#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 1.60 -0.16 2.41 0.00 0.43 0.16 121.76 126.20 1lud s ALA 2 Ca 0.00 -1.29 -0.06 0.00 0.00 0.00 0.00 51.96 50.61 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 0.18 0.05 -0.06 0.00 0.00 0.00 175.76 175.93 1lud s PHE 3 N -1.85 3.25 -0.46 0.00 0.40 -0.03 0.17 117.98 119.46 1lud s PHE 3 Ca 0.08 0.10 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 1lud s PHE 3 Cb -0.07 -2.02 0.15 0.00 0.51 0.00 0.00 43.02 41.59 1lud s PHE 3 CO 0.04 0.23 0.29 -1.17 0.70 0.00 0.00 175.22 175.31 1lud s LEU 4 N 0.08 2.65 0.01 -0.37 2.96 -0.91 0.14 118.68 123.24 1lud s LEU 4 Ca 0.05 -2.82 0.02 0.00 -0.22 0.00 0.00 54.13 51.16 1lud s LEU 4 Cb -0.12 -0.98 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 1lud s LEU 4 CO 0.01 -0.23 -0.08 -1.66 -1.32 0.00 0.00 176.35 173.07 1lud s TRP 5 N 0.12 0.68 -0.24 5.38 -2.14 -0.78 -4.67 118.94 117.29 1lud s TRP 5 Ca 0.21 -0.24 -0.11 0.00 2.66 0.00 0.00 56.10 58.62 1lud s TRP 5 Cb -0.17 -0.42 -0.05 0.00 -3.10 0.00 0.00 33.47 29.72 1lud s TRP 5 CO -0.05 -0.02 0.18 0.00 -2.66 0.00 0.00 176.95 174.40 1lud s ALA 6 N -0.56 3.60 0.21 2.67 0.00 -1.26 -2.11 121.76 124.31 1lud s ALA 6 Ca -0.01 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.16 1lud s ALA 6 Cb -0.05 -2.36 -0.05 0.00 0.00 0.00 0.00 23.12 20.66 1lud s ALA 6 CO 0.00 -0.24 -0.17 1.14 0.00 0.00 0.00 175.76 176.49 1lud s GLN 7 N 1.15 1.40 0.00 0.00 -2.07 0.12 -4.62 119.66 115.63 1lud s GLN 7 Ca 0.08 -1.57 0.00 0.00 -1.82 0.00 0.00 55.36 52.05 1lud s GLN 7 Cb -0.14 -1.36 0.00 0.00 -1.09 0.00 0.00 33.01 30.42 1lud s GLN 7 CO 0.05 0.25 0.00 -0.40 -1.32 0.00 0.00 175.29 173.88 1lud n ASP 8 N -0.19 0.00 -0.31 12.60 5.75 -1.23 -0.81 116.55 132.37 1lud n ASP 8 Ca -0.09 -0.98 -0.01 0.00 -0.01 0.00 0.00 54.79 53.69 1lud n ASP 8 Cb 0.59 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.79 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 1.03 -0.02 0.11 -0.00 -1.37 -1.60 114.38 112.54 1lud h ARG 9 Ca 0.00 -0.06 -0.12 0.00 -0.00 0.00 0.00 59.98 59.80 1lud h ARG 9 Cb 0.00 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.97 29.72 1lud h ARG 9 CO 0.00 0.68 -0.55 -0.44 -0.00 0.00 0.00 179.97 179.66 1lud h ASP 10 N 1.06 0.06 0.00 0.08 3.32 -1.89 -3.47 116.42 115.58 1lud h ASP 10 Ca 0.34 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1lud h ASP 10 Cb 0.02 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1lud h ASP 10 CO -0.12 0.60 0.00 0.61 -1.72 0.00 0.00 179.24 178.61 1lud n GLY 11 N 0.07 1.07 3.91 2.75 0.00 -0.60 -5.06 105.19 107.32 1lud n GLY 11 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1lud n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lud s LEU 12 N 0.00 3.28 0.00 0.99 2.96 -1.26 -3.02 118.68 121.64 1lud s LEU 12 Ca 0.00 0.80 0.00 0.00 -0.22 0.00 0.00 54.13 54.71 1lud s LEU 12 Cb 0.00 -3.66 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1lud s LEU 12 CO 0.00 -0.99 0.00 2.30 -1.32 0.00 0.00 176.35 176.34 1lud n ILE 13 N -2.56 0.00 0.00 6.68 -5.35 -1.16 -3.47 119.36 113.51 1lud n ILE 13 Ca 0.04 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 1lud n ILE 13 Cb 0.57 0.78 0.00 0.00 -1.74 0.00 0.00 39.64 39.25 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 0.50 4.25 3.09 3.28 0.00 -1.23 -4.92 105.19 110.15 1lud n GLY 14 Ca 0.00 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.97 1.34 -1.23 1.61 2.20 -1.18 -3.57 119.74 115.93 1lud s LYS 15 Ca 0.00 -0.49 -0.03 0.00 -0.36 0.00 0.00 55.97 55.09 1lud s LYS 15 Cb 0.00 -1.23 -0.01 0.00 -1.51 0.00 0.00 37.83 35.08 1lud s LYS 15 CO 0.00 0.23 0.80 -0.25 -0.36 0.00 0.00 175.35 175.77 1lud n ASP 16 N 3.06 -2.42 0.00 1.43 9.92 -1.26 -3.82 116.55 123.46 1lud n ASP 16 Ca -0.17 -0.78 0.00 0.00 -0.53 0.00 0.00 54.79 53.31 1lud n ASP 16 Cb 0.54 -4.38 0.00 0.00 -0.64 0.00 0.00 41.12 36.64 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 -1.44 2.24 0.00 0.44 0.00 -1.26 -4.88 105.19 100.29 1lud n GLY 17 Ca -0.25 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.36 -4.15 1.61 1.44 -1.25 -4.98 115.22 106.54 1lud n HIS 18 Ca 0.00 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.48 1lud n HIS 18 Cb 0.00 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.04 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 3.21 0.04 2.39 1.43 -1.26 -3.11 118.68 121.38 1lud s LEU 19 Ca 0.00 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1lud s LEU 19 Cb 0.00 -1.66 -0.26 0.00 0.03 0.00 0.00 46.19 44.30 1lud s LEU 19 CO 0.00 -0.29 1.00 1.55 0.23 0.00 0.00 176.35 178.84 1lud h PRO 20 N 1.60 0.18 0.00 1.29 0.14 -1.89 -3.45 132.00 129.87 1lud h PRO 20 Ca -0.44 -0.30 0.00 0.00 0.14 0.00 0.00 66.00 65.40 1lud h PRO 20 Cb 1.25 0.11 0.00 0.00 0.14 0.00 0.00 31.00 32.51 1lud h PRO 20 CO 0.64 1.06 0.00 -2.67 0.14 0.00 0.00 178.00 177.17 1lud n TRP 21 N -3.41 0.00 -3.27 1.56 2.14 -1.26 -4.99 117.44 108.21 1lud n TRP 21 Ca -0.11 0.00 -0.06 0.00 2.07 0.00 0.00 57.50 59.40 1lud n TRP 21 Cb 1.02 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 31.48 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 1.61 -1.17 -0.26 -2.67 2.46 -1.26 -5.11 115.29 108.89 1lud s HIS 22 Ca 0.00 0.21 -0.00 0.00 0.47 0.00 0.00 55.06 55.74 1lud s HIS 22 Cb 0.00 -0.02 0.07 0.00 -0.13 0.00 0.00 32.58 32.50 1lud s HIS 22 CO 0.00 -1.04 0.01 -1.17 -2.47 0.00 0.00 174.74 170.07 1lud s LEU 23 N 2.22 2.44 0.21 8.88 2.96 -1.26 -4.98 118.68 129.16 1lud s LEU 23 Ca 0.12 -1.33 -0.04 0.00 -0.22 0.00 0.00 54.13 52.66 1lud s LEU 23 Cb -0.11 -1.03 0.17 0.00 0.50 0.00 0.00 46.19 45.72 1lud s LEU 23 CO -0.19 -0.31 1.59 1.55 -1.32 0.00 0.00 176.35 177.67 1lud h PRO 24 N 8.01 0.71 0.00 0.98 0.14 -1.99 -2.73 132.00 137.12 1lud h PRO 24 Ca -0.15 -0.33 -0.02 0.00 0.14 0.00 0.00 66.00 65.65 1lud h PRO 24 Cb 1.06 -0.01 -0.00 0.00 0.14 0.00 0.00 31.00 32.19 1lud h PRO 24 CO 0.42 0.93 -0.08 0.22 0.14 0.00 0.00 178.00 179.63 1lud h ASP 25 N 0.60 0.00 0.07 1.44 3.58 -1.97 -2.35 116.42 117.80 1lud h ASP 25 Ca 0.07 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.34 1lud h ASP 25 Cb 0.84 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.91 1lud h ASP 25 CO 0.07 0.08 -0.73 -0.78 -2.88 0.00 0.00 179.24 175.01 1lud h ASP 26 N 0.00 0.51 -0.92 2.28 3.58 -1.89 -2.96 116.42 117.02 1lud h ASP 26 Ca -0.00 -0.86 0.14 0.00 0.42 0.00 0.00 57.03 56.74 1lud h ASP 26 Cb 0.16 -0.16 -0.09 0.00 1.72 0.00 0.00 39.33 40.96 1lud h ASP 26 CO 0.01 1.32 0.53 -0.07 -2.88 0.00 0.00 179.24 178.15 1lud h LEU 27 N -0.22 0.70 -0.90 2.28 3.38 -1.24 0.30 115.31 119.61 1lud h LEU 27 Ca -0.11 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1lud h LEU 27 Cb 1.50 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.16 1lud h LEU 27 CO 0.14 0.32 0.29 0.45 0.09 0.00 0.00 178.44 179.72 1lud h HIS 28 N 0.76 1.11 -0.26 1.13 3.86 -1.47 -0.93 115.15 119.34 1lud h HIS 28 Ca 0.49 -0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.58 1lud h HIS 28 Cb 0.64 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 1lud h HIS 28 CO -0.05 0.84 0.00 -0.92 0.86 0.00 0.00 177.93 178.67 1lud h TYR 29 N 1.06 0.40 0.01 2.45 3.20 -0.32 0.14 116.97 123.90 1lud h TYR 29 Ca 0.24 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 1lud h TYR 29 Cb 0.21 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.36 1lud h TYR 29 CO 0.02 0.41 -0.00 0.35 -1.64 0.00 0.00 178.16 177.29 1lud h PHE 30 N 0.38 -0.01 -0.63 -3.82 3.57 0.09 0.52 116.94 117.04 1lud h PHE 30 Ca 0.09 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 1lud h PHE 30 Cb 0.26 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 1lud h PHE 30 CO 0.01 0.51 0.12 -0.09 -2.23 0.00 0.00 178.31 176.63 1lud h ARG 31 N -0.54 1.02 -0.33 1.11 2.43 -0.97 -2.37 114.38 114.73 1lud h ARG 31 Ca -0.00 -0.25 -0.16 0.00 -0.81 0.00 0.00 59.98 58.75 1lud h ARG 31 Cb 0.53 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1lud h ARG 31 CO 0.00 0.93 -0.43 0.00 -1.51 0.00 0.00 179.97 178.96 1lud h ALA 32 N 1.15 0.50 0.00 2.80 0.00 -0.75 -2.84 119.26 120.12 1lud h ALA 32 Ca 0.20 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1lud h ALA 32 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1lud h ALA 32 CO 0.01 0.63 0.00 1.04 0.00 0.00 0.00 179.25 180.93 1lud n GLN 33 N -4.08 0.15 -0.60 0.00 1.13 0.17 -2.71 117.38 111.45 1lud n GLN 33 Ca -0.03 0.40 0.05 0.00 -1.94 0.00 0.00 57.00 55.48 1lud n GLN 33 Cb 0.57 -1.80 0.21 0.00 0.11 0.00 0.00 30.24 29.32 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 -2.09 2.23 -2.58 5.09 -2.24 -0.91 -4.93 114.28 108.85 1lud n THR 34 Ca 0.02 -3.15 -0.43 0.00 -2.27 0.00 0.00 64.05 58.22 1lud n THR 34 Cb 0.20 -0.25 -0.02 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 -3.22 4.39 -0.24 2.28 -7.23 -1.10 -3.28 120.40 111.99 1lud s VAL 35 Ca 0.38 1.58 0.00 0.00 -1.81 0.00 0.00 61.98 62.13 1lud s VAL 35 Cb 0.37 -4.37 0.00 0.00 0.56 0.00 0.00 36.38 32.94 1lud s VAL 35 CO -0.06 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 174.81 1lud n GLY 36 N 4.07 0.57 3.56 2.32 0.00 -1.26 -5.02 105.19 109.43 1lud n GLY 36 Ca 0.13 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.48 1.85 -0.22 1.61 1.02 -1.20 -4.44 119.74 116.87 1lud s LYS 37 Ca 0.00 -2.03 -0.27 0.00 0.02 0.00 0.00 55.97 53.69 1lud s LYS 37 Cb 0.00 -1.46 0.00 0.00 -0.52 0.00 0.00 37.83 35.85 1lud s LYS 37 CO 0.00 -0.05 0.94 0.42 -0.92 0.00 0.00 175.35 175.74 1lud s ILE 38 N -2.83 4.76 -0.39 2.17 1.01 -1.03 -3.77 121.20 121.13 1lud s ILE 38 Ca 0.35 1.83 -0.12 0.00 0.00 0.00 0.00 60.65 62.70 1lud s ILE 38 Cb 0.08 -4.22 0.03 0.00 0.01 0.00 0.00 42.46 38.35 1lud s ILE 38 CO 0.17 -0.11 0.24 -0.32 0.00 0.00 0.00 174.94 174.93 1lud s MET 39 N 2.87 2.87 -0.30 2.79 1.75 -0.81 0.14 119.30 128.59 1lud s MET 39 Ca 0.41 -1.07 -0.19 0.00 -1.25 0.00 0.00 55.69 53.59 1lud s MET 39 Cb -0.16 -3.82 -0.01 0.00 2.84 0.00 0.00 34.83 33.68 1lud s MET 39 CO 0.08 -0.72 0.58 0.08 -0.65 0.00 0.00 175.02 174.39 1lud s VAL 40 N 1.60 4.98 -0.04 10.11 1.01 0.57 0.41 120.40 139.03 1lud s VAL 40 Ca 0.03 0.76 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1lud s VAL 40 Cb -0.19 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.25 1lud s VAL 40 CO 0.08 -0.11 -0.08 0.68 0.00 0.00 0.00 175.10 175.67 1lud s VAL 41 N 2.50 0.76 0.63 2.92 -7.23 -0.51 -0.15 120.40 119.33 1lud s VAL 41 Ca 0.23 -0.28 -0.18 0.00 -1.81 0.00 0.00 61.98 59.93 1lud s VAL 41 Cb -0.15 -0.72 -0.02 0.00 0.56 0.00 0.00 36.38 36.05 1lud s VAL 41 CO 0.12 0.26 1.25 -0.83 -0.31 0.00 0.00 175.10 175.59 1lud s GLY 42 N 0.62 2.77 0.67 2.32 0.00 -0.10 -1.67 107.32 111.92 1lud s GLY 42 Ca -0.10 1.10 0.27 0.00 0.00 0.00 0.00 44.72 45.99 1lud s GLY 42 CO 0.01 1.51 1.82 -0.09 0.00 0.00 0.00 173.10 176.36 1lud h ARG 43 N 0.61 0.00 0.09 2.90 1.12 -1.05 -1.02 114.38 117.04 1lud h ARG 43 Ca -0.50 0.00 -0.13 0.00 -1.11 0.00 