 46.19 44.39 1lud s LEU 113 CO -0.10 0.24 0.19 -0.76 0.23 0.00 0.00 176.35 176.15 1lud s LEU 114 N -0.07 3.12 0.00 1.79 1.43 0.30 0.13 118.68 125.39 1lud s LEU 114 Ca 0.04 -2.44 0.04 0.00 -1.03 0.00 0.00 54.13 50.74 1lud s LEU 114 Cb -0.13 -1.17 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 1lud s LEU 114 CO 0.02 -0.30 -0.09 0.54 0.23 0.00 0.00 176.35 176.74 1lud s VAL 115 N 0.57 3.46 -0.22 -1.59 0.11 -0.93 -2.12 120.40 119.68 1lud s VAL 115 Ca 0.15 -0.82 -0.05 0.00 -2.93 0.00 0.00 61.98 58.34 1lud s VAL 115 Cb -0.23 -2.48 -0.02 0.00 -1.53 0.00 0.00 36.38 32.12 1lud s VAL 115 CO -0.06 0.42 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.23 1lud s THR 116 N -0.95 3.74 -0.32 5.04 2.01 -1.03 -1.75 115.64 122.37 1lud s THR 116 Ca 0.16 -0.37 -0.12 0.00 0.31 0.00 0.00 61.69 61.67 1lud s THR 116 Cb -0.11 -2.71 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 1lud s THR 116 CO 0.06 0.41 0.21 -0.13 -0.69 0.00 0.00 174.62 174.47 1lud s ARG 117 N 1.36 3.53 0.51 4.92 0.52 -0.95 0.48 118.95 129.32 1lud s ARG 117 Ca 0.04 -0.61 -0.11 0.00 -0.52 0.00 0.00 55.73 54.54 1lud s ARG 117 Cb -0.15 -3.71 -0.05 0.00 0.52 0.00 0.00 34.95 31.56 1lud s ARG 117 CO -0.00 -0.39 0.90 -0.51 0.02 0.00 0.00 175.30 175.32 1lud s LEU 118 N 1.70 3.56 0.07 2.53 1.02 -0.50 -2.07 118.68 125.00 1lud s LEU 118 Ca 0.06 1.27 0.10 0.00 0.02 0.00 0.00 54.13 55.58 1lud s LEU 118 Cb -0.17 -4.23 -0.19 0.00 0.02 0.00 0.00 46.19 41.62 1lud s LEU 118 CO 0.09 -0.62 1.05 0.00 0.02 0.00 0.00 176.35 176.90 1lud h ALA 119 N 0.48 0.54 -2.36 4.21 0.00 -0.37 -3.05 119.26 118.71 1lud h ALA 119 Ca -0.46 -1.06 -0.45 0.00 0.00 0.00 0.00 54.91 52.93 1lud h ALA 119 Cb 1.19 0.10 0.14 0.00 0.00 0.00 0.00 17.79 19.21 1lud h ALA 119 CO 0.62 1.30 0.35 0.20 0.00 0.00 0.00 179.25 181.72 1lud s GLY 120 N -4.83 1.64 -0.20 0.00 0.00 -1.08 -4.78 107.32 98.06 1lud s GLY 120 Ca -0.01 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 43.93 1lud s GLY 120 CO 0.82 -0.16 -0.09 -0.45 0.00 0.00 0.00 173.10 173.22 1lud s SER 121 N -4.41 3.40 0.27 1.64 0.15 -1.26 -3.35 113.70 110.14 1lud s SER 121 Ca 0.67 -0.91 0.08 0.00 0.70 0.00 0.00 55.95 56.49 1lud s SER 121 Cb -0.10 -1.20 -0.04 0.00 -1.71 0.00 0.00 66.02 62.97 1lud s SER 121 CO 0.52 -0.16 0.15 -0.36 1.20 0.00 0.00 173.24 174.59 1lud s PHE 122 N 1.42 2.97 0.18 3.44 0.40 -1.26 -5.06 117.98 120.06 1lud s PHE 122 Ca -0.02 -0.17 0.08 0.00 -0.60 0.00 0.00 56.93 56.23 1lud s PHE 122 Cb -0.16 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.93 1lud s PHE 122 CO -0.08 0.51 -0.06 -1.83 0.70 0.00 0.00 175.22 174.46 1lud s GLU 123 N -3.81 2.19 0.00 0.44 -1.05 -1.26 -4.91 118.70 110.29 1lud s GLU 123 Ca 0.33 -1.22 0.00 0.00 -0.15 0.00 0.00 54.97 53.93 1lud s GLU 123 Cb -0.07 -2.23 0.00 0.00 -0.44 0.00 0.00 34.13 31.39 1lud s GLU 123 CO 0.24 0.44 0.00 0.41 0.95 0.00 0.00 175.26 177.29 1lud n GLY 124 N -0.07 2.11 0.00 -3.83 0.00 -1.26 -4.88 105.19 97.26 1lud n GLY 124 Ca -0.10 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1lud n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1lud n ASP 125 N 0.00 0.16 -4.23 1.61 -0.08 -1.26 -5.01 116.55 107.74 1lud n ASP 125 Ca 0.00 -0.52 -0.34 0.00 -1.51 0.00 0.00 54.79 52.42 1lud n ASP 125 Cb 0.00 0.24 -0.15 0.00 2.34 0.00 0.00 41.12 43.55 1lud n ASP 125 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1lud s THR 126 N -0.24 2.86 0.17 5.18 2.01 -1.23 -5.07 115.64 119.33 1lud s THR 126 Ca 0.00 -0.75 0.10 0.00 0.31 0.00 0.00 61.69 61.36 1lud s THR 126 Cb 0.00 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1lud s THR 126 CO 0.00 0.41 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.62 1lud s LYS 127 N 1.39 1.73 0.83 4.92 1.02 -1.26 -2.48 119.74 125.88 1lud s LYS 127 Ca 0.04 -1.37 -0.11 0.00 0.02 0.00 0.00 55.97 54.55 1lud s LYS 127 Cb -0.14 -1.99 0.09 0.00 -0.52 0.00 0.00 37.83 35.27 1lud s LYS 127 CO -0.07 0.43 1.14 1.41 -0.92 0.00 0.00 175.35 177.34 1lud s MET 128 N -2.60 1.66 0.85 1.68 1.75 -1.14 -4.86 119.30 116.65 1lud s MET 128 Ca 0.21 1.46 -0.12 0.00 -1.25 0.00 0.00 55.69 55.99 1lud s MET 128 Cb -0.09 -1.81 0.10 0.00 2.84 0.00 0.00 34.83 35.88 1lud s MET 128 CO 0.11 -2.14 1.11 0.96 -0.65 0.00 0.00 175.02 174.42 1lud s ILE 129 N -2.61 2.58 -0.61 10.11 -4.36 -1.26 -4.96 121.20 120.09 1lud s ILE 129 Ca 0.66 0.19 -0.28 0.00 -0.26 0.00 0.00 60.65 60.97 1lud s ILE 129 Cb -0.22 -2.93 0.02 0.00 1.25 0.00 0.00 42.46 40.58 1lud s ILE 129 CO 0.55 -0.25 1.39 -2.16 0.24 0.00 0.00 174.94 174.70 1lud s PRO 130 N -5.20 3.25 0.39 0.37 0.05 -1.26 -5.02 135.00 127.58 1lud s PRO 130 Ca 0.62 0.27 -0.00 0.00 0.05 0.00 0.00 61.00 61.94 1lud s PRO 130 Cb -0.15 -4.14 -0.03 0.00 0.05 0.00 0.00 34.50 30.24 1lud s PRO 130 CO 0.54 -2.02 0.61 -0.51 0.05 0.00 0.00 177.00 175.67 1lud s LEU 131 N 6.07 3.87 -1.15 -3.56 1.43 -1.26 -5.01 118.68 119.07 1lud s LEU 131 Ca 0.48 0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 53.99 1lud s LEU 131 Cb -0.10 -3.34 0.26 0.00 0.03 0.00 0.00 46.19 43.04 1lud s LEU 131 CO 0.22 -0.44 1.64 -3.20 0.23 0.00 0.00 176.35 174.80 1lud n ASN 132 N -1.92 6.05 -0.05 2.29 5.15 -1.26 -4.80 115.26 120.72 1lud n ASN 132 Ca -0.02 -3.32 0.24 0.00 -0.60 0.00 0.00 54.58 50.88 1lud n ASN 132 Cb 0.56 -1.34 0.72 0.00 -0.53 0.00 0.00 39.78 39.20 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 5.48 0.00 0.00 1.20 4.06 -1.95 0.39 115.95 125.13 