#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1udy s PHE 12 N 0.00 3.07 -0.22 1.61 0.08 -1.26 -5.03 117.98 116.23 1udy s PHE 12 Ca 0.00 1.40 -0.11 0.00 0.12 0.00 0.00 56.93 58.35 1udy s PHE 12 Cb 0.00 -3.67 0.08 0.00 -0.57 0.00 0.00 43.02 38.86 1udy s PHE 12 CO 0.00 -1.85 0.52 0.45 -0.10 0.00 0.00 175.22 174.24 1udy s SER 13 N -0.44 -0.67 -0.42 1.36 0.15 -1.26 -5.03 113.70 107.40 1udy s SER 13 Ca 0.49 1.18 0.05 0.00 0.70 0.00 0.00 55.95 58.38 1udy s SER 13 Cb -0.39 1.28 0.43 0.00 -1.71 0.00 0.00 66.02 65.62 1udy s SER 13 CO 0.52 -0.22 1.23 0.49 1.20 0.00 0.00 173.24 176.46 1udy n PHE 14 N 4.69 3.16 -4.36 3.44 3.72 -1.26 -5.02 117.46 121.83 1udy n PHE 14 Ca -0.18 -2.77 -0.31 0.00 -0.05 0.00 0.00 57.45 54.15 1udy n PHE 14 Cb 0.54 -0.29 -0.10 0.00 -0.94 0.00 0.00 39.48 38.69 1udy n PHE 14 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1udy s GLU 15 N -3.60 2.36 -0.14 -1.08 2.56 -1.26 -5.12 118.70 112.43 1udy s GLU 15 Ca 0.50 -0.86 -0.09 0.00 0.00 0.00 0.00 54.97 54.51 1udy s GLU 15 Cb 0.41 -2.41 -0.05 0.00 2.00 0.00 0.00 34.13 34.08 1udy s GLU 15 CO -0.12 0.56 0.18 -1.17 -0.56 0.00 0.00 175.26 174.15 1udy s LEU 16 N -1.79 4.33 0.52 2.70 2.96 -1.26 -5.07 118.68 121.07 1udy s LEU 16 Ca 0.19 0.45 -0.21 0.00 -0.22 0.00 0.00 54.13 54.35 1udy s LEU 16 Cb -0.11 -2.16 -0.06 0.00 0.50 0.00 0.00 46.19 44.36 1udy s LEU 16 CO 0.11 0.30 1.15 0.42 -1.32 0.00 0.00 176.35 177.01 1udy s THR 17 N -0.48 3.10 0.38 3.68 -4.23 -1.26 -4.76 115.64 112.07 1udy s THR 17 Ca 0.14 0.73 0.21 0.00 -1.18 0.00 0.00 61.69 61.59 1udy s THR 17 Cb -0.12 -3.32 0.39 0.00 1.34 0.00 0.00 72.50 70.78 1udy s THR 17 CO 0.03 -0.10 1.65 -0.33 -0.54 0.00 0.00 174.62 175.32 1udy h GLU 18 N 1.45 0.20 -0.24 3.99 3.07 -1.99 0.23 114.58 121.29 1udy h GLU 18 Ca -0.50 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.30 1udy h GLU 18 Cb 1.26 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.12 1udy h GLU 18 CO 0.58 0.13 -0.04 0.37 -1.40 0.00 0.00 179.01 178.64 1udy h GLN 19 N 0.20 0.46 -0.20 2.33 4.15 -2.00 -2.63 115.11 117.42 1udy h GLN 19 Ca 0.77 -0.17 -0.03 0.00 0.77 0.00 0.00 58.65 59.99 1udy h GLN 19 Cb 2.03 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 29.68 1udy h GLN 19 CO -0.55 0.67 -0.00 1.96 -1.93 0.00 0.00 178.83 178.98 1udy h GLN 20 N 0.20 0.29 0.00 1.69 4.20 -0.95 0.11 115.11 120.66 1udy h GLN 20 Ca 0.06 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1udy h GLN 20 Cb 0.50 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1udy h GLN 20 CO 0.02 0.33 -0.13 0.87 -0.67 0.00 0.00 178.83 179.25 1udy h LYS 21 N 0.29 0.00 0.02 1.46 1.57 -0.87 -2.01 116.57 117.02 1udy h LYS 21 Ca 0.07 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1udy h LYS 21 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1udy h LYS 21 CO 0.00 0.13 -0.01 0.93 -0.57 0.00 0.00 179.45 179.93 1udy h GLU 22 N 0.00 -0.02 -0.58 3.15 5.08 -0.46 -2.97 114.58 118.78 1udy h GLU 22 Ca -0.00 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1udy h GLU 22 Cb 0.35 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 1udy h GLU 22 CO 0.02 0.71 0.08 0.74 -1.00 0.00 0.00 179.01 179.56 1udy h PHE 23 N -0.94 0.11 -0.24 4.33 0.04 -1.21 -1.84 116.94 117.19 1udy h PHE 23 Ca -0.00 0.04 0.02 0.00 2.80 0.00 0.00 57.97 60.83 1udy h PHE 23 Cb 0.74 0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.91 1udy h PHE 23 CO 0.20 -0.07 0.08 0.37 -0.60 0.00 0.00 178.31 178.29 1udy h GLN 24 N 0.20 0.19 -0.27 1.51 4.15 -1.49 -1.28 115.11 118.13 1udy h GLN 24 Ca 0.30 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.70 1udy h GLN 24 Cb 0.46 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1udy h GLN 24 CO -0.43 0.13 0.09 0.00 -1.93 0.00 0.00 178.83 176.69 1udy h ALA 25 N 1.15 1.66 0.60 3.38 0.00 -1.22 0.15 119.26 125.00 1udy h ALA 25 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1udy h ALA 25 Cb 0.07 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1udy h ALA 25 CO -0.11 0.27 -0.29 1.15 0.00 0.00 0.00 179.25 180.27 1udy h THR 26 N 0.38 0.03 -0.50 0.00 2.02 -0.83 -1.83 112.91 112.18 1udy h THR 26 Ca 0.09 -0.41 0.10 0.00 0.77 0.00 0.00 66.41 66.96 1udy h THR 26 Cb 0.10 0.04 -0.08 0.00 -1.74 0.00 0.00 68.15 66.47 1udy h THR 26 CO -0.01 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 175.88 1udy h ALA 27 N -1.19 0.46 0.16 6.16 0.00 -1.08 -0.10 119.26 123.67 1udy h ALA 27 Ca -0.08 0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1udy h ALA 27 Cb 0.63 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1udy h ALA 27 CO 0.14 -0.39 -0.26 -0.09 0.00 0.00 0.00 179.25 178.64 1udy h ARG 28 N 0.11 -0.48 -0.10 0.00 2.43 -0.74 0.13 114.38 115.74 1udy h ARG 28 Ca 0.25 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.47 1udy h ARG 28 Cb 0.38 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1udy h ARG 28 CO -0.42 -0.32 -0.03 -0.22 -1.51 0.00 0.00 179.97 177.47 1udy h LYS 29 N -0.50 -0.02 -0.45 0.20 3.64 -0.92 -1.10 116.57 117.43 1udy h LYS 29 Ca 0.02 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1udy h LYS 29 Cb 0.50 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.25 1udy h LYS 29 CO -0.13 -0.01 -0.04 0.35 -2.27 0.00 0.00 179.45 177.35 1udy h PHE 30 N -0.02 -0.10 -0.54 1.91 3.57 -0.77 0.21 116.94 121.20 1udy h PHE 30 Ca 0.05 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 1udy h PHE 30 Cb 0.09 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1udy h PHE 30 CO -0.15 -0.13 0.07 0.00 -2.23 0.00 0.00 178.31 175.86 1udy h ALA 31 N 1.42 1.09 0.00 2.41 0.00 -0.35 -0.33 119.26 123.51 1udy h ALA 31 Ca 0.22 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1udy h ALA 31 Cb 0.33 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1udy h ALA 31 CO -0.41 0.59 -1.07 0.00 0.00 0.00 0.00 179.25 178.36 1udy h ARG 32 N 0.83 0.00 0.00 0.00 3.08 -0.76 -1.27 114.38 116.26 1udy h ARG 32 Ca 0.17 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.97 1udy h ARG 32 Cb 0.40 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 1udy h ARG 32 CO 0.01 0.23 -2.23 0.39 -1.07 0.00 0.00 179.97 177.30 1udy n GLU 33 N -2.90 0.73 -0.03 0.04 1.02 0.02 -4.56 120.64 114.97 1udy n GLU 33 Ca -0.04 -0.07 -0.04 0.00 -0.02 0.00 0.00 57.16 56.99 1udy n GLU 33 Cb 0.73 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.60 1udy n GLU 33 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1udy n GLU 34 N -2.57 1.65 -0.06 3.49 1.02 -0.16 -4.64 120.64 119.36 1udy n GLU 34 Ca -0.23 0.02 -0.06 0.00 -0.02 0.00 0.00 57.16 56.87 1udy n GLU 34 Cb 0.95 -1.14 -0.04 0.00 -0.02 0.00 0.00 31.44 31.19 1udy n GLU 34 