0.00 59.98 58.23 1lud h ARG 43 Cb 1.32 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.29 1lud h ARG 43 CO 0.54 0.00 -0.59 0.00 -3.11 0.00 0.00 179.97 176.81 1lud h ARG 44 N 0.00 0.20 -0.06 0.20 2.47 -1.88 -2.71 114.38 112.60 1lud h ARG 44 Ca 0.00 -0.34 -0.02 0.00 -1.26 0.00 0.00 59.98 58.36 1lud h ARG 44 Cb 0.81 0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1lud h ARG 44 CO -0.00 1.16 -0.06 1.15 0.56 0.00 0.00 179.97 182.78 1lud h THR 45 N -0.58 1.37 -0.98 2.04 2.02 -1.57 -2.02 112.91 113.19 1lud h THR 45 Ca -0.11 -1.20 0.10 0.00 0.77 0.00 0.00 66.41 65.97 1lud h THR 45 Cb 1.44 2.04 -0.08 0.00 -1.74 0.00 0.00 68.15 69.82 1lud h THR 45 CO 0.09 0.33 0.62 0.22 0.37 0.00 0.00 175.52 177.16 1lud h TYR 46 N -0.29 1.11 0.00 3.16 5.03 -1.42 0.59 116.97 125.15 1lud h TYR 46 Ca 0.01 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.35 1lud h TYR 46 Cb 0.56 -0.36 0.00 0.00 1.55 0.00 0.00 36.73 38.49 1lud h TYR 46 CO 0.09 0.48 0.00 0.93 -1.32 0.00 0.00 178.16 178.34 1lud h GLU 47 N 1.00 0.00 0.00 1.82 4.39 -1.37 -2.90 114.58 117.51 1lud h GLU 47 Ca 0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.17 1lud h GLU 47 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1lud h GLU 47 CO -0.22 0.00 -1.86 0.45 -1.16 0.00 0.00 179.01 176.21 1lud n SER 48 N -2.37 0.12 -4.33 1.42 2.88 0.13 -4.98 113.62 106.49 1lud n SER 48 Ca 0.03 -0.01 -0.35 0.00 -1.33 0.00 0.00 58.87 57.21 1lud n SER 48 Cb 0.31 1.81 0.08 0.00 -0.75 0.00 0.00 64.21 65.66 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 -2.26 -2.14 -0.06 0.66 3.01 0.16 -4.96 117.46 111.86 1lud n PHE 49 Ca -0.03 0.23 -0.04 0.00 1.01 0.00 0.00 57.45 58.62 1lud n PHE 49 Cb 0.56 -1.75 -0.03 0.00 -0.01 0.00 0.00 39.48 38.25 1lud n PHE 49 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1lud h PRO 50 N -0.90 0.00 -4.43 -1.08 0.13 -1.91 -3.44 132.00 120.37 1lud h PRO 50 Ca -0.44 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 1lud h PRO 50 Cb 1.32 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.06 1lud h PRO 50 CO 0.35 0.17 -0.68 0.15 -0.23 0.00 0.00 178.00 177.76 1lud s LYS 51 N -1.87 1.63 -0.08 0.86 1.02 -1.26 -5.09 119.74 114.95 1lud s LYS 51 Ca -0.08 -2.01 0.02 0.00 0.02 0.00 0.00 55.97 53.92 1lud s LYS 51 Cb 0.01 -3.27 -0.02 0.00 -0.52 0.00 0.00 37.83 34.02 1lud s LYS 51 CO 0.17 -0.99 -0.13 1.03 -0.92 0.00 0.00 175.35 174.52 1lud s ARG 52 N 0.70 2.86 0.72 1.68 3.00 -1.26 -3.88 118.95 122.77 1lud s ARG 52 Ca 0.12 -0.68 -0.06 0.00 0.00 0.00 0.00 55.73 55.11 1lud s ARG 52 Cb -0.21 -2.49 0.09 0.00 0.00 0.00 0.00 34.95 32.34 1lud s ARG 52 CO -0.06 0.47 1.02 -1.25 0.00 0.00 0.00 175.30 175.48 1lud s PRO 53 N -0.31 1.93 0.57 3.54 0.04 -1.26 -5.12 135.00 134.40 1lud s PRO 53 Ca 0.03 -0.51 -0.18 0.00 0.04 0.00 0.00 61.00 60.38 1lud s PRO 53 Cb -0.13 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 1lud s PRO 53 CO 0.03 -1.37 1.13 -0.51 0.04 0.00 0.00 177.00 176.32 1lud s LEU 54 N -5.25 3.66 -0.11 -3.56 1.43 -1.25 -4.91 118.68 108.68 1lud s LEU 54 Ca 0.63 2.16 -0.29 0.00 -1.03 0.00 0.00 54.13 55.60 1lud s LEU 54 Cb -0.09 -4.58 -0.07 0.00 0.03 0.00 0.00 46.19 41.49 1lud s LEU 54 CO 0.45 -1.36 2.12 -2.84 0.23 0.00 0.00 176.35 174.95 1lud s PRO 55 N -3.47 3.55 -1.29 1.29 0.02 -1.26 -2.96 135.00 130.88 1lud s PRO 55 Ca 0.72 2.28 -0.01 0.00 0.02 0.00 0.00 61.00 64.01 1lud s PRO 55 Cb -0.24 -4.29 -0.00 0.00 0.02 0.00 0.00 34.50 29.99 1lud s PRO 55 CO 0.31 -1.63 0.70 0.39 -0.33 0.00 0.00 177.00 176.44 1lud n GLU 56 N 8.26 -4.66 -3.86 5.54 1.02 -1.26 -4.99 120.64 120.68 1lud n GLU 56 Ca 0.26 0.62 -0.11 0.00 -0.02 0.00 0.00 57.16 57.90 1lud n GLU 56 Cb 0.43 -5.14 -0.10 0.00 -0.02 0.00 0.00 31.44 26.61 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 -5.94 0.48 -0.22 3.49 0.52 -1.15 -4.37 118.95 111.76 1lud s ARG 57 Ca 0.03 -0.33 -0.21 0.00 -0.52 0.00 0.00 55.73 54.70 1lud s ARG 57 Cb -0.01 0.20 -0.02 0.00 0.52 0.00 0.00 34.95 35.64 1lud s ARG 57 CO 0.81 -0.11 0.66 0.99 0.02 0.00 0.00 175.30 177.67 1lud s THR 58 N -1.27 4.98 -0.08 0.02 2.01 -1.25 -4.63 115.64 115.43 1lud s THR 58 Ca -0.13 1.24 0.05 0.00 0.31 0.00 0.00 61.69 63.15 1lud s THR 58 Cb -0.07 -3.97 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 1lud s THR 58 CO 0.02 0.06 -0.23 0.20 -0.69 0.00 0.00 174.62 173.98 1lud s ASN 59 N 1.29 3.26 -0.07 3.53 0.01 -1.26 -1.93 114.94 119.76 1lud s ASN 59 Ca 0.29 -0.48 0.05 0.00 -0.71 0.00 0.00 52.86 52.02 1lud s ASN 59 Cb -0.16 -1.07 -0.01 0.00 0.41 0.00 0.00 41.25 40.42 1lud s ASN 59 CO 0.10 0.22 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.98 1lud s VAL 60 N -0.02 2.00 0.04 1.60 1.01 0.16 -1.79 120.40 123.40 1lud s VAL 60 Ca -0.07 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1lud s VAL 60 Cb -0.15 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1lud s VAL 60 CO 0.05 0.55 0.12 -0.69 0.00 0.00 0.00 175.10 175.13 1lud s VAL 61 N 0.00 4.88 -0.13 2.92 1.01 -0.86 -1.42 120.40 126.80 1lud s VAL 61 Ca -0.08 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1lud s VAL 61 Cb -0.15 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1lud s VAL 61 CO 0.05 0.22 -0.22 -0.76 0.00 0.00 0.00 175.10 174.39 1lud s LEU 62 N -2.16 2.10 0.09 3.92 1.02 -0.67 -2.45 118.68 120.53 1lud s LEU 62 Ca 0.28 -0.59 -0.10 0.00 0.02 0.00 0.00 54.13 53.74 1lud s LEU 62 Cb -0.12 -1.43 0.01 0.00 0.02 0.00 0.00 46.19 44.66 1lud s LEU 62 CO 0.20 