1lud h TRP 133 Ca 0.28 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.20 1lud h TRP 133 Cb 0.60 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.76 1lud h TRP 133 CO 1.11 0.00 -0.14 -0.44 -3.56 0.00 0.00 178.44 175.41 1lud h ASP 134 N 0.00 0.00 0.41 -3.49 5.19 -2.04 -1.45 116.42 115.04 1lud h ASP 134 Ca 0.32 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.73 1lud h ASP 134 Cb 1.44 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.95 1lud h ASP 134 CO -0.00 0.14 -0.39 0.47 -3.12 0.00 0.00 179.24 176.34 1lud n ASP 135 N -4.07 0.68 -4.62 6.45 9.92 0.14 -4.89 116.55 120.15 1lud n ASP 135 Ca -0.02 -0.48 -0.25 0.00 -0.53 0.00 0.00 54.79 53.51 1lud n ASP 135 Cb 0.22 0.18 -0.09 0.00 -0.64 0.00 0.00 41.12 40.80 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 -2.80 2.54 -0.03 1.24 0.40 -0.54 -3.75 117.98 115.03 1lud s PHE 136 Ca 0.16 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 56.08 1lud s PHE 136 Cb 0.18 -1.45 0.02 0.00 0.51 0.00 0.00 43.02 42.28 1lud s PHE 136 CO 0.62 0.50 -0.04 0.99 0.70 0.00 0.00 175.22 177.99 1lud s THR 137 N -2.51 0.45 -0.16 0.64 2.01 -1.04 -4.90 115.64 110.13 1lud s THR 137 Ca 0.34 -0.12 -0.29 0.00 0.31 0.00 0.00 61.69 61.93 1lud s THR 137 Cb -0.01 -0.46 -0.02 0.00 0.01 0.00 0.00 72.50 72.02 1lud s THR 137 CO 0.19 0.18 1.42 -0.75 -0.69 0.00 0.00 174.62 174.98 1lud s LYS 138 N 0.62 4.11 -0.09 4.92 2.36 -1.26 -1.66 119.74 128.74 1lud s LYS 138 Ca -0.08 1.75 0.20 0.00 -2.55 0.00 0.00 55.97 55.30 1lud s LYS 138 Cb -0.11 -3.88 -0.31 0.00 -1.05 0.00 0.00 37.83 32.49 1lud s LYS 138 CO -0.00 -0.88 0.33 1.33 1.55 0.00 0.00 175.35 177.67 1lud n VAL 139 N 5.66 0.52 -3.80 4.02 0.24 -0.04 -4.96 118.33 119.98 1lud n VAL 139 Ca 0.16 -0.64 -0.13 0.00 -2.04 0.00 0.00 64.34 61.69 1lud n VAL 139 Cb 0.45 -0.17 -0.13 0.00 -1.47 0.00 0.00 33.84 32.51 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 -4.88 -0.14 -0.15 -1.34 0.01 -1.20 -5.04 113.70 100.96 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 0.27 0.04 0.00 0.21 0.00 0.00 66.02 66.65 1lud s SER 140 CO 0.88 -0.08 0.37 -0.44 0.41 0.00 0.00 173.24 174.38 1lud s SER 141 N 0.43 -0.42 -0.04 2.44 0.01 -1.26 -0.73 113.70 114.13 1lud s SER 141 Ca -0.03 0.78 0.02 0.00 1.31 0.00 0.00 55.95 58.03 1lud s SER 141 Cb -0.04 0.73 0.01 0.00 0.21 0.00 0.00 66.02 66.93 1lud s SER 141 CO -0.02 -0.15 -0.10 -0.60 0.41 0.00 0.00 173.24 172.78 1lud s ARG 142 N 0.67 1.21 -0.15 12.44 6.06 -0.87 -4.96 118.95 133.36 1lud s ARG 142 Ca -0.04 -0.31 -0.04 0.00 -2.50 0.00 0.00 55.73 52.84 1lud s ARG 142 Cb -0.05 -1.08 -0.03 0.00 0.06 0.00 0.00 34.95 33.85 1lud s ARG 142 CO -0.04 0.05 -0.03 0.99 -2.50 0.00 0.00 175.30 173.77 