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1udy h ILE 35 N 0.00 0.46 -0.72 -3.67 2.04 -1.35 -3.38 117.51 110.89 1udy h ILE 35 Ca -0.15 -1.39 0.15 0.00 1.00 0.00 0.00 64.86 64.47 1udy h ILE 35 Cb 1.29 0.92 -0.11 0.00 -0.74 0.00 0.00 36.82 38.18 1udy h ILE 35 CO -0.01 0.16 0.16 0.40 0.00 0.00 0.00 178.15 178.86 1udy h ILE 36 N -1.00 0.52 0.00 -0.67 2.04 -1.47 0.36 117.51 117.29 1udy h ILE 36 Ca -0.03 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1udy h ILE 36 Cb 0.44 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1udy h ILE 36 CO -0.02 0.05 0.03 -2.65 0.00 0.00 0.00 178.15 175.56 1udy n PRO 37 N -5.16 0.07 0.00 2.37 -0.02 -1.26 -3.22 135.00 127.77 1udy n PRO 37 Ca 0.13 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1udy n PRO 37 Cb 0.44 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1udy n PRO 37 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1udy n VAL 38 N -1.87 0.00 0.05 -1.45 0.24 -0.47 -4.87 118.33 109.96 1udy n VAL 38 Ca -0.01 -0.06 0.03 0.00 -2.04 0.00 0.00 64.34 62.26 1udy n VAL 38 Cb 0.05 1.58 0.42 0.00 -1.47 0.00 0.00 33.84 34.41 1udy n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1udy h ALA 39 N 0.00 1.64 -0.70 2.33 0.00 -0.95 -2.63 119.26 118.95 1udy h ALA 39 Ca 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1udy h ALA 39 Cb 0.29 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1udy h ALA 39 CO 0.00 0.29 0.33 0.00 0.00 0.00 0.00 179.25 179.87 1udy h ALA 40 N 1.71 0.91 -0.53 0.00 0.00 -1.86 -0.54 119.26 118.95 1udy h ALA 40 Ca 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1udy h ALA 40 Cb 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1udy h ALA 40 CO -0.01 0.48 0.11 1.49 0.00 0.00 0.00 179.25 181.32 1udy h GLU 41 N 0.98 0.86 -0.06 0.00 4.57 -1.84 -2.31 114.58 116.79 1udy h GLU 41 Ca 0.24 -0.22 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1udy h GLU 41 Cb 0.13 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1udy h GLU 41 CO -0.03 0.83 -0.22 1.88 -1.18 0.00 0.00 179.01 180.29 1udy h TYR 42 N 0.75 0.10 -0.12 0.92 0.05 -1.31 0.10 116.97 117.46 1udy h TYR 42 Ca 0.16 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 58.84 1udy h TYR 42 Cb 0.37 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1udy h TYR 42 CO 0.03 0.31 -0.32 0.22 -1.05 0.00 0.00 178.16 177.35 1udy h ASP 43 N 0.09 0.23 0.09 3.88 3.58 -0.62 -0.82 116.42 122.86 1udy h ASP 43 Ca 0.02 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.38 1udy h ASP 43 Cb 0.44 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.43 1udy h ASP 43 CO 0.03 0.54 -0.05 0.03 -2.88 0.00 0.00 179.24 176.92 1udy h ARG 44 N 0.20 -0.12 0.00 0.28 3.08 -0.75 -3.37 114.38 113.70 1udy h ARG 44 Ca 0.03 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1udy h ARG 44 Cb 0.66 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1udy h ARG 44 CO 0.05 0.16 -0.17 1.79 -1.07 0.00 0.00 179.97 180.73 1udy h THR 45 N -1.00 0.45 0.00 2.04 1.35 -0.90 -3.46 112.91 111.39 1udy h THR 45 Ca -0.01 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 1udy h THR 45 Cb 0.34 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1udy h THR 45 CO 0.02 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 1udy n GLY 46 N 0.01 0.31 3.73 5.82 0.00 -0.31 -4.95 105.19 109.80 1udy n GLY 46 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1udy n GLY 46 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1udy s GLU 47 N -0.89 4.38 0.30 1.61 2.12 -1.26 -4.59 118.70 120.37 1udy s GLU 47 Ca 0.00 2.05 -0.29 0.00 0.36 0.00 0.00 54.97 57.09 1udy s GLU 47 Cb 0.00 -3.21 -0.13 0.00 0.26 0.00 0.00 34.13 31.06 1udy s GLU 47 CO 0.00 -0.29 1.37 0.98 -0.54 0.00 0.00 175.26 176.78 1udy n TYR 48 N 2.90 2.29 -1.06 5.30 9.36 -1.26 -4.75 117.16 129.94 1udy n TYR 48 Ca 0.07 0.48 -0.16 0.00 3.32 0.00 0.00 57.90 61.61 1udy n TYR 48 Cb 0.43 -2.45 -0.08 0.00 -0.63 0.00 0.00 39.34 36.61 1udy n TYR 48 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1udy n PRO 49 N 1.28 1.94 -0.31 2.98 -0.04 -1.26 -4.75 135.00 134.84 1udy n PRO 49 Ca 0.08 -1.36 0.06 0.00 -0.04 0.00 0.00 63.50 62.24 1udy n PRO 49 Cb 0.34 -1.83 0.16 0.00 -0.04 0.00 0.00 33.50 32.14 1udy n PRO 49 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1udy h VAL 50 N 1.68 0.15 -0.85 0.52 2.07 -1.97 0.03 116.25 117.88 1udy h VAL 50 Ca 0.24 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.86 1udy h VAL 50 Cb 1.09 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 1udy h VAL 50 CO 0.48 0.00 0.55 -0.65 0.02 0.00 0.00 177.57 177.98 1udy h PRO 51 N 0.02 0.75 0.07 1.57 0.11 -2.00 0.90 132.00 133.42 1udy h PRO 51 Ca 0.46 -0.04 -0.24 0.00 0.11 0.00 0.00 66.00 66.28 1udy h PRO 51 Cb 0.79 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.72 1udy h PRO 51 CO -0.86 0.49 -1.11 -0.07 -0.21 0.00 0.00 178.00 176.24 1udy h LEU 52 N 0.77 0.25 -0.20 2.35 3.38 -1.42 -2.88 115.31 117.56 1udy h LEU 52 Ca 0.40 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1udy h LEU 52 Cb 0.51 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1udy h LEU 52 CO -0.17 1.19 0.00 -0.07 0.09 0.00 0.00 178.44 179.48 1udy h LEU 53 N 0.05 0.34 0.16 1.67 3.38 -0.45 0.66 115.31 121.12 1udy h LEU 53 Ca -0.08 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.60 1udy h LEU 53 Cb 1.85 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 42.46 1udy h LEU 53 CO 0.17 0.56 -0.45 0.50 0.09 0.00 0.00 178.44 179.31 1udy h LYS 54 N 0.11 -0.68 0.00 1.13 1.63 -0.92 0.64 116.57 118.47 1udy h LYS 54 Ca 0.06 0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.89 1udy h LYS 54 Cb 0.38 0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1udy h LYS 54 CO 0.01 -0.46 -0.04 0.00 -3.45 0.00 0.00 179.45 175.51 1udy h ARG 55 N -0.71 0.00 -0.18 1.90 2.47 -1.44 -1.55 114.38 114.87 1udy h ARG 55 Ca 0.01 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.55 1udy h ARG 55 Cb 0.71 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.03 1udy h ARG 55 CO -0.23 0.04 -0.61 0.00 0.56 0.00 0.00 179.97 179.73 1udy h ALA 56 N 1.96 0.59 0.26 0.04 0.00 0.08 -2.30 119.26 119.89 1udy h ALA 56 Ca -0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1udy h ALA 56 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1udy h ALA 56 CO 0.01 0.70 -0.13 2.35 0.00 0.00 0.00 179.25 182.18 1udy h TRP 57 N 0.46 -0.33 0.00 0.00 7.01 0.09 -1.17 115.95 122.01 1udy h TRP 57 Ca -0.01 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 60.93 1udy h TRP 57 Cb 1.18 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.34 1udy h TRP 57 CO 0.06 -0.12 -0.29 1.05 -2.79 0.00 0.00 178.44 176.34 1udy h GLU 58 N -0.47 0.00 -0.01 