0.10 0.23 0.28 0.02 0.00 0.00 176.35 177.19 1lud s THR 63 N 0.69 0.13 -2.48 5.49 -1.32 -1.06 -0.35 115.64 116.73 1lud s THR 63 Ca -0.10 -1.03 0.23 0.00 -1.21 0.00 0.00 61.69 59.58 1lud s THR 63 Cb -0.16 -1.26 0.42 0.00 -1.51 0.00 0.00 72.50 69.99 1lud s THR 63 CO 0.01 -0.57 1.50 1.41 -2.21 0.00 0.00 174.62 174.76 1lud n HIS 64 N -0.02 0.21 -2.28 9.09 8.25 -1.26 -4.22 115.22 124.99 1lud n HIS 64 Ca -0.16 -0.10 -0.25 0.00 -0.26 0.00 0.00 57.72 56.95 1lud n HIS 64 Cb 0.62 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.82 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 -1.79 1.90 -0.00 -0.41 1.11 -1.26 -5.02 119.66 114.19 1lud s GLN 65 Ca 0.34 -0.51 0.01 0.00 0.01 0.00 0.00 55.36 55.21 1lud s GLN 65 Cb 0.20 -2.19 -0.01 0.00 -1.01 0.00 0.00 33.01 30.00 1lud s GLN 65 CO 0.30 -1.40 0.02 0.39 0.01 0.00 0.00 175.29 174.61 1lud n GLU 66 N -2.97 6.32 -0.66 2.91 1.02 -1.26 -4.63 120.64 121.37 1lud n GLU 66 Ca 0.10 -0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.28 1lud n GLU 66 Cb 0.60 -0.56 0.27 0.00 -0.02 0.00 0.00 31.44 31.73 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 -1.05 4.02 -4.64 1.62 -0.08 -1.26 -4.98 116.55 110.18 1lud n ASP 67 Ca 0.00 -3.18 -0.42 0.00 -1.51 0.00 0.00 54.79 49.68 1lud n ASP 67 Cb 0.01 -0.61 -0.03 0.00 2.34 0.00 0.00 41.12 42.83 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 -2.93 1.33 -0.45 -0.67 5.04 -1.26 -4.93 117.35 113.48 1lud s TYR 68 Ca 0.46 0.01 -0.15 0.00 -2.44 0.00 0.00 57.07 54.95 1lud s TYR 68 Cb 0.38 -4.10 0.06 0.00 0.35 0.00 0.00 41.96 38.65 1lud s TYR 68 CO 0.09 -4.75 0.36 -0.65 -1.34 0.00 0.00 175.55 169.26 1lud s GLN 69 N 5.15 2.97 -0.48 4.97 -1.52 -1.26 -4.99 119.66 124.50 1lud s GLN 69 Ca 0.91 -1.24 0.03 0.00 -1.95 0.00 0.00 55.36 53.11 1lud s GLN 69 Cb -0.37 -4.07 0.15 0.00 -0.22 0.00 0.00 33.01 28.50 1lud s GLN 69 CO 0.38 -0.93 0.31 0.00 -0.25 0.00 0.00 175.29 174.80 1lud s ALA 70 N 1.65 2.18 -0.08 6.09 0.00 -1.26 -5.09 121.76 125.24 1lud s ALA 70 Ca 0.04 -2.74 -0.30 0.00 0.00 0.00 0.00 51.96 48.96 1lud s ALA 70 Cb -0.22 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1lud s ALA 70 CO 0.08 -2.05 1.26 -0.65 0.00 0.00 0.00 175.76 174.39 1lud s GLN 71 N -0.02 4.30 0.00 0.00 -0.21 -1.26 -2.92 119.66 119.55 1lud s GLN 71 Ca 0.23 1.72 0.00 0.00 0.02 0.00 0.00 55.36 57.33 1lud s GLN 71 Cb -0.13 -3.64 0.00 0.00 1.00 0.00 0.00 33.01 30.25 1lud s GLN 71 CO -0.08 -0.56 0.00 0.41 -2.12 0.00 0.00 175.29 172.94 1lud n GLY 72 N 3.50 2.67 3.62 3.09 0.00 -1.26 -5.04 105.19 111.77 1lud n GLY 72 Ca 0.12 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.56 3.08 0.76 4.61 0.00 -1.15 -4.86 121.76 122.64 1lud s ALA 73 Ca 0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 1lud s ALA 73 Cb 0.00 -1.28 0.06 0.00 0.00 0.00 0.00 23.12 21.90 1lud s ALA 73 CO 0.00 0.59 1.23 0.08 0.00 0.00 0.00 175.76 177.66 1lud s VAL 74 N -0.88 2.06 -0.03 0.00 1.01 -0.74 -4.74 120.40 117.07 1lud s VAL 74 Ca 0.14 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.15 1lud s VAL 74 Cb -0.11 -2.59 0.03 0.00 0.00 0.00 0.00 36.38 33.71 1lud s VAL 74 CO 0.03 -0.02 0.01 -0.69 0.00 0.00 0.00 175.10 174.44 1lud s VAL 75 N -1.95 0.13 0.06 2.92 1.01 -1.26 -2.02 120.40 119.30 1lud s VAL 75 Ca 0.76 0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.84 1lud s VAL 75 Cb -0.31 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 1lud s VAL 75 CO 0.47 0.15 0.07 0.68 0.00 0.00 0.00 175.10 176.48 1lud s VAL 76 N 1.27 0.18 -0.09 2.92 -7.23 -1.03 -4.98 120.40 111.45 1lud s VAL 76 Ca -0.06 -1.49 0.22 0.00 -1.81 0.00 0.00 61.98 58.84 1lud s VAL 76 Cb -0.13 -1.38 0.44 0.00 0.56 0.00 0.00 36.38 35.87 1lud s VAL 76 CO -0.02 -0.82 1.17 1.41 -0.31 0.00 0.00 175.10 176.52 1lud n HIS 77 N 0.12 0.34 -3.15 2.82 8.25 -1.26 -2.56 115.22 119.78 1lud n HIS 77 Ca -0.15 -1.01 0.05 0.00 -0.26 0.00 0.00 57.72 56.35 1lud n HIS 77 Cb 0.61 -0.19 -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 -0.51 0.64 0.00 0.00 176.34 176.47 1lud s ASP 78 N -2.57 -0.90 0.52 0.41 1.01 -1.26 -4.90 116.67 108.97 1lud s ASP 78 Ca 0.34 0.50 0.43 0.00 0.71 0.00 0.00 52.55 54.53 1lud s ASP 78 Cb 0.38 1.73 1.63 0.00 1.01 0.00 0.00 42.92 47.67 1lud s ASP 78 CO -0.12 -0.17 1.62 0.58 0.21 0.00 0.00 175.17 177.29 1lud h VAL 79 N 5.59 0.09 -0.83 -1.27 2.07 -1.99 0.83 116.25 120.74 1lud h VAL 79 Ca -0.16 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.40 1lud h VAL 79 Cb 1.17 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 1lud h VAL 79 CO 0.06 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.17 1lud h ALA 80 N 1.23 1.11 -0.16 1.67 0.00 -2.00 -1.44 119.26 119.66 1lud h ALA 80 Ca 0.86 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.72 1lud h ALA 80 Cb 3.