1lud s THR 143 N 0.49 3.98 -0.09 4.11 2.01 -1.26 -0.50 115.64 124.37 1lud s THR 143 Ca -0.09 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.60 1lud s THR 143 Cb -0.12 -2.73 0.01 0.00 0.01 0.00 0.00 72.50 69.66 1lud s THR 143 CO 0.02 0.51 -0.15 0.54 -0.69 0.00 0.00 174.62 174.84 1lud s VAL 144 N 0.19 1.41 0.48 3.82 0.11 -0.83 -5.01 120.40 120.56 1lud s VAL 144 Ca -0.01 -0.62 -0.04 0.00 -2.93 0.00 0.00 61.98 58.38 1lud s VAL 144 Cb -0.14 -1.27 -0.02 0.00 -1.53 0.00 0.00 36.38 33.42 1lud s VAL 144 CO 0.03 0.42 0.76 -1.83 -3.33 0.00 0.00 175.10 171.14 1lud s GLU 145 N 0.76 3.34 0.05 1.54 -1.05 -1.26 -2.88 118.70 119.19 1lud s GLU 145 Ca -0.12 -0.01 -0.01 0.00 -0.15 0.00 0.00 54.97 54.68 1lud s GLU 145 Cb -0.16 -2.42 -0.04 0.00 -0.44 0.00 0.00 34.13 31.08 1lud s GLU 145 CO 0.02 -0.26 -0.02 0.34 0.95 0.00 0.00 175.26 176.29 1lud s ASP 146 N -4.15 0.44 0.56 0.83 2.15 -1.26 -4.96 116.67 110.28 1lud s ASP 146 Ca 0.48 -0.92 0.24 0.00 0.43 0.00 0.00 52.55 52.78 1lud s ASP 146 Cb -0.10 0.19 1.59 0.00 -0.30 0.00 0.00 42.92 44.30 1lud s ASP 146 CO 0.43 -0.56 2.20 0.71 -0.17 0.00 0.00 175.17 177.78 1lud h THR 147 N 3.36 0.71 -3.57 1.71 1.35 -1.99 -3.39 112.91 111.09 1lud h THR 147 Ca -0.34 0.00 -0.62 0.00 -0.55 0.00 0.00 66.41 64.91 1lud h THR 147 Cb 1.15 0.98 -0.13 0.00 -1.73 0.00 0.00 68.15 68.43 1lud h THR 147 CO 0.62 0.00 -0.02 0.21 -0.25 0.00 0.00 175.52 176.08 1lud s ASN 148 N -6.48 6.44 0.24 5.36 3.84 -1.26 -4.96 114.94 118.13 1lud s ASN 148 Ca -0.05 0.54 -0.06 0.00 0.21 0.00 0.00 52.86 53.50 1lud s ASN 148 Cb 0.16 -2.28 0.45 0.00 -0.55 0.00 0.00 41.25 39.02 1lud s ASN 148 CO 0.60 -0.27 1.67 -0.65 -2.79 0.00 0.00 177.10 175.66 1lud h PRO 149 N 7.96 0.21 0.00 0.43 0.10 -2.00 -1.01 132.00 137.70 1lud h PRO 149 Ca -0.29 -0.01 -0.16 0.00 0.10 0.00 0.00 66.00 65.63 1lud h PRO 149 Cb 1.14 -0.05 -0.02 0.00 0.10 0.00 0.00 31.00 32.17 1lud h PRO 149 CO 0.72 0.14 -0.77 0.00 0.10 0.00 0.00 178.00 178.19 1lud h ALA 150 N 1.62 0.56 0.00 -0.75 0.00 -1.93 -3.16 119.26 115.60 1lud h ALA 150 Ca 0.41 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1lud h ALA 150 Cb 0.70 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1lud h ALA 150 CO -0.54 0.97 0.00 1.28 0.00 0.00 0.00 179.25 180.96 1lud n LEU 151 N -3.38 0.00 -4.77 0.00 4.77 -0.40 -2.63 117.00 110.60 1lud n LEU 151 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.61 1lud n LEU 151 Cb 0.82 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.90 1lud n LEU 151 CO 0.44 0.00 0.84 -0.89 -1.33 0.00 0.00 177.39 176.45 1lud s THR 152 N -2.00 3.07 0.15 -5.08 2.01 -1.10 -4.68 115.64 108.01 1lud s THR 152 Ca 0.34 0.84 -0.25 0.00 0.31 0.00 0.00 61.69 62.93 