2.65 4.11 -1.50 -1.79 114.58 117.57 1udy h GLU 58 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1udy h GLU 58 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1udy h GLU 58 CO 0.06 0.29 0.00 -0.11 0.07 0.00 0.00 179.01 179.32 1udy n LEU 59 N -4.09 0.07 -1.23 3.06 7.94 -0.87 -4.87 117.00 117.01 1udy n LEU 59 Ca -0.02 -0.03 -0.16 0.00 -1.11 0.00 0.00 56.01 54.69 1udy n LEU 59 Cb 0.35 -0.01 -0.06 0.00 0.53 0.00 0.00 43.42 44.23 1udy n LEU 59 CO 0.37 0.02 -0.15 0.61 -1.11 0.00 0.00 177.39 177.12 1udy n GLY 60 N 0.63 1.48 0.59 -3.96 0.00 -0.67 -4.89 105.19 98.36 1udy n GLY 60 Ca 0.06 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1udy n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1udy n LEU 61 N -1.80 1.81 -4.75 0.99 4.77 -0.46 -4.83 117.00 112.74 1udy n LEU 61 Ca -0.16 -0.66 -0.27 0.00 -0.03 0.00 0.00 56.01 54.90 1udy n LEU 61 Cb 0.52 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 1udy n LEU 61 CO 0.24 0.33 -0.16 -0.04 -1.33 0.00 0.00 177.39 176.43 1udy s MET 62 N -1.91 2.19 -1.01 3.23 -1.94 -1.24 -4.69 119.30 113.92 1udy s MET 62 Ca 0.35 -1.99 -0.13 0.00 -1.71 0.00 0.00 55.69 52.22 1udy s MET 62 Cb 0.20 -1.88 0.13 0.00 2.01 0.00 0.00 34.83 35.28 1udy s MET 62 CO 0.31 -0.22 0.32 0.09 -0.01 0.00 0.00 175.02 175.51 1udy n ASN 63 N -1.28 -1.37 -0.07 3.03 3.02 -1.26 -4.76 115.26 112.56 1udy n ASN 63 Ca -0.04 -0.47 0.17 0.00 -0.03 0.00 0.00 54.58 54.21 1udy n ASN 63 Cb 0.65 -1.25 0.60 0.00 -0.61 0.00 0.00 39.78 39.17 1udy n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1udy h THR 64 N -0.46 0.78 -0.00 3.41 1.03 -1.88 -2.80 112.91 112.98 1udy h THR 64 Ca -0.32 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.01 1udy h THR 64 Cb 1.14 0.55 0.00 0.00 -1.07 0.00 0.00 68.15 68.77 1udy h THR 64 CO 0.48 0.04 -0.30 1.57 -0.01 0.00 0.00 175.52 177.30 1udy n HIS 65 N -4.43 0.00 -1.94 0.00 -0.00 -1.26 -2.69 115.22 104.90 1udy n HIS 65 Ca 0.11 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.41 1udy n HIS 65 Cb 0.55 -0.31 -0.03 0.00 -0.00 0.00 0.00 29.99 30.20 1udy n HIS 65 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1udy s ILE 66 N -2.93 2.71 0.36 3.57 1.01 -1.06 -4.64 121.20 120.23 1udy s ILE 66 Ca 0.14 0.47 -0.27 0.00 0.00 0.00 0.00 60.65 60.99 1udy s ILE 66 Cb 0.18 -3.30 -0.12 0.00 0.01 0.00 0.00 42.46 39.24 1udy s ILE 66 CO 0.62 0.03 1.28 -2.65 0.00 0.00 0.00 174.94 174.22 1udy n PRO 67 N 4.23 2.07 0.17 2.79 -0.02 -1.26 -1.78 135.00 141.20 1udy n PRO 67 Ca 0.14 0.73 0.18 0.00 -2.02 0.00 0.00 63.50 62.53 1udy n PRO 67 Cb 0.39 -2.34 0.80 0.00 -0.02 0.00 0.00 33.50 32.33 1udy n PRO 67 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1udy h GLU 68 N 2.41 0.00 -0.14 -0.52 5.08 -1.87 0.53 114.58 120.07 1udy h GLU 68 Ca -0.46 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.94 1udy h GLU 68 Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1udy h GLU 68 CO 0.62 0.00 0.11 0.77 -1.00 0.00 0.00 179.01 179.51 1udy h SER 69 N 0.00 0.00 -0.18 1.42 0.02 -1.90 -1.95 113.55 110.96 1udy h SER 69 Ca 0.12 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 1udy h SER 69 Cb 0.66 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.14 1udy h SER 69 CO -0.00 0.00 -0.27 0.49 -1.14 0.00 0.00 176.83 175.91 1udy n PHE 70 N -4.27 0.57 -0.83 3.45 3.72 0.11 -4.95 117.46 115.26 1udy n PHE 70 Ca 0.00 -1.54 0.00 0.00 -0.05 0.00 0.00 57.45 55.87 1udy n PHE 70 Cb 0.24 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 1udy n PHE 70 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1udy n GLY 71 N -1.12 0.62 3.99 1.37 0.00 -0.73 -4.40 105.19 104.92 1udy n GLY 71 Ca 0.26 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.06 1udy n GLY 71 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1udy s GLY 72 N -1.98 1.79 0.48 -0.02 0.00 -0.81 -4.89 107.32 101.88 1udy s GLY 72 Ca 0.00 -1.67 0.29 0.00 0.00 0.00 0.00 44.72 43.34 1udy s GLY 72 CO 0.00 -1.23 1.83 1.41 0.00 0.00 0.00 173.10 175.11 1udy h LEU 73 N -0.18 0.00 0.01 0.66 -0.00 -1.71 -3.26 115.31 110.83 1udy h LEU 73 Ca -0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.50 1udy h LEU 73 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.94 1udy h LEU 73 CO 0.44 0.00 -0.00 0.61 -0.00 0.00 0.00 178.44 179.49 1udy n GLY 74 N 0.45 0.24 3.43 0.83 0.00 -0.73 -4.80 105.19 104.61 1udy n GLY 74 Ca 0.02 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1udy n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1udy n LEU 75 N -0.02 -2.00 -4.80 0.99 4.32 -1.10 -4.93 117.00 109.46 1udy n LEU 75 Ca -0.00 -0.22 -0.29 0.00 -0.02 0.00 0.00 56.01 55.47 1udy n LEU 75 Cb 0.28 -1.21 -0.05 0.00 -1.62 0.00 0.00 43.42 40.82 1udy n LEU 75 CO 0.00 -3.38 -0.13 -0.83 -1.22 0.00 0.00 177.39 171.83 1udy s GLY 76 N -2.33 2.68 0.25 -0.72 0.00 -1.26 -4.55 107.32 101.40 1udy s GLY 76 Ca 0.68 -0.99 -0.03 0.00 0.00 0.00 0.00 44.72 44.37 1udy s GLY 76 CO 0.66 -2.07 1.81 -2.22 0.00 0.00 0.00 173.10 171.28 1udy h ILE 77 N 1.16 0.88 -0.93 0.90 1.08 -1.94 0.32 117.51 118.98 1udy h ILE 77 Ca -0.41 -0.27 0.03 0.00 -0.39 0.00 0.00 64.86 63.82 1udy h ILE 77 Cb 1.30 0.03 -0.05 0.00 -3.07 0.00 0.00 36.82 35.02 1udy h ILE 77 CO 0.68 0.14 0.61 0.40 -0.69 0.00 0.00 178.15 179.29 1udy h ILE 78 N 0.79 1.16 -0.19 -0.67 2.04 -1.96 -0.83 117.51 117.85 1udy h ILE 78 Ca 0.42 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 1udy h ILE 78 Cb 0.42 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1udy h ILE 78 CO -0.27 0.22 -0.03 0.44 0.00 0.00 0.00 178.15 178.50 1udy h ASP 79 N 1.18 0.36 -0.76 1.72 3.32 -1.33 -2.64 116.42 118.27 1udy h ASP 79 Ca 0.37 -0.35 0.13 0.00 0.02 0.00 0.00 57.03 57.19 1udy h ASP 79 Cb -0.01 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.39 1udy h ASP 79 CO -0.12 0.63 0.50 -1.28 -1.72 0.00 0.00 179.24 177.26 1udy h SER 80 N 0.08 0.50 -0.05 6.45 0.87 0.17 -2.69 113.55 118.89 1udy h SER 80 Ca 0.05 0.02 -0.22 0.00 -1.23 0.00 0.00 61.79 60.41 1udy h SER 80 Cb 0.47 -0.08 0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1udy h SER 80 CO 0.02 0.28 -0.82 0.00 -0.53 0.00 0.00 176.83 175.78 1udy h LEU 82 N 0.29 0.74 0.00 0.00 4.07 -1.14 -1.79 115.31 117.48 1udy h LEU 82 Ca -0.09 -0.01 -0.17 0.00 0.08 0.00 0.00 57.88 57.69 1udy h LEU 82 Cb 1.48 -0.17 0.01 0.00 1.08 0.00 0.00 40.66 43.06 1udy h LEU 82 CO 0.16 0.51 -0.66 0.40 -1.08 0.00 0.00 178.44 177.78 1udy h ILE 83 N 0.86 1.41 -0.51 1.22 2.04 -1.59 -3.31 117.51 117.63 1udy h ILE 83 Ca 0.28 -2.11 0.01 0.00 1.00 0.00 0.00 64.86 64.04 1udy h ILE 83 Cb 0.04 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.68 1udy h ILE 83 CO -0.08 0.62 0.32 0.74 