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 20.78 1lud h ALA 80 CO -0.13 0.30 -0.02 0.00 0.00 0.00 0.00 179.25 179.40 1lud h ALA 81 N 1.37 0.22 -0.86 0.00 0.00 0.28 -2.95 119.26 117.31 1lud h ALA 81 Ca 0.35 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 55.16 1lud h ALA 81 Cb 0.09 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 1lud h ALA 81 CO -0.14 -0.05 0.49 0.28 0.00 0.00 0.00 179.25 179.82 1lud h VAL 82 N 0.02 0.84 -0.83 0.00 2.07 -1.31 0.00 116.25 117.03 1lud h VAL 82 Ca 0.04 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.33 1lud h VAL 82 Cb 0.42 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.16 1lud h VAL 82 CO 0.01 0.14 0.55 -0.26 0.02 0.00 0.00 177.57 178.03 1lud h PHE 83 N 0.75 1.01 0.68 1.57 0.04 -1.13 -2.88 116.94 116.97 1lud h PHE 83 Ca 0.44 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.21 1lud h PHE 83 Cb 0.51 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 1lud h PHE 83 CO -0.06 0.60 -0.43 0.00 -0.60 0.00 0.00 178.31 177.81 1lud h ALA 84 N 1.51 -1.09 -0.63 2.45 0.00 -0.83 -2.19 119.26 118.47 1lud h ALA 84 Ca 0.32 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1lud h ALA 84 Cb -0.01 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 18.21 1lud h ALA 84 CO -0.09 -1.13 -0.44 -0.92 0.00 0.00 0.00 179.25 176.67 1lud h TYR 85 N -1.05 -1.30 -0.53 0.00 3.20 -1.35 0.35 116.97 116.29 1lud h TYR 85 Ca -0.09 0.09 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1lud h TYR 85 Cb 0.85 0.66 -0.07 0.00 1.54 0.00 0.00 36.73 39.71 1lud h TYR 85 CO -0.11 -0.42 0.13 0.00 -1.64 0.00 0.00 178.16 176.12 1lud h ALA 86 N 0.66 0.62 0.00 1.82 0.00 -1.46 0.47 119.26 121.38 1lud h ALA 86 Ca 0.19 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1lud h ALA 86 Cb 0.56 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1lud h ALA 86 CO -0.72 -0.28 -0.12 -0.22 0.00 0.00 0.00 179.25 177.91 1lud h LYS 87 N 0.28 0.00 0.00 0.00 3.64 -0.31 -2.72 116.57 117.46 1lud h LYS 87 Ca 0.27 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 1lud h LYS 87 Cb 0.35 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1lud h LYS 87 CO -0.32 0.12 -1.28 0.94 -2.27 0.00 0.00 179.45 176.63 1lud n GLN 88 N -3.52 0.62 -3.42 1.90 -0.06 0.10 -4.81 117.38 108.19 1lud n GLN 88 Ca -0.01 0.10 -0.39 0.00 -2.00 0.00 0.00 57.00 54.70 1lud n GLN 88 Cb 0.26 -1.78 -0.09 0.00 -4.06 0.00 0.00 30.24 24.57 1lud n GLN 88 CO 0.00 0.00 0.00 -1.01 -0.20 0.00 0.00 177.06 175.85 1lud s HIS 89 N -3.25 3.23 -2.16 3.69 3.76 0.13 -4.93 115.29 115.77 1lud s HIS 89 Ca -0.02 0.23 0.27 0.00 -0.15 0.00 0.00 55.06 55.38 1lud s HIS 89 Cb 0.10 -2.58 1.38 0.00 1.11 0.00 0.00 32.58 32.58 1lud s HIS 89 CO 0.81 -0.29 1.91 -0.35 -0.85 0.00 0.00 174.74 175.98 1lud n PRO 90 N 5.32 1.26 -0.02 8.40 -0.04 -1.26 -3.61 135.00 145.04 1lud n PRO 90 Ca -0.09 -0.38 0.00 0.00 -0.04 0.00 0.00 63.50 62.99 1lud n PRO 90 Cb 0.50 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.50 0.00 -3.42 3.54 9.92 -1.26 -5.00 116.55 119.84 1lud n ASP 91 Ca 0.20 -1.05 -0.18 0.00 -0.53 0.00 0.00 54.79 53.22 1lud n ASP 91 Cb 0.19 -0.01 -0.10 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 0.00 0.31 0.00 -1.24 0.74 -1.24 -4.77 119.66 113.46 1lud s GLN 92 Ca 0.00 -0.17 0.00 0.00 0.05 0.00 0.00 55.36 55.24 1lud s GLN 92 Cb 0.00 -0.72 0.00 0.00 1.10 0.00 0.00 33.01 33.39 1lud s GLN 92 CO 0.00 -1.02 0.00 0.39 -0.55 0.00 0.00 175.29 174.11 1lud n GLU 93 N 5.31 0.99 -3.65 1.67 1.02 -1.26 -4.49 120.64 120.22 1lud n GLU 93 Ca -0.03 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.73 1lud n GLU 93 Cb 0.46 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.76 1lud n GLU 93 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1lud s LEU 94 N 0.00 4.10 -0.14 -4.62 2.96 -1.26 -2.47 118.68 117.26 1lud s LEU 94 Ca 0.00 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1lud s LEU 94 Cb 0.00 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.68 1lud s LEU 94 CO 0.00 -0.18 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.97 1lud s VAL 95 N 1.63 2.40 0.26 1.68 1.01 0.12 -0.43 120.40 127.07 1lud s VAL 95 Ca 0.05 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 1lud s VAL 95 Cb -0.17 -1.98 -0.08 0.00 0.00 0.00 0.00 36.38 34.15 1lud s VAL 95 CO 0.07 0.53 0.63 -0.63 0.00 0.00 0.00 175.10 175.70 1lud s ILE 96 N 0.70 4.81 0.00 2.22 -1.09 0.46 -0.31 121.20 127.99 1lud s ILE 96 Ca -0.09 0.73 0.00 0.00 -2.23 0.00 0.00 60.65 59.06 1lud s ILE 96 Cb -0.16 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.09 1lud s ILE 96 CO 0.01 -0.08 0.25 0.00 -1.23 0.00 0.00 174.94 173.89 1lud n ALA 97 N -0.12 1.35 0.00 9.38 0.00 0.79 -2.15 120.51 129.77 1lud n ALA 97 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.20 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 0.05 -1.84 0.00 0.00 0.00 -1.13 -4.91 105.19 97.35 1lud n GLY 98 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.80 0.28 -0.02 0.00 -1.26 -0.92 105.19 102.47 1lud n GLY 99 Ca 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 46.02 44.87 1lud n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud h ALA 100 N -2.00 1.49 -0.81 4.61 0.00 -1.93 -2.37 119.26 118.25 1lud h ALA 100 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.80 1lud h ALA 100 Cb 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1lud h ALA 100 CO 0.00 0.38 0.52 1.96 0.00 0.00 0.00 179.25 182.11 1lud h GLN 101 N 0.52 0.98 0.00 0.00 4.20 -1.97 -1.72 115.11 117.12 1lud h GLN 101 Ca 0.12 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 1lud h GLN 101 Cb 0.19 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1lud h GLN 101 CO -0.00 0.65 -0.64 0.82 -0.67 0.00 0.00 178.83 178.98 1lud h ILE 102 N 1.01 1.26 0.00 2.54 1.08 -1.66 -2.94 117.51 118.79 1lud h ILE 102 Ca 0.33 -2.35 -0.00 0.00 -0.39 0.00 0.00 64.86 62.45 1lud h ILE 102 Cb 0.02 2.34 -0.00 0.00 -3.07 0.00 0.00 36.82 36.11 1lud h ILE 102 CO -0.12 0.63 -0.00 -0.26 -0.69 0.00 0.00 178.15 177.70 1lud h PHE 103 N 0.00 0.00 0.00 1.37 0.04 -0.95 -2.74 116.94 114.66 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 1.