1lud s THR 152 Cb 0.15 -3.44 0.06 0.00 0.01 0.00 0.00 72.50 69.28 1lud s THR 152 CO 0.26 0.03 0.93 -1.38 -0.69 0.00 0.00 174.62 173.77 1lud s HIS 153 N -1.48 -0.15 0.10 4.92 -3.43 -1.14 0.17 115.29 114.28 1lud s HIS 153 Ca 0.61 -0.15 0.04 0.00 -0.80 0.00 0.00 55.06 54.76 1lud s HIS 153 Cb -0.30 0.64 -0.04 0.00 -1.43 0.00 0.00 32.58 31.45 1lud s HIS 153 CO 0.37 -0.84 -0.10 0.99 -2.00 0.00 0.00 174.74 173.16 1lud s THR 154 N -3.33 0.94 -0.20 -5.38 2.01 -0.88 -1.97 115.64 106.83 1lud s THR 154 Ca 0.12 -1.68 -0.05 0.00 0.31 0.00 0.00 61.69 60.39 1lud s THR 154 Cb -0.02 -1.40 -0.02 0.00 0.01 0.00 0.00 72.50 71.07 1lud s THR 154 CO 0.02 -0.59 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.04 1lud s TYR 155 N -2.56 3.03 -0.18 4.92 2.02 0.34 -2.24 117.35 122.69 1lud s TYR 155 Ca 0.06 -0.48 -0.01 0.00 -0.37 0.00 0.00 57.07 56.28 1lud s TYR 155 Cb -0.02 -2.07 0.00 0.00 -0.40 0.00 0.00 41.96 39.47 1lud s TYR 155 CO -0.00 -0.24 -0.13 -1.21 -1.57 0.00 0.00 175.55 172.39 1lud s GLU 156 N 0.97 3.21 -0.19 -0.62 2.02 -0.72 -2.06 118.70 121.32 1lud s GLU 156 Ca 0.01 -0.73 -0.04 0.00 0.02 0.00 0.00 54.97 54.23 1lud s GLU 156 Cb -0.14 -2.71 -0.02 0.00 0.10 0.00 0.00 34.13 31.35 1lud s GLU 156 CO 0.02 -0.09 -0.03 0.08 0.02 0.00 0.00 175.26 175.25 1lud s VAL 157 N 1.10 3.69 0.30 2.63 1.01 0.10 -2.19 120.40 127.04 1lud s VAL 157 Ca 0.00 -0.41 0.10 0.00 0.00 0.00 0.00 61.98 61.67 1lud s VAL 157 Cb -0.14 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1lud s VAL 157 CO -0.04 0.45 -0.05 0.26 0.00 0.00 0.00 175.10 175.72 1lud s TRP 158 N 0.88 2.52 0.00 5.22 0.52 0.12 -0.86 118.94 127.35 1lud s TRP 158 Ca -0.00 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.79 1lud s TRP 158 Cb -0.15 -1.25 -0.01 0.00 -1.15 0.00 0.00 33.47 30.92 1lud s TRP 158 CO 0.01 0.59 -0.04 -0.65 0.02 0.00 0.00 176.95 176.89 1lud s GLN 159 N -3.64 0.33 0.04 4.98 -1.52 -0.66 -1.63 119.66 117.55 1lud s GLN 159 Ca 0.32 -0.22 -0.30 0.00 -1.95 0.00 0.00 55.36 53.21 1lud s GLN 159 Cb -0.03 -0.27 -0.05 0.00 -0.22 0.00 0.00 33.01 32.44 1lud s GLN 159 CO 0.18 0.07 1.11 0.21 -0.25 0.00 0.00 175.29 176.61 1lud s LYS 160 N -0.31 4.49 0.60 2.91 2.36 -0.91 -2.51 119.74 126.36 1lud s LYS 160 Ca -0.01 1.63 -0.07 0.00 -2.55 0.00 0.00 55.97 54.97 1lud s LYS 160 Cb -0.03 -3.39 -0.00 0.00 -1.05 0.00 0.00 37.83 33.36 1lud s LYS 160 CO -0.00 -0.16 0.93 0.15 1.55 0.00 0.00 175.35 177.82 1lud s LYS 161 N 1.00 3.10 0.00 4.03 -0.14 -1.25 -5.01 119.74 121.48 1lud s LYS 161 Ca 0.56 0.21 0.27 0.00 -1.36 0.00 0.00 55.97 55.65 1lud s LYS 161 Cb -0.26 -2.22 0.75 0.00 -1.68 0.00 0.00 37.83 34.42 1lud s LYS 161 CO 0.29 -0.66 1.57 0.00 -0.76 0.00 0.00 175.35 175.79