0.00 0.00 0.00 178.15 179.76 1udy h THR 84 N -0.06 1.10 -0.91 -0.27 2.02 -1.18 -2.03 112.91 111.58 1udy h THR 84 Ca -0.08 -0.23 0.07 0.00 0.77 0.00 0.00 66.41 66.94 1udy h THR 84 Cb 1.36 0.38 -0.07 0.00 -1.74 0.00 0.00 68.15 68.09 1udy h THR 84 CO 0.13 0.12 0.57 -0.08 0.37 0.00 0.00 175.52 176.63 1udy h GLU 85 N 0.66 0.99 -0.35 6.66 4.81 -1.46 0.41 114.58 126.30 1udy h GLU 85 Ca 0.20 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1udy h GLU 85 Cb -0.04 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1udy h GLU 85 CO -0.06 0.66 0.00 0.93 -0.73 0.00 0.00 179.01 179.80 1udy h GLU 86 N 1.02 0.62 -0.20 1.92 4.39 -1.56 -2.24 114.58 118.54 1udy h GLU 86 Ca 0.40 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 1udy h GLU 86 Cb 0.20 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1udy h GLU 86 CO -0.18 0.73 0.09 -0.07 -1.16 0.00 0.00 179.01 178.42 1udy h LEU 87 N 0.43 0.26 -1.79 1.33 4.07 -0.67 -2.73 115.31 116.21 1udy h LEU 87 Ca 0.10 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1udy h LEU 87 Cb 0.45 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 1udy h LEU 87 CO 0.02 0.31 0.15 0.00 -1.08 0.00 0.00 178.44 177.84 1udy h ALA 88 N 0.95 1.85 -0.73 1.53 0.00 -0.15 -0.81 119.26 121.91 1udy h ALA 88 Ca 0.07 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1udy h ALA 88 Cb 0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1udy h ALA 88 CO -0.01 0.14 0.48 -0.92 0.00 0.00 0.00 179.25 178.94 1udy h TYR 89 N 0.29 0.58 0.18 0.00 5.03 -1.07 -2.73 116.97 119.25 1udy h TYR 89 Ca 0.08 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 1udy h TYR 89 Cb -0.02 -0.19 0.00 0.00 1.55 0.00 0.00 36.73 38.07 1udy h TYR 89 CO -0.00 0.25 -0.09 0.78 -1.32 0.00 0.00 178.16 177.79 1udy h GLY 90 N 0.53 -0.25 -5.42 1.82 0.00 -1.18 -3.45 103.07 95.12 1udy h GLY 90 Ca 0.35 0.09 0.11 0.00 0.00 0.00 0.00 47.33 47.87 1udy h GLY 90 CO -0.12 -0.09 -0.10 0.00 0.00 0.00 0.00 176.54 176.23 1udy n THR 92 N 5.38 1.08 -0.02 0.00 -2.24 -1.21 -0.92 114.28 116.34 1udy n THR 92 Ca -0.08 0.27 -0.13 0.00 -2.27 0.00 0.00 64.05 61.84 1udy n THR 92 Cb 0.50 -1.08 -0.10 0.00 -2.10 0.00 0.00 70.33 67.55 1udy n THR 92 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1udy h GLY 93 N 1.93 -0.05 0.75 3.38 0.00 -1.91 -1.41 103.07 105.75 1udy h GLY 93 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1udy h GLY 93 CO 0.00 -0.02 -0.09 -2.08 0.00 0.00 0.00 176.54 174.35 1udy h VAL 94 N -0.74 0.92 -0.77 4.60 2.07 -1.72 -3.08 116.25 117.53 1udy h VAL 94 Ca -0.00 -0.52 0.13 0.00 0.82 0.00 0.00 66.70 67.12 1udy h VAL 94 Cb 0.65 1.23 -0.09 0.00 -1.52 0.00 0.00 31.29 31.56 1udy h VAL 94 CO 0.01 0.12 0.35 -0.61 0.02 0.00 0.00 177.57 177.45 1udy h GLN 95 N -0.50 0.51 0.00 1.57 -0.00 -1.12 0.31 115.11 115.87 1udy h GLN 95 Ca -0.02 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.56 1udy h GLN 95 Cb 0.38 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 27.74 1udy h GLN 95 CO 0.04 0.34 -0.15 1.15 0.00 0.00 0.00 178.83 180.20 1udy h THR 96 N 0.52 0.66 -0.13 2.39 2.02 -1.27 0.30 112.91 117.41 1udy h THR 96 Ca 0.41 -0.66 -0.18 0.00 0.77 0.00 0.00 66.41 66.76 1udy h THR 96 Cb 0.57 1.41 0.01 0.00 -1.74 0.00 0.00 68.15 68.40 1udy h THR 96 CO -0.36 0.15 -0.61 0.00 0.37 0.00 0.00 175.52 175.07 1udy h ALA 97 N 1.85 0.24 0.05 6.16 0.00 -0.86 -2.46 119.26 124.24 1udy h ALA 97 Ca -0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1udy h ALA 97 Cb 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1udy h ALA 97 CO 0.02 0.50 -0.02 0.82 0.00 0.00 0.00 179.25 180.57 1udy h ILE 98 N 0.30 1.25 0.00 0.00 2.04 -0.87 -3.18 117.51 117.05 1udy h ILE 98 Ca -0.04 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.79 1udy h ILE 98 Cb 1.25 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 1udy h ILE 98 CO 0.13 0.26 0.00 1.21 0.00 0.00 0.00 178.15 179.74 1udy n GLU 99 N -4.90 0.13 0.16 2.37 4.07 0.10 -1.99 120.64 120.58 1udy n GLU 99 Ca -0.08 0.44 0.01 0.00 -0.06 0.00 0.00 57.16 57.47 1udy n GLU 99 Cb 0.24 -1.79 0.26 0.00 -0.06 0.00 0.00 31.44 30.09 1udy n GLU 99 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1udy h ALA 100 N 2.23 1.09 -0.65 4.31 0.00 -1.41 -2.72 119.26 122.10 1udy h ALA 100 Ca 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1udy h ALA 100 Cb 0.23 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1udy h ALA 100 CO 0.00 0.62 0.31 -0.91 0.00 0.00 0.00 179.25 179.27 1udy h ASN 101 N 0.00 0.86 -0.52 0.00 4.21 -1.52 -1.56 115.58 117.05 1udy h ASN 101 Ca -0.00 -0.14 -0.02 0.00 1.21 0.00 0.00 56.30 57.35 1udy h ASN 101 Cb 0.93 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.89 1udy h ASN 101 CO 0.06 0.76 0.25 0.74 -1.29 0.00 0.00 177.43 177.95 1udy h THR 102 N 0.91 1.20 -0.75 2.81 2.02 -1.63 -1.28 112.91 116.18 1udy h THR 102 Ca 0.22 -0.55 0.03 0.00 0.77 0.00 0.00 66.41 66.89 1udy h THR 102 Cb 0.13 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 1udy h THR 102 CO -0.03 0.22 0.47 0.25 0.37 0.00 0.00 175.52 176.81 1udy h LEU 103 N 0.70 0.77 -0.60 2.58 5.85 -1.15 -1.54 115.31 121.92 1udy h LEU 103 Ca 0.18 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1udy h LEU 103 Cb 0.12 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1udy h LEU 103 CO -0.02 0.53 -0.20 1.23 -0.34 0.00 0.00 178.44 179.63 1udy h GLY 104 N 0.92 0.00 1.49 3.75 0.00 -1.05 -3.31 103.07 104.87 1udy h GLY 104 Ca 0.31 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.37 1udy h GLY 104 CO -0.12 0.00 -1.35 1.46 0.00 0.00 0.00 176.54 176.53 1udy h GLN 105 N 0.00 0.12 -0.83 4.80 4.20 -0.57 -3.38 115.11 119.45 1udy h GLN 105 Ca -0.00 -0.20 0.16 0.00 0.06 0.00 0.00 58.65 58.66 1udy h GLN 105 Cb 0.94 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 28.69 1udy h GLN 105 CO 0.03 0.97 0.39 0.28 -0.67 0.00 0.00 178.83 179.82 1udy h VAL 106 N 0.03 0.67 -0.36 -0.54 2.07 -1.39 -1.66 116.25 115.07 1udy h VAL 106 Ca -0.16 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.27 1udy h VAL 106 Cb 1.93 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1udy h VAL 106 CO 0.14 0.10 0.26 -0.65 0.02 0.00 0.00 177.57 177.43 1udy h PRO 107 N 0.53 0.05 0.01 1.57 0.11 -1.77 -1.07 132.00 131.43 1udy h PRO 107 Ca 0.46 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.57 1udy h PRO 107 Cb 0.71 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1udy h PRO 107 CO -0.40 0.03 -0.00 -0.07 -0.21 0.00 0.00 178.00 177.35 1udy h LEU 108 N 0.05 -0.01 -1.26 2.35 4.07 -1.56 -0.61 115.31 118.34 1udy h LEU 108 Ca 0.17 -0.84 0.21 0.00 0.08 0.00 0.00 57.88 57.50 1udy h LEU 108 Cb 0.61 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 