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.44 1lud h PHE 103 CO 0.00 0.00 -0.00 1.15 -0.60 0.00 0.00 178.31 178.86 1lud h THR 104 N 0.00 1.48 0.00 -1.55 2.02 -1.16 -0.82 112.91 112.88 1lud h THR 104 Ca -0.00 -2.10 -0.04 0.00 0.77 0.00 0.00 66.41 65.04 1lud h THR 104 Cb 0.65 2.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.84 1lud h THR 104 CO 0.00 0.50 -0.19 0.00 0.37 0.00 0.00 175.52 176.20 1lud h ALA 105 N -0.18 1.23 0.00 6.16 0.00 -1.59 -3.11 119.26 121.78 1lud h ALA 105 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1lud h ALA 105 Cb 0.82 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1lud h ALA 105 CO 0.00 0.24 -1.64 1.19 0.00 0.00 0.00 179.25 179.04 1lud n PHE 106 N -3.66 0.00 0.01 0.00 3.72 -1.03 -4.44 117.46 112.06 1lud n PHE 106 Ca -0.01 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 1lud n PHE 106 Cb 0.32 -0.33 0.55 0.00 -0.94 0.00 0.00 39.48 39.08 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 0.28 -0.57 -1.08 2.10 -1.06 -1.22 116.57 115.01 1lud h LYS 107 Ca 0.00 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.58 1lud h LYS 107 Cb 0.81 -0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 32.05 1lud h LYS 107 CO 0.00 0.18 0.15 0.22 -2.00 0.00 0.00 179.45 178.01 1lud h ASP 108 N 0.28 0.81 -3.68 7.07 1.82 -1.78 -3.32 116.42 117.63 1lud h ASP 108 Ca 0.20 -0.14 -0.69 0.00 -0.39 0.00 0.00 57.03 56.00 1lud h ASP 108 Cb 0.41 -0.21 -0.36 0.00 0.68 0.00 0.00 39.33 39.85 1lud h ASP 108 CO -0.04 0.78 -0.27 -1.81 -1.61 0.00 0.00 179.24 176.29 1lud s ASP 109 N -6.55 5.51 0.13 2.28 1.01 -0.46 -5.06 116.67 113.53 1lud s ASP 109 Ca -0.10 -3.38 0.08 0.00 0.71 0.00 0.00 52.55 49.86 1lud s ASP 109 Cb 0.16 -1.85 -0.04 0.00 1.01 0.00 0.00 42.92 42.20 1lud s ASP 109 CO 0.81 -0.25 -0.12 -0.69 0.21 0.00 0.00 175.17 175.13 1lud s VAL 110 N -0.83 3.17 0.00 -1.27 1.01 -1.24 -4.60 120.40 116.64 1lud s VAL 110 Ca 0.23 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.74 1lud s VAL 110 Cb -0.13 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1lud s VAL 110 CO -0.09 0.03 0.00 0.47 0.00 0.00 0.00 175.10 175.51 1lud n ASP 111 N 0.50 3.62 -3.72 3.32 8.00 0.41 -4.80 116.55 123.88 1lud n ASP 111 Ca -0.13 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.24 1lud n ASP 111 Cb 0.53 0.21 -0.13 0.00 -0.02 0.00 0.00 41.12 41.71 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lud s THR 112 N -1.80 -0.09 -0.14 -3.53 2.01 -1.10 -2.19 115.64 108.80 1lud s THR 112 Ca 0.00 0.18 -0.03 0.00 0.31 0.00 0.00 61.69 62.14 1lud s THR 112 Cb 0.00 -0.36 -0.03 0.00 0.01 0.00 0.00 72.50 72.13 1lud s THR 112 CO 0.00 0.07 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.21 1lud s LEU 113 N 1.40 3.32 -0.35 4.42 1.43 -0.84 -0.85 118.68 127.21 1lud s LEU 113 Ca -0.08 -0.08 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 1lud s LEU 113 Cb -0.11 -1.79 0.11 0.00 0.03 0.00 0.00 46.19 44.42 1lud s LEU 113 CO -0.08 0.21 0.10 -0.76 0.23 0.00 0.00 176.35 176.05 1lud s LEU 114 N 0.14 3.56 -0.03 1.79 1.43 0.37 0.40 118.68 126.34 1lud s LEU 114 Ca -0.01 -2.08 0.05 0.00 -1.03 0.00 0.00 54.13 51.06 1lud s LEU 114 Cb -0.13 -1.28 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 1lud s LEU 114 CO 0.03 -0.37 -0.16 0.54 0.23 0.00 0.00 176.35 176.61 1lud s VAL 115 N 1.02 2.89 -0.26 -1.59 0.11 -0.68 -1.86 120.40 120.02 1lud s VAL 115 Ca 0.12 -0.87 -0.07 0.00 -2.93 0.00 0.00 61.98 58.23 1lud s VAL 115 Cb -0.19 -2.14 -0.01 0.00 -1.53 0.00 0.00 36.38 32.50 1lud s VAL 115 CO -0.13 0.53 0.06 -0.89 -3.33 0.00 0.00 175.10 171.35 1lud s THR 116 N -0.76 4.10 -0.39 5.04 2.01 -0.89 -1.33 115.64 123.42 1lud s THR 116 Ca 0.12 -0.37 -0.18 0.00 0.31 0.00 0.00 61.69 61.57 1lud s THR 116 Cb -0.11 -2.97 0.01 0.00 0.01 0.00 0.00 72.50 69.44 1lud s THR 116 CO 0.01 0.27 0.50 -0.13 -0.69 0.00 0.00 174.62 174.59 1lud s ARG 117 N 1.57 3.39 0.40 4.92 1.81 -0.61 0.11 118.95 130.53 1lud s ARG 117 Ca 0.05 -0.41 -0.16 0.00 -1.72 0.00 0.00 55.73 53.49 1lud s ARG 117 Cb -0.16 -3.89 -0.09 0.00 -0.45 0.00 0.00 34.95 30.37 1lud s ARG 117 CO 0.02 -0.77 0.84 -0.51 -0.68 0.00 0.00 175.30 174.20 1lud s LEU 118 N 2.37 3.91 0.15 2.53 1.02 0.01 -1.70 118.68 126.98 1lud s LEU 118 Ca 0.17 1.41 0.14 0.00 0.02 0.00 0.00 54.13 55.88 1lud s LEU 118 Cb -0.16 -4.27 -0.08 0.00 0.02 0.00 0.00 46.19 41.71 1lud s LEU 118 CO 0.14 -0.35 1.12 0.00 0.02 0.00 0.00 176.35 177.29 1lud h ALA 119 N 1.76 0.62 -2.43 4.21 0.00 -1.26 -2.44 119.26 119.72 1lud h ALA 119 Ca -0.48 -0.75 -0.47 0.00 0.00 0.00 0.00 54.91 53.21 1lud h ALA 119 Cb 1.18 0.09 0.13 0.00 0.00 0.00 0.00 17.79 19.19 1lud h ALA 119 CO 0.63 0.91 0.28 0.20 0.00 0.00 0.00 179.25 181.27 1lud s GLY 120 N -4.68 1.59 -0.20 0.00 0.00 -1.03 -4.71 107.32 98.29 1lud s GLY 120 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 44.72 44.35 1lud s GLY 120 CO 0.79 0.15 -0.13 -1.35 0.00 0.00 0.00 173.10 172.56 1lud s SER 121 N -3.83 3.49 0.30 1.64 1.04 -1.26 -3.09 113.70 111.98 1lud s SER 121 Ca 0.63 -0.91 0.09 0.00 0.48 0.00 0.00 55.95 56.25 1lud s SER 121 Cb -0.16 -1.34 -0.04 0.00 0.10 0.00 0.00 66.02 64.58 1lud s SER 121 CO 0.55 -0.12 0.08 -0.36 0.98 0.00 0.00 173.24 174.37 1lud s PHE 122 N 1.33 2.73 0.29 5.02 0.08 -1.26 -5.06 117.98 121.10 1lud s PHE 122 Ca -0.01 -0.30 0.10 0.00 0.12 0.00 0.00 56.93 56.85 1lud s PHE 122 Cb -0.16 -1.43 -0.05 0.00 -0.57 0.00 0.00 43.02 40.81 1lud s PHE 122 CO -0.09 0.47 -0.08 -1.83 -0.10 0.00 0.00 175.22 173.59 1lud s GLU 123 N -3.77 1.97 0.00 0.44 -1.05 -1.26 -4.90 118.70 110.12 1lud s GLU 123 Ca 0.35 -1.67 0.00 0.00 -0.15 0.00 0.00 54.97 53.49 1lud s GLU 123 Cb -0.04 -1.92 0.00 0.00 -0.44 0.00 0.00 34.13 31.73 1lud s GLU 123 CO 0.22 0.28 0.00 0.41 0.95 0.00 0.00 175.26 177.12 1lud n GLY 124 N -0.79 1.23 0.00 -3.83 0.00 -1.26 -4.87 105.19 95.67 1lud n GLY 124 Ca -0.05 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 0.53 -4.40 1.61 -0.08 -1.26 -5.01 116.55 107.93 1lud n ASP 125 Ca 0.00 -0.08 -0.38 0.00 -1.51 0.00 0.00 54.79 52.83 1lud n ASP 125 Cb 0.00 0.26 -0.12 0.00 2.34 0.00 0.00 41.12 43.60 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 -0.37 4.29 0.21 5.18 2.01 -1.23 -5.08 115.64 120.64 1lud s THR 126 Ca 0.00 -0.48 0.11 0.00 0.31 0.00 0.00 61.69 61.62 1lud s THR 126 Cb 0.00 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 1lud s THR 126 CO 0.00 0.12 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.33 1lud s LYS 127 N 1.57 1.73 0.78 4.92 3.01 -1.26 -2.98 119.74 127.51 1lud s LYS 127 Ca 0.04 -1.49 -0.13 0.00 -1.01 0.00 0.00 55.97 53.38 1lud s LYS 127 Cb -0.17 -1.94 0.07 0.00 -1.01 0.00 0.00 37.83 34.78 1lud s LYS 127 CO 0.04 0.40 1.18 1.41 0.51 0.00 0.00 175.35 178.89 1lud s MET 128 N -2.90 1.89 0.91 1.68 1.75 -1.17 -4.85 119.30 116.62 1lud s MET 128 Ca 0.24 1.64 -0.12 0.00 -1.25 0.00 0.00 55.69 56.20 1lud s MET 128 Cb -0.08 -1.82 0.14 0.00 2.84 0.00 0.00 34.83 35.91 1lud s MET 128 CO 0.13 -2.00 1.13 0.96 -0.65 0.00 0.00 175.02 174.59 1lud s ILE 129 N -2.25 2.10 -0.67 10.11 -4.36 -1.26 -4.95 121.20 119.92 1lud s ILE 129 Ca 0.71 0.03 -0.27 0.00 -0.26 0.00 0.00 60.65 60.86 1lud s ILE 129 Cb -0.26 -2.75 0.01 0.00 1.25 0.00 0.00 42.46 40.71 1lud s ILE 129 CO 0.49 -0.04 1.44 -2.16 0.24 0.00 0.00 174.94 174.91 1lud s PRO 130 N -5.23 3.09 0.38 0.37 0.05 -1.26 -5.02 135.00 127.38 1lud s PRO 130 Ca 0.64 0.11 -0.07 0.00 0.05 0.00 0.00 61.00 61.73 1lud s PRO 130 Cb -0.15 -4.21 -0.05 0.00 0.05 0.00 0.00 34.50 30.13 1lud s PRO 130 CO 0.54 -2.23 0.70 -0.51 0.05 0.00 0.00 177.00 175.54 1lud s LEU 131 N 6.57 3.86 -1.18 -3.56 1.43 -1.26 -4.99 118.68 119.55 1lud s LEU 131 Ca 0.46 0.92 -0.06 0.00 -1.03 0.00 0.00 54.13 54.42 1lud s LEU 131 Cb -0.10 -3.79 0.23 0.00 0.03 0.00 0.00 46.19 42.56 1lud s LEU 131 CO 0.19 -0.37 1.81 -3.20 0.23 0.00 0.00 176.35 175.01 1lud n ASN 132 N -1.45 6.37 -0.08 2.29 5.15 -1.26 -4.78 115.26 121.50 1lud n ASN 132 Ca 0.00 -3.31 0.25 0.00 -0.60 0.00 0.00 54.58 50.93 1lud n ASN 132 Cb 0.54 -1.34 0.72 0.00 -0.53 0.00 0.00 39.78 39.17 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 5.22 0.00 0.00 1.20 4.06 -1.94 0.42 115.95 124.91 1lud h TRP 133 Ca 0.40 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.31 1lud h TRP 133 Cb 0.53 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.68 1lud h TRP 133 CO 1.24 0.00 -0.15 0.22 -3.56 0.00 0.00 178.44 176.18 1lud h ASP 134 N 0.00 0.00 0.46 -3.49 3.58 -2.04 -1.52 116.42 113.41 1lud h ASP 134 Ca 0.34 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.79 1lud h ASP 134 Cb 1.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.55 1lud h ASP 134 CO -0.00 0.15 -0.43 -0.67 -2.88 0.00 0.00 179.24 175.41 1lud n ASP 135 N -3.91 0.58 -4.64 2.28 2.03 0.15 -4.89 116.55 108.14 1lud n ASP 135 Ca -0.02 -0.35 -0.25 0.00 0.52 0.00 0.00 54.79 54.69 1lud n ASP 135 Cb 0.25 0.20 -0.09 0.00 -0.72 0.00 0.00 41.12 40.76 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1lud s PHE 136 N -2.89 2.55 -0.04 -0.67 0.40 -0.57 -4.01 117.98 112.74 1lud s PHE 136 Ca 0.14 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 56.00 1lud s PHE 136 Cb 0.18 -1.59 0.02 0.00 0.51 0.00 0.00 43.02 42.14 1lud s PHE 136 CO 0.66 0.43 -0.06 0.99 0.70 0.00 0.00 175.22 177.93 1lud s THR 137 N -2.55 0.65 -0.11 0.64 2.01 -0.96 -4.89 115.64 110.42 1lud s THR 137 Ca 0.36 -0.21 -0.29 0.00 0.31 0.00 0.00 61.69 61.85 1lud s THR 137 Cb 0.02 -0.64 -0.03 0.00 0.01 0.00 0.00 72.50 71.86 1lud s THR 137 CO 0.20 0.24 1.35 -0.75 -0.69 0.00 0.00 174.62 174.97 1lud s LYS 138 N 0.71 4.24 -0.05 4.92 2.20 -1.26 -1.43 119.74 129.07 1lud s LYS 138 Ca -0.10 1.81 0.21 0.00 -0.36 0.00 0.00 55.97 57.52 1lud s LYS 138 Cb -0.13 -3.77 -0.29 0.00 -1.51 0.00 0.00 37.83 32.13 1lud s LYS 138 CO 0.01 -0.70 0.43 1.33 -0.36 0.00 0.00 175.35 176.06 1lud n VAL 139 N 5.24 0.43 -3.80 4.02 0.24 0.49 -4.95 118.33 120.00 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 -0.13 0.00 -1.47 0.00 0.00 33.84 32.52 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 -0.16 -0.08 -1.34 0.01 -1.19 -5.02 113.70 101.06 1lud s SER 140 Ca -0.08 0.33 -0.04 0.00 1.31 0.00 0.00 55.95 57.47 1lud s SER 140 Cb 0.12 0.30 0.04 0.00 0.21 0.00 0.00 66.02 66.69 1lud s SER 140 CO 0.88 -0.08 0.18 -0.94 0.41 0.00 0.00 173.24 173.70 1lud s SER 141 N 0.35 -0.15 -0.07 2.44 1.04 -1.26 -0.64 113.70 115.42 1lud s SER 141 Ca -0.02 0.39 0.02 0.00 0.48 0.00 0.00 55.95 56.81 1lud s SER 141 Cb -0.04 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.37 1lud s SER 141 CO -0.01 -0.16 -0.11 -0.60 0.98 0.00 0.00 173.24 173.34 1lud s ARG 142 N 1.24 1.61 -0.18 4.02 3.52 -0.43 -4.96 118.95 123.77 1lud s ARG 142 Ca -0.09 -0.37 -0.06 0.00 -0.13 0.00 0.00 55.73 55.07 1lud s ARG 142 Cb -0.11 -1.37 -0.03 0.00 -1.56 0.00 0.00 34.95 31.87 1lud s ARG 142 CO -0.07 -0.01 0.03 0.99 -0.81 