42.27 1udy h LEU 108 CO -0.01 0.87 0.62 0.40 -1.08 0.00 0.00 178.44 179.24 1udy h ILE 109 N -0.92 0.65 -0.01 1.22 2.04 -1.00 0.34 117.51 119.83 1udy h ILE 109 Ca -0.00 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1udy h ILE 109 Cb 0.85 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1udy h ILE 109 CO 0.00 0.10 -0.37 2.30 0.00 0.00 0.00 178.15 180.18 1udy n ILE 110 N -4.65 0.00 -0.21 -0.67 -5.35 -0.46 -4.68 119.36 103.34 1udy n ILE 110 Ca 0.23 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 1udy n ILE 110 Cb 0.69 1.10 0.00 0.00 -1.74 0.00 0.00 39.64 39.69 1udy n ILE 110 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1udy n GLY 111 N 1.10 0.24 3.82 3.28 0.00 -0.24 -5.07 105.19 108.33 1udy n GLY 111 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 1udy n GLY 111 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1udy s GLY 112 N -0.29 2.06 0.84 -0.02 0.00 0.12 -3.03 107.32 106.99 1udy s GLY 112 Ca 0.00 -1.87 -0.08 0.00 0.00 0.00 0.00 44.72 42.78 1udy s GLY 112 CO 0.00 -1.72 1.15 0.54 0.00 0.00 0.00 173.10 173.07 1udy s ASN 113 N -4.01 3.73 0.15 1.64 2.20 -1.26 -4.89 114.94 112.51 1udy s ASN 113 Ca 0.43 -0.11 -0.17 0.00 -0.94 0.00 0.00 52.86 52.08 1udy s ASN 113 Cb -0.02 -0.09 0.04 0.00 -2.00 0.00 0.00 41.25 39.18 1udy s ASN 113 CO 0.26 -2.30 1.75 0.22 -2.94 0.00 0.00 177.10 174.09 1udy h TYR 114 N -1.06 0.20 0.22 1.54 3.20 -1.98 -2.39 116.97 116.70 1udy h TYR 114 Ca -0.40 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.50 1udy h TYR 114 Cb 1.25 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 1udy h TYR 114 CO -0.68 0.09 -0.25 1.96 -1.64 0.00 0.00 178.16 177.64 1udy h GLN 115 N 0.26 -0.49 -0.94 1.82 7.50 -1.99 -0.10 115.11 121.16 1udy h GLN 115 Ca 0.15 0.03 0.09 0.00 0.50 0.00 0.00 58.65 59.43 1udy h GLN 115 Cb 0.13 0.11 -0.07 0.00 0.05 0.00 0.00 27.48 27.69 1udy h GLN 115 CO -0.16 -0.33 0.58 1.96 -1.50 0.00 0.00 178.83 179.39 1udy h GLN 116 N -0.51 0.96 0.00 1.46 4.20 -1.89 -1.01 115.11 118.31 1udy h GLN 116 Ca 0.00 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 1udy h GLN 116 Cb 0.49 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1udy h GLN 116 CO -0.08 0.63 -0.29 1.96 -0.67 0.00 0.00 178.83 180.39 1udy h GLN 117 N 0.99 0.00 -0.02 1.46 4.20 -1.02 -2.59 115.11 118.12 1udy h GLN 117 Ca 0.44 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.12 1udy h GLN 117 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1udy h GLN 117 CO -0.23 0.29 -0.10 -0.22 -0.67 0.00 0.00 178.83 177.90 1udy h LYS 118 N 0.00 0.11 0.35 1.46 3.11 0.22 -2.78 116.57 119.04 1udy h LYS 118 Ca -0.00 -0.09 -0.02 0.00 -2.81 0.00 0.00 60.65 57.73 1udy h LYS 118 Cb 0.83 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.09 1udy h LYS 118 CO 0.04 0.75 -0.17 -0.22 -2.81 0.00 0.00 179.45 177.04 1udy h LYS 119 N -0.51 -0.45 0.19 1.90 3.64 -1.24 -2.15 116.57 117.95 1udy h LYS 119 Ca -0.01 0.03 -0.31 0.00 -1.27 0.00 0.00 60.65 59.09 1udy h LYS 119 Cb 0.77 0.10 0.02 0.00 -0.41 0.00 0.00 32.23 32.72 1udy h LYS 119 CO 0.02 -0.30 -1.38 1.88 -2.27 0.00 0.00 179.45 177.40 1udy h TYR 120 N -0.48 0.74 0.01 1.91 0.05 -1.65 -3.20 116.97 114.35 1udy h TYR 120 Ca -0.05 -0.54 -0.20 0.00 0.05 0.00 0.00 58.73 57.99 1udy h TYR 120 Cb 0.36 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 1udy h TYR 120 CO 0.14 1.43 -0.93 1.25 -1.05 0.00 0.00 178.16 179.01 1udy h LEU 121 N 0.11 0.11 -0.13 3.88 5.85 -1.66 -3.33 115.31 120.14 1udy h LEU 121 Ca -0.20 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1udy h LEU 121 Cb 2.08 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 43.07 1udy h LEU 121 CO 0.24 0.98 0.05 1.23 -0.34 0.00 0.00 178.44 180.59 1udy h GLY 122 N 2.35 0.21 2.00 3.75 0.00 -1.12 -3.11 103.07 107.15 1udy h GLY 122 Ca -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1udy h GLY 122 CO 0.13 0.11 0.00 0.07 0.00 0.00 0.00 176.54 176.85 1udy h ARG 123 N 0.05 0.00 0.00 4.80 0.11 -1.66 -1.86 114.38 115.82 1udy h ARG 123 Ca 0.04 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.09 1udy h ARG 123 Cb 0.19 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.26 1udy h ARG 123 CO -0.00 0.00 -0.16 0.52 0.10 0.00 0.00 179.97 180.43 1udy h MET 124 N 0.00 0.00 0.00 0.08 2.86 -1.67 -0.42 114.93 115.78 1udy h MET 124 Ca 0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1udy h MET 124 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1udy h MET 124 CO 0.00 0.16 -0.98 1.79 1.06 0.00 0.00 176.91 178.94 1udy h THR 125 N 0.00 0.33 0.06 2.22 1.35 -1.46 -3.38 112.91 112.03 1udy h THR 125 Ca -0.00 -1.57 -0.24 0.00 -0.55 0.00 0.00 66.41 64.05 1udy h THR 125 Cb 0.77 1.90 -0.02 0.00 -1.73 0.00 0.00 68.15 69.08 1udy h THR 125 CO 0.02 0.19 -1.28 -0.33 -0.25 0.00 0.00 175.52 173.87 1udy h GLU 126 N 0.00 0.12 -5.78 4.72 5.08 -1.53 -3.48 114.58 113.71 1udy h GLU 126 Ca -0.06 -0.21 -0.54 0.00 -1.00 0.00 0.00 59.36 57.54 1udy h GLU 126 Cb 1.29 0.08 -0.27 0.00 0.50 0.00 0.00 28.75 30.34 1udy h GLU 126 CO 0.03 1.10 -0.83 -1.21 -1.00 0.00 0.00 179.01 177.10 1udy s GLU 127 N -2.41 1.34 0.00 2.33 0.41 -0.18 -5.03 118.70 115.15 1udy s GLU 127 Ca -0.24 -0.77 0.00 0.00 -0.41 0.00 0.00 54.97 53.55 1udy s GLU 127 Cb 0.04 -1.36 0.00 0.00 -1.78 0.00 0.00 34.13 31.03 1udy s GLU 127 CO 0.69 0.36 0.22 -2.30 -0.49 0.00 0.00 175.26 173.73 1udy n PRO 128 N 2.22 0.13 -0.44 0.39 -0.02 -1.26 -4.33 135.00 131.68 1udy n PRO 128 Ca -0.16 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.01 1udy n PRO 128 Cb 0.54 -1.43 0.29 0.00 -0.02 0.00 0.00 33.50 32.87 1udy n PRO 128 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1udy s LEU 129 N 0.00 -0.99 0.04 2.45 2.01 -1.26 -4.98 118.68 115.95 1udy s LEU 129 Ca 0.00 0.80 -0.00 0.00 0.01 0.00 0.00 54.13 54.94 1udy s LEU 129 Cb 0.00 -2.24 -0.03 0.00 0.01 0.00 0.00 46.19 43.93 1udy s LEU 129 CO 0.00 -5.30 -0.03 -0.04 1.01 0.00 0.00 176.35 171.99 1udy s MET 130 N -5.14 0.50 0.36 1.70 -1.94 -1.26 -5.01 119.30 108.51 1udy s MET 130 Ca 0.69 -0.95 0.05 0.00 -1.71 0.00 0.00 55.69 53.76 1udy s MET 130 Cb -0.12 0.12 -0.03 0.00 2.01 0.00 0.00 34.83 36.81 1udy s MET 130 CO 0.57 -0.07 0.18 0.00 -0.01 0.00 0.00 175.02 175.69 1udy s ALA 132 N -3.37 -0.13 -0.28 0.00 0.00 -1.05 -4.54 121.76 112.38 1udy s ALA 132 Ca 0.32 -0.72 -0.04 0.00 0.00 0.00 0.00 51.96 51.52 1udy s ALA 132 Cb 0.03 0.63 0.03 0.00 0.00 0.00 0.00 23.12 23.80 1udy s ALA 132 CO 0.19 -0.56 0.02 -0.47 0.00 0.00 0.00 175.76 174.94 1udy s TYR 133 N -3.90 3.15 -0.60 0.00 5.04 -1.26 -1.04 117.35 118.74 1udy s TYR 133 Ca 0.10 -1.40 -0.04 0.00 -2.44 0.00 0.00 57.07 53.29 1udy s TYR 133 