0.00 0.00 175.30 175.43 1lud s THR 143 N 0.77 4.41 -0.09 4.11 2.01 -1.26 -0.30 115.64 125.29 1lud s THR 143 Ca -0.13 -0.16 0.02 0.00 0.31 0.00 0.00 61.69 61.73 1lud s THR 143 Cb -0.15 -2.98 0.01 0.00 0.01 0.00 0.00 72.50 69.38 1lud s THR 143 CO 0.02 0.45 -0.15 0.54 -0.69 0.00 0.00 174.62 174.80 1lud s VAL 144 N 0.56 1.39 0.49 3.82 0.11 -0.92 -5.02 120.40 120.82 1lud s VAL 144 Ca 0.01 -0.61 -0.04 0.00 -2.93 0.00 0.00 61.98 58.42 1lud s VAL 144 Cb -0.13 -1.26 -0.02 0.00 -1.53 0.00 0.00 36.38 33.44 1lud s VAL 144 CO 0.02 0.42 0.77 -1.83 -3.33 0.00 0.00 175.10 171.14 1lud s GLU 145 N 0.78 3.28 0.05 1.54 1.03 -1.26 -2.86 118.70 121.26 1lud s GLU 145 Ca -0.12 -0.05 0.00 0.00 0.03 0.00 0.00 54.97 54.84 1lud s GLU 145 Cb -0.16 -2.42 -0.03 0.00 -0.80 0.00 0.00 34.13 30.72 1lud s GLU 145 CO 0.02 -0.31 -0.04 0.34 -1.33 0.00 0.00 175.26 173.94 1lud s ASP 146 N -4.17 0.62 0.31 0.83 2.15 -1.26 -4.94 116.67 110.20 1lud s ASP 146 Ca 0.48 -0.85 0.19 0.00 0.43 0.00 0.00 52.55 52.80 1lud s ASP 146 Cb -0.10 0.14 1.06 0.00 -0.30 0.00 0.00 42.92 43.71 1lud s ASP 146 CO 0.43 -0.47 1.58 0.35 -0.17 0.00 0.00 175.17 176.88 1lud n THR 147 N 0.52 1.01 -3.91 1.71 -2.24 -1.26 -4.33 114.28 105.77 1lud n THR 147 Ca -0.17 0.73 -0.36 0.00 -2.27 0.00 0.00 64.05 61.99 1lud n THR 147 Cb 0.59 -1.73 -0.12 0.00 -2.10 0.00 0.00 70.33 66.97 1lud n THR 147 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1lud s ASN 148 N -3.89 5.01 0.25 3.42 3.84 -1.26 -5.00 114.94 117.31 1lud s ASN 148 Ca -0.02 -0.19 -0.06 0.00 0.21 0.00 0.00 52.86 52.80 1lud s ASN 148 Cb 0.06 -1.88 0.47 0.00 -0.55 0.00 0.00 41.25 39.35 1lud s ASN 148 CO 0.18 0.02 1.63 -0.65 -2.79 0.00 0.00 177.10 175.49 1lud h PRO 149 N 7.80 0.11 0.00 0.43 0.10 -2.00 -0.91 132.00 137.53 1lud h PRO 149 Ca -0.37 -0.01 -0.20 0.00 0.10 0.00 0.00 66.00 65.52 1lud h PRO 149 Cb 1.17 -0.02 -0.03 0.00 0.10 0.00 0.00 31.00 32.22 1lud h PRO 149 CO 0.60 0.07 -1.02 0.00 0.10 0.00 0.00 178.00 177.75 1lud h ALA 150 N 1.72 0.47 0.00 -0.75 0.00 -1.93 -3.26 119.26 115.51 1lud h ALA 150 Ca 0.43 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1lud h ALA 150 Cb 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1lud h ALA 150 CO -0.67 1.18 0.00 1.28 0.00 0.00 0.00 179.25 181.03 1lud n LEU 151 N -3.27 0.00 -4.76 0.00 4.77 -0.36 -2.47 117.00 110.90 1lud n LEU 151 Ca -0.02 0.02 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 1lud n LEU 151 Cb 0.92 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.99 1lud n LEU 151 CO 0.46 -0.01 0.95 -0.89 -1.33 0.00 0.00 177.39 176.56 1lud s THR 152 N -2.04 2.57 0.08 -5.08 2.01 -1.12 -4.69 115.64 107.37 1lud s THR 152 Ca 0.23 0.47 -0.19 0.00 0.31 0.00 0.00 61.69 62.52 1lud s THR 152 Cb 0.11 -3.26 0.04 0.00 0.01 0.00 0.00 72.50 69.40 1lud s THR 152 CO 0.19 0.04 0.44 -1.38 -0.69 0.00 0.00 174.62 173.22 1lud s HIS 153 N -1.33 -0.30 0.06 4.92 -3.43 -1.14 -1.19 115.29 112.90 1lud s HIS 153 Ca 0.62 0.15 0.07 0.00 -0.80 0.00 0.00 55.06 55.10 1lud s HIS 153 Cb -0.37 0.28 -0.03 0.00 -1.43 0.00 0.00 32.58 31.04 1lud s HIS 153 CO 0.46 -0.66 -0.18 0.99 -2.00 0.00 0.00 174.74 173.35 1lud s THR 154 N -3.08 1.46 -0.23 -5.38 2.01 -0.69 -2.17 115.64 107.57 1lud s THR 154 Ca -0.02 -1.24 -0.07 0.00 0.31 0.00 0.00 61.69 60.67 1lud s THR 154 Cb 0.00 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 1lud s THR 154 CO -0.07 0.03 0.07 -0.31 -0.69 0.00 0.00 174.62 173.65 1lud s TYR 155 N -0.96 3.12 -0.13 4.92 2.02 0.58 -1.57 117.35 125.33 1lud s TYR 155 Ca 0.05 -0.28 0.03 0.00 -0.37 0.00 0.00 57.07 56.49 1lud s TYR 155 Cb -0.09 -2.19 0.00 0.00 -0.40 0.00 0.00 41.96 39.28 1lud s TYR 155 CO 0.02 -0.22 -0.22 -1.21 -1.57 0.00 0.00 175.55 172.36 1lud s GLU 156 N 1.28 3.07 -0.16 -0.62 2.02 -0.44 -1.32 118.70 122.54 1lud s GLU 156 Ca 0.05 -0.84 -0.01 0.00 0.02 0.00 0.00 54.97 54.18 1lud s GLU 156 Cb -0.15 -2.41 -0.01 0.00 0.10 0.00 0.00 34.13 31.66 1lud s GLU 156 CO 0.03 0.07 -0.10 0.08 0.02 0.00 0.00 175.26 175.36 1lud s VAL 157 N 0.61 3.11 0.30 2.63 1.01 0.18 -1.69 120.40 126.56 1lud s VAL 157 Ca -0.12 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.34 1lud s VAL 157 Cb -0.16 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 1lud s VAL 157 CO 0.03 0.49 0.01 0.26 0.00 0.00 0.00 175.10 175.89 1lud s TRP 158 N 0.76 2.62 0.01 5.22 0.52 0.16 -0.38 118.94 127.85 1lud s TRP 158 Ca -0.04 -0.32 0.01 0.00 0.02 0.00 0.00 56.10 55.77 1lud s TRP 158 Cb -0.15 -1.34 -0.01 0.00 -1.15 0.00 0.00 33.47 30.82 1lud s TRP 158 CO 0.01 0.54 -0.04 -0.65 0.02 0.00 0.00 176.95 176.83 1lud s GLN 159 N -3.70 0.32 -0.00 4.98 -0.21 -0.51 -1.98 119.66 118.56 1lud s GLN 159 Ca 0.33 -0.26 -0.28 0.00 0.02 0.00 0.00 55.36 55.17 1lud s GLN 159 Cb -0.04 -0.25 -0.04 0.00 1.00 0.00 0.00 33.01 33.69 1lud s GLN 159 CO 0.20 0.06 0.88 0.21 -2.12 0.00 0.00 175.29 174.52 1lud s LYS 160 N -0.43 4.53 0.48 2.91 2.20 -0.93 -2.28 119.74 126.23 1lud s LYS 160 Ca -0.02 1.24 -0.23 0.00 -0.36 0.00 0.00 55.97 56.61 1lud s LYS 160 Cb -0.03 -3.44 -0.07 0.00 -1.51 0.00 0.00 37.83 32.78 1lud s LYS 160 CO -0.00 0.04 1.24 0.15 -0.36 0.00 0.00 175.35 176.42 1lud s LYS 161 N 0.76 3.57 0.00 4.03 1.02 -1.26 -5.02 119.74 122.85 1lud s LYS 161 Ca 0.46 1.97 0.00 0.00 0.02 0.00 0.00 55.97 58.42 1lud s LYS 161 Cb -0.20 -2.39 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 1lud s LYS 161 CO 0.25 -0.76 0.31 0.00 -0.92 0.00 0.00 175.35 174.23