Cb 0.04 -2.16 0.16 0.00 0.35 0.00 0.00 41.96 40.35 1udy s TYR 133 CO -0.07 -0.69 0.42 0.00 -1.34 0.00 0.00 175.55 173.87 1udy n VAL 135 N 3.75 0.66 -1.76 0.00 0.31 -1.26 -2.39 118.33 117.63 1udy n VAL 135 Ca 0.06 0.18 -0.42 0.00 -0.01 0.00 0.00 64.34 64.15 1udy n VAL 135 Cb 0.39 -1.58 -0.02 0.00 -0.91 0.00 0.00 33.84 31.72 1udy n VAL 135 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1udy s THR 136 N -2.04 2.06 0.49 2.52 2.01 -1.26 -4.90 115.64 114.51 1udy s THR 136 Ca -0.02 0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.08 1udy s THR 136 Cb 0.01 -3.03 -0.00 0.00 0.01 0.00 0.00 72.50 69.48 1udy s THR 136 CO 0.03 0.01 0.26 -1.61 -0.69 0.00 0.00 174.62 172.61 1udy s GLU 137 N 0.01 2.25 0.40 4.92 2.02 -0.85 -0.68 118.70 126.77 1udy s GLU 137 Ca 0.67 -2.01 0.18 0.00 0.02 0.00 0.00 54.97 53.83 1udy s GLU 137 Cb -0.48 -1.97 0.85 0.00 0.10 0.00 0.00 34.13 32.62 1udy s GLU 137 CO 0.43 -0.39 1.84 -1.00 0.02 0.00 0.00 175.26 176.17 1udy h PRO 138 N 1.09 0.00 -0.02 0.39 0.13 -1.88 -3.21 132.00 128.51 1udy h PRO 138 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1udy h PRO 138 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1udy h PRO 138 CO 0.64 0.33 -0.18 0.41 -0.23 0.00 0.00 178.00 178.97 1udy n GLY 139 N -0.28 0.42 3.17 1.56 0.00 -1.26 -4.91 105.19 103.89 1udy n GLY 139 Ca -0.01 -0.60 -0.02 0.00 0.00 0.00 0.00 46.02 45.39 1udy n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1udy s ALA 140 N -1.98 -1.78 0.02 4.61 0.00 -1.21 -5.00 121.76 116.42 1udy s ALA 140 Ca 0.21 1.62 -0.00 0.00 0.00 0.00 0.00 51.96 53.79 1udy s ALA 140 Cb 0.17 -1.88 -0.00 0.00 0.00 0.00 0.00 23.12 21.41 1udy s ALA 140 CO 0.37 -1.19 -0.01 0.41 0.00 0.00 0.00 175.76 175.35 1udy n GLY 141 N 5.41 0.03 0.29 0.00 0.00 -1.26 -2.01 105.19 107.65 1udy n GLY 141 Ca -0.04 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.09 1udy n GLY 141 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1udy h SER 142 N -0.02 0.00 -3.20 1.61 0.02 -1.97 -3.25 113.55 106.74 1udy h SER 142 Ca 0.00 0.00 -0.75 0.00 -0.84 0.00 0.00 61.79 60.20 1udy h SER 142 Cb 0.02 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 62.24 1udy h SER 142 CO 0.00 0.00 0.27 -0.67 -1.14 0.00 0.00 176.83 175.29 1udy n ASP 143 N -4.22 5.17 -0.08 3.07 -0.08 -1.26 -4.90 116.55 114.25 1udy n ASP 143 Ca -0.02 -3.20 0.19 0.00 -1.51 0.00 0.00 54.79 50.26 1udy n ASP 143 Cb 0.14 -1.18 0.63 0.00 2.34 0.00 0.00 41.12 43.05 1udy n ASP 143 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1udy h VAL 144 N 3.67 0.73 0.00 5.18 -1.51 -1.87 0.53 116.25 122.99 1udy h VAL 144 Ca 0.18 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.60 1udy h VAL 144 Cb 0.77 0.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1udy h VAL 144 CO 1.03 0.03 0.00 0.00 -1.23 0.00 0.00 177.57 177.40 1udy n ALA 145 N -2.61 2.27 -0.02 5.19 0.00 -1.26 -2.40 120.51 121.69 1udy n ALA 145 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1udy n ALA 145 Cb 0.62 -1.33 -0.13 0.00 0.00 0.00 0.00 19.45 18.62 1udy n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1udy n GLY 146 N 0.30 -1.09 3.39 0.00 0.00 0.18 -4.98 105.19 103.00 1udy n GLY 146 Ca 0.15 -0.29 -0.45 0.00 0.00 0.00 0.00 46.02 45.43 1udy n GLY 146 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1udy n ILE 147 N -2.68 1.56 0.10 -0.61 -5.35 -1.01 -4.91 119.36 106.46 1udy n ILE 147 Ca -0.15 -0.50 0.02 0.00 -0.27 0.00 0.00 62.75 61.85 1udy n ILE 147 Cb 0.86 -0.15 0.02 0.00 -1.74 0.00 0.00 39.64 38.62 1udy n ILE 147 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 1udy n LYS 148 N 1.03 -0.04 -2.14 6.28 0.00 -1.26 -4.78 118.16 117.25 1udy n LYS 148 Ca 0.14 -0.83 -0.42 0.00 -0.00 0.00 0.00 58.31 57.20 1udy n LYS 148 Cb 0.32 -1.06 -0.03 0.00 -0.00 0.00 0.00 35.03 34.26 1udy n LYS 148 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1udy s THR 149 N -0.37 3.71 0.46 0.58 -1.32 -1.26 -4.88 115.64 112.55 1udy s THR 149 Ca 0.04 0.96 -0.02 0.00 -1.21 0.00 0.00 61.69 61.46 1udy s THR 149 Cb 0.03 -3.62 -0.02 0.00 -1.51 0.00 0.00 72.50 67.38 1udy s THR 149 CO 0.04 -0.05 0.71 -0.75 -2.21 0.00 0.00 174.62 172.35 1udy s LYS 150 N 3.34 3.28 -0.03 7.08 2.47 -0.17 -1.37 119.74 134.34 1udy s LYS 150 Ca 0.67 -0.18 0.01 0.00 -1.56 0.00 0.00 55.97 54.91 1udy s LYS 150 Cb -0.31 -2.49 0.02 0.00 -1.46 0.00 0.00 37.83 33.59 1udy s LYS 150 CO 0.26 -0.22 -0.04 0.00 0.16 0.00 0.00 175.35 175.52 1udy s ALA 151 N -2.62 0.57 -0.05 3.13 0.00 -1.01 -1.85 121.76 119.93 1udy s ALA 151 Ca 0.47 -0.03 0.04 0.00 0.00 0.00 0.00 51.96 52.45 1udy s ALA 151 Cb -0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.66 1udy s ALA 151 CO 0.41 0.00 -0.18 -1.21 0.00 0.00 0.00 175.76 174.78 1udy s GLU 152 N 0.78 1.91 -0.46 0.00 2.02 0.13 -4.63 118.70 118.45 1udy s GLU 152 Ca -0.10 -0.65 -0.27 0.00 0.02 0.00 0.00 54.97 53.98 1udy s GLU 152 Cb -0.13 -1.64 0.03 0.00 0.10 0.00 0.00 34.13 32.49 1udy s GLU 152 CO -0.00 0.25 0.99 0.21 0.02 0.00 0.00 175.26 176.73 1udy s LYS 153 N 0.05 3.60 -0.64 1.61 2.47 -1.26 0.23 119.74 125.81 1udy s LYS 153 Ca -0.05 0.30 0.05 0.00 -1.56 0.00 0.00 55.97 54.71 1udy s LYS 153 Cb -0.12 -3.92 0.15 0.00 -1.46 0.00 0.00 37.83 32.49 1udy s LYS 153 CO 0.03 -1.27 0.41 0.21 0.16 0.00 0.00 175.35 174.89 1udy s LYS 154 N 3.97 2.28 7.75 4.03 2.20 0.67 -4.97 119.74 135.66 1udy s LYS 154 Ca 0.41 -3.08 0.00 0.00 -0.36 0.00 0.00 55.97 52.94 1udy s LYS 154 Cb -0.09 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 1udy s LYS 154 CO 0.28 -1.22 0.00 0.41 -0.36 0.00 0.00 175.35 174.46 1udy n GLY 155 N 2.39 2.20 2.22 5.54 0.00 -1.26 -2.99 105.19 113.28 1udy n GLY 155 Ca 0.14 -0.44 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 1udy n GLY 155 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1udy n ASP 156 N 8.69 5.12 -4.04 1.61 10.43 -1.26 -4.94 116.55 132.15 1udy n ASP 156 Ca 0.00 -3.60 -0.10 0.00 2.57 0.00 0.00 54.79 53.66 1udy n ASP 156 Cb 0.00 -0.88 -0.07 0.00 1.84 0.00 0.00 41.12 42.01 1udy n ASP 156 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1udy s GLU 157 N -3.33 1.34 -0.08 -1.24 2.12 -1.16 -3.07 118.70 113.28 1udy s GLU 157 Ca 0.57 -1.33 0.02 0.00 0.36 0.00 0.00 54.97 54.59 1udy s GLU 157 Cb 0.47 0.39 0.02 0.00 0.26 0.00 0.00 34.13 35.26 1udy s GLU 157 CO 0.06 -0.51 -0.12 0.71 -0.54 0.00 0.00 175.26 174.86 1udy s TYR 158 N -4.04 1.57 -0.32 5.30 1.51 0.95 -0.24 117.35 122.07 1udy s TYR 158 Ca 0.25 -0.65 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 1udy s TYR 158 Cb 0.03 -1.17 -0.02 0.00 -0.11 0.00 0.00 41.96 40.69 1udy s TYR 158 CO 0.07 -0.35 0.34 0.42 -1.11 0.00 0.00 175.55 174.92 1udy s ILE 159 N 0.89 5.19 -0.13 2.71 -1.09 0.64 -1.04 121.20 128.37 1udy s ILE 159 Ca -0.10 0.14 -0.05 0.00 -2.23 0.00 0.00 60.65 58.42 1udy s ILE 159 Cb -0.15 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 1udy s ILE 159 CO 0.01 -0.01 0.04 -0.63 -1.23 0.00 0.00 174.94 173.11 1udy s ILE 160 N 1.99 4.61 -0.05 2.92 1.01 0.19 0.19 121.20 132.05 1udy s ILE 160 Ca 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 1udy s ILE 160 Cb -0.16 -3.01 0.03 0.00 0.01 0.00 0.00 42.46 39.33 1udy s ILE 160 CO 0.11 0.55 0.12 0.20 0.00 0.00 0.00 174.94 175.92 1udy s ASN 161 N -0.35 -0.08 0.00 3.58 0.01 -0.77 -1.91 114.94 115.43 1udy s ASN 161 Ca 0.08 0.24 0.00 0.00 -0.71 0.00 0.00 52.86 52.47 1udy s ASN 161 Cb -0.12 0.14 0.00 0.00 0.41 0.00 0.00 41.25 41.68 1udy s ASN 161 CO 0.02 -0.13 0.00 0.61 -1.51 0.00 0.00 177.10 176.09 1udy n GLY 162 N 4.03 -0.33 3.07 0.66 0.00 -0.68 -1.00 105.19 110.94 1udy n GLY 162 Ca -0.25 -1.52 -0.16 0.00 0.00 0.00 0.00 46.02 44.09 1udy n GLY 162 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1udy s GLN 163 N -1.69 0.65 0.09 1.61 -2.07 -1.26 0.29 119.66 117.28 1udy s GLN 163 Ca 0.00 -0.66 0.08 0.00 -1.82 0.00 0.00 55.36 52.96 1udy s GLN 163 Cb 0.00 -0.55 -0.04 0.00 -1.09 0.00 0.00 33.01 31.33 1udy s GLN 163 CO 0.00 0.13 -0.18 0.15 -1.32 0.00 0.00 175.29 174.07 1udy s LYS 164 N -1.17 1.89 0.08 9.60 -0.14 0.86 -4.38 119.74 126.48 1udy s LYS 164 Ca -0.04 -1.11 0.05 0.00 -1.36 0.00 0.00 55.97 53.52 1udy s LYS 164 Cb -0.08 -2.14 -0.03 0.00 -1.68 0.00 0.00 37.83 33.90 1udy s LYS 164 CO 0.01 0.50 -0.13 1.41 -0.76 0.00 0.00 175.35 176.37 1udy s MET 165 N -1.89 0.85 -0.99 1.68 -2.45 0.14 -0.71 119.30 115.95 1udy s MET 165 Ca 0.17 -1.03 -0.02 0.00 -1.25 0.00 0.00 55.69 53.56 1udy s MET 165 Cb -0.11 -0.79 -0.02 0.00 1.25 0.00 0.00 34.83 35.17 1udy s MET 165 CO 0.08 0.16 0.83 0.91 1.05 0.00 0.00 175.02 178.06 1udy n TRP 166 N 1.05 -1.95 -3.54 4.11 7.02 -1.25 -4.52 117.44 118.36 1udy n TRP 166 Ca -0.20 0.78 -0.39 0.00 -1.02 0.00 0.00 57.50 56.67 1udy n TRP 166 Cb 0.55 -4.41 -0.11 0.00 -2.42 0.00 0.00 31.31 24.92 1udy n TRP 166 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1udy s ILE 167 N -3.32 5.29 0.45 -0.99 -1.09 -0.74 -4.83 121.20 115.97 1udy s ILE 167 Ca 0.12 -0.03 -0.24 0.00 -2.23 0.00 0.00 60.65 58.28 1udy s ILE 167 Cb -0.02 -3.65 -0.08 0.00 -1.58 0.00 0.00 42.46 37.14 1udy s ILE 167 CO 0.63 0.09 1.23 -0.89 -1.23 0.00 0.00 174.94 174.77 1udy s THR 168 N 1.76 2.85 -1.66 2.92 2.01 -1.26 -1.44 115.64 120.83 1udy s THR 168 Ca 0.07 0.68 0.00 0.00 0.31 0.00 0.00 61.69 62.75 1udy s THR 168 Cb -0.17 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1udy s THR 168 CO 0.11 0.03 0.00 0.59 -0.69 0.00 0.00 174.62 174.66 1udy n ASN 169 N -0.30 -4.24 -0.25 3.53 5.03 0.18 -4.57 115.26 114.64 1udy n ASN 169 Ca 0.06 0.37 0.09 0.00 0.87 0.00 0.00 54.58 55.97 1udy n ASN 169 Cb 0.46 -3.83 0.34 0.00 -1.02 0.00 0.00 39.78 35.73 1udy n ASN 169 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1udy h GLY 170 N 0.00 1.15 -1.27 7.41 0.00 -1.33 -2.21 103.07 106.82 1udy h GLY 170 Ca -0.33 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 1udy h GLY 170 CO 0.48 0.17 -0.09 0.61 0.00 0.00 0.00 176.54 177.71 1udy n GLY 171 N -1.43 4.66 0.00 4.60 0.00 -1.26 -4.47 105.19 107.29 1udy n GLY 171 Ca 0.15 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1udy n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1udy n LYS 172 N -1.01 -0.32 -2.85 1.61 4.76 -1.01 -5.09 118.16 114.26 1udy n LYS 172 Ca 0.23 -0.19 -0.36 0.00 -2.87 0.00 0.00 58.31 55.13 1udy n LYS 172 Cb 0.85 -0.68 -0.07 0.00 -1.84 0.00 0.00 35.03 33.29 1udy n LYS 172 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1udy s ALA 173 N -0.01 3.20 -0.05 7.82 0.00 -0.86 -4.39 121.76 127.47 1udy s ALA 173 Ca 0.00 0.43 -0.18 0.00 0.00 0.00 0.00 51.96 52.20 1udy s ALA 173 Cb 0.00 -3.11 -0.31 0.00 0.00 0.00 0.00 23.12 19.70 1udy s ALA 173 CO 0.00 0.19 0.81 -0.97 0.00 0.00 0.00 175.76 175.79 1udy h ASN 174 N 2.85 0.52 -5.28 0.00 -0.73 -0.05 -3.43 115.58 109.47 1udy h ASN 174 Ca -0.47 -0.92 -0.13 0.00 1.87 0.00 0.00 56.30 56.65 1udy h ASN 174 Cb 1.19 -0.17 -0.14 0.00 0.27 0.00 0.00 38.32 39.47 1udy h ASN 174 CO 0.64 1.54 -0.48 -1.66 -0.37 0.00 0.00 177.43 177.10 1udy s TRP 175 N -2.48 0.50 0.09 0.67 1.48 -1.26 -1.80 118.94 116.14 1udy s TRP 175 Ca -0.15 -0.91 0.06 0.00 -1.06 0.00 0.00 56.10 54.05 1udy s TRP 175 Cb 0.03 -0.23 -0.03 0.00 -1.16 0.00 0.00 33.47 32.07 1udy s TRP 175 CO 0.84 -0.57 -0.16 0.71 -4.06 0.00 0.00 176.95 173.71 1udy s TYR 176 N -3.96 1.39 -0.18 1.66 2.02 0.27 -2.53 117.35 116.03 1udy s TYR 176 Ca 0.15 -0.47 -0.11 0.00 -0.37 0.00 0.00 57.07 56.27 1udy s TYR 176 Cb 0.06 -0.76 -0.05 0.00 -0.40 0.00 0.00 41.96 40.80 1udy s TYR 176 CO -0.04 0.11 0.19 0.12 -1.57 0.00 0.00 175.55 174.37 1udy s PHE 177 N -1.46 3.45 -0.01 2.71 5.36 -0.21 -0.37 117.98 127.46 1udy s PHE 177 Ca 0.03 0.44 0.04 0.00 -0.96 0.00 0.00 56.93 56.48 1udy s PHE 177 Cb -0.09 -2.20 -0.01 0.00 -0.34 0.00 0.00 43.02 40.38 1udy s PHE 177 CO 0.03 0.32 -0.14 -1.17 -1.46 0.00 0.00 175.22 172.80 1udy s LEU 178 N 0.24 2.04 -0.19 6.12 2.96 -0.29 -0.45 118.68 129.11 1udy s LEU 178 Ca 0.12 -0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 53.74 1udy s LEU 178 Cb -0.12 -0.70 -0.01 0.00 0.50 0.00 0.00 46.19 45.86 1udy s LEU 178 CO 0.01 0.16 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.89 1udy s LEU 179 N -0.38 2.79 -0.00 -0.68 2.96 -1.00 -0.23 118.68 122.13 1udy s LEU 179 Ca 0.05 -0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1udy s LEU 179 Cb -0.05 -1.68 -0.00 0.00 0.50 0.00 0.00 46.19 44.96 1udy s LEU 179 CO -0.00 0.05 0.00 0.00 -1.32 0.00 0.00 176.35 175.08 1udy s ALA 180 N 1.06 -0.01 0.02 5.97 0.00 -0.92 -4.86 121.76 123.02 1udy s ALA 180 Ca 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.66 1udy s ALA 180 Cb -0.15 -0.00 -0.07 0.00 0.00 0.00 0.00 23.12 22.90 1udy s ALA 180 CO -0.01 -0.01 1.66 0.50 0.00 0.00 0.00 175.76 177.90 1udy s ARG 181 N -0.03 4.19 -0.00 0.00 3.52 -0.47 -1.71 118.95 124.44 1udy s ARG 181 Ca -0.00 2.27 0.21 0.00 -0.13 0.00 0.00 55.73 58.07 1udy s ARG 181 Cb -0.00 -3.78 -0.24 0.00 -1.56 0.00 0.00 34.95 29.36 1udy s ARG 181 CO -0.00 -0.78 0.82 -1.13 -0.81 0.00 0.00 175.30 173.40 1udy n SER 182 N 6.30 0.85 -4.15 -2.12 3.41 0.12 -2.41 113.62 115.61 1udy n SER 182 Ca 0.16 -0.85 -0.33 0.00 -0.26 0.00 0.00 58.87 57.59 1udy n SER 182 Cb 0.42 1.14 -0.15 0.00 -0.26 0.00 0.00 64.21 65.36 1udy n SER 182 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1udy s ASP 183 N -3.18 3.86 0.30 4.04 2.15 -1.02 -4.88 116.67 117.95 1udy s ASP 183 Ca 0.06 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.20 1udy s ASP 183 Cb 0.15 -1.57 0.46 0.00 -0.30 0.00 0.00 42.92 41.66 1udy s ASP 183 CO 0.86 -0.08 1.84 1.55 -0.17 0.00 0.00 175.17 179.17 1udy h PRO 184 N 7.95 0.75 -6.02 4.34 0.13 -1.91 -3.44 132.00 133.80 1udy h PRO 184 Ca -0.36 -0.15 -0.81 0.00 -0.87 0.00 0.00 66.00 63.81 1udy h PRO 184 Cb 1.11 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1udy h PRO 184 CO 0.58 0.69 0.99 -3.47 -0.23 0.00 0.00 178.00 176.56 1udy n ASP 185 N -4.28 1.27 0.27 1.44 -0.08 -1.26 -4.76 116.55 109.15 1udy n ASP 185 Ca 0.03 0.94 0.15 0.00 -1.51 0.00 0.00 54.79 54.41 1udy n ASP 185 Cb 0.23 -0.95 0.70 0.00 2.34 0.00 0.00 41.12 43.44 1udy n ASP 185 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1udy h PRO 186 N 7.20 0.00 -0.02 -0.67 0.13 -2.04 -2.31 132.00 134.29 1udy h PRO 186 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1udy h PRO 186 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1udy h PRO 186 CO 1.02 0.08 0.00 1.63 -0.23 0.00 0.00 178.00 180.50 1udy n LYS 187 N -3.27 1.34 -2.52 0.86 4.01 -1.26 -4.90 118.16 112.41 1udy n LYS 187 Ca -0.00 -0.49 -0.41 0.00 -0.51 0.00 0.00 58.31 56.90 1udy n LYS 187 Cb 0.30 -1.47 -0.04 0.00 -0.51 0.00 0.00 35.03 33.30 1udy n LYS 187 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1udy s ALA 188 N -1.99 3.38 0.63 7.82 0.00 -0.87 -5.00 121.76 125.73 1udy s ALA 188 Ca 0.41 0.82 -0.19 0.00 0.00 0.00 0.00 51.96 53.01 1udy s ALA 188 Cb 0.21 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 1udy s ALA 188 CO 0.34 -0.16 1.24 -2.30 0.00 0.00 0.00 175.76 174.88 1udy n PRO 189 N 1.98 1.14 0.14 0.00 -0.02 -1.26 -4.76 135.00 132.22 1udy n PRO 189 Ca 0.01 0.44 0.03 0.00 -2.02 0.00 0.00 63.50 61.97 1udy n PRO 189 Cb 0.46 -2.47 0.42 0.00 -0.02 0.00 0.00 33.50 31.89 1udy n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1udy h ALA 190 N 0.63 1.58 0.00 3.55 0.00 -1.97 -0.45 119.26 122.58 1udy h ALA 190 Ca -0.50 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1udy h ALA 190 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1udy h ALA 190 CO 0.53 0.31 0.00 0.66 0.00 0.00 0.00 179.25 180.75 1udy h SER 191 N 0.18 0.00 0.00 0.00 4.64 -1.90 -3.14 113.55 113.34 1udy h SER 191 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1udy h SER 191 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1udy h SER 191 CO 0.02 0.00 -0.33 1.17 -0.87 0.00 0.00 176.83 176.82 1udy n LYS 192 N -2.93 4.91 0.00 4.77 4.81 -0.79 -4.51 118.16 124.42 1udy n LYS 192 Ca -0.00 -0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 1udy n LYS 192 Cb 0.23 -0.75 0.45 0.00 0.02 0.00 0.00 35.03 34.97 1udy n LYS 192 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1udy n ALA 193 N -1.17 2.90 -2.42 3.14 0.00 -0.25 -4.47 120.51 118.24 1udy n ALA 193 Ca 0.01 -0.40 -0.22 0.00 0.00 0.00 0.00 53.44 52.83 1udy n ALA 193 Cb 0.07 -1.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.25 1udy n ALA 193 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1udy s PHE 194 N -2.35 2.05 -0.02 0.00 0.08 -1.26 0.12 117.98 116.60 1udy s PHE 194 Ca 0.29 -0.44 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 1udy s PHE 194 Cb 0.20 -0.92 0.01 0.00 -0.57 0.00 0.00 43.02 41.74 1udy s PHE 194 CO 0.46 0.56 0.03 0.99 -0.10 0.00 0.00 175.22 177.16 1udy s THR 195 N -2.72 -0.02 -0.18 0.64 2.01 -0.70 -1.26 115.64 113.41 1udy s THR 195 Ca 0.27 0.07 -0.09 0.00 0.31 0.00 0.00 61.69 62.24 1udy s THR 195 Cb -0.03 -0.07 -0.05 0.00 0.01 0.00 0.00 72.50 72.37 1udy s THR 195 CO 0.12 0.03 0.14 -0.83 -0.69 0.00 0.00 174.62 173.38 1udy s GLY 196 N 0.35 2.07 0.44 4.40 0.00 -1.26 -2.17 107.32 111.15 1udy s GLY 196 Ca -0.03 -0.68 0.06 0.00 0.00 0.00 0.00 44.72 44.07 1udy s GLY 196 CO -0.01 0.04 0.05 -1.36 0.00 0.00 0.00 173.10 171.82 1udy s PHE 197 N 0.08 2.36 -0.22 1.90 0.40 0.68 -1.26 117.98 121.92 1udy s PHE 197 Ca 0.10 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 1udy s PHE 197 Cb -0.11 -1.77 0.05 0.00 0.51 0.00 0.00 43.02 41.70 1udy s PHE 197 CO -0.01 0.34 -0.06 -1.50 0.70 0.00 0.00 175.22 174.69 1udy s ILE 198 N -2.73 1.46 -0.16 0.64 1.10 -0.84 -1.13 121.20 119.53 1udy s ILE 198 Ca 0.29 -1.07 -0.01 0.00 -0.51 0.00 0.00 60.65 59.35 1udy s ILE 198 Cb 0.07 -1.68 -0.01 0.00 0.15 0.00 0.00 42.46 40.99 1udy s ILE 198 CO 0.15 -0.02 -0.12 -0.69 -2.11 0.00 0.00 174.94 172.16 1udy s VAL 199 N 1.45 3.00 0.05 4.00 1.01 0.50 -4.86 120.40 125.55 1udy s VAL 199 Ca -0.04 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 60.99 1udy s VAL 199 Cb -0.18 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1udy s VAL 199 CO -0.07 0.50 0.94 -1.61 0.00 0.00 0.00 175.10 174.86 1udy s GLU 200 N 0.80 4.61 0.28 2.72 2.02 -1.26 0.94 118.70 128.81 1udy s GLU 200 Ca -0.04 1.39 0.01 0.00 0.02 0.00 0.00 54.97 56.35 1udy s GLU 200 Cb -0.15 -3.42 0.57 0.00 0.10 0.00 0.00 34.13 31.23 1udy s GLU 200 CO 0.01 0.10 1.81 0.00 0.02 0.00 0.00 175.26 177.20 1udy h ALA 201 N 6.17 1.47 0.00 5.21 0.00 -1.62 -2.64 119.26 127.84 1udy h ALA 201 Ca -0.42 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1udy h ALA 201 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1udy h ALA 201 CO 0.73 0.12 0.00 -0.40 0.00 0.00 0.00 179.25 179.70 1udy n ASP 202 N -4.70 0.36 -4.77 0.00 5.68 -1.26 -4.79 116.55 107.07 1udy n ASP 202 Ca 0.19 0.58 -0.41 0.00 -0.50 0.00 0.00 54.79 54.65 1udy n ASP 202 Cb 0.40 -0.66 -0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1udy n ASP 202 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1udy n THR 203 N -1.89 1.94 -1.86 2.12 -2.24 -1.00 -4.90 114.28 106.44 1udy n THR 203 Ca 0.03 -0.48 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 1udy n THR 203 Cb 0.22 -1.98 -0.03 0.00 -2.10 0.00 0.00 70.33 66.44 1udy n THR 203 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1udy s PRO 204 N -2.01 4.18 0.00 -0.78 0.04 -1.26 -3.40 135.00 131.78 1udy s PRO 204 Ca 0.54 2.45 0.00 0.00 0.04 0.00 0.00 61.00 64.03 1udy s PRO 204 Cb -0.48 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1udy s PRO 204 CO 0.63 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 177.42 1udy n GLY 205 N 3.82 1.74 3.43 0.56 0.00 -1.26 -4.58 105.19 108.90 1udy n GLY 205 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 1udy n GLY 205 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1udy s VAL 206 N -2.02 4.82 -0.53 1.61 -7.23 -1.22 -1.16 120.40 114.66 1udy s VAL 206 Ca 0.00 -0.57 -0.19 0.00 -1.81 0.00 0.00 61.98 59.41 1udy s VAL 206 Cb 0.00 -4.37 0.07 0.00 0.56 0.00 0.00 36.38 32.64 1udy s VAL 206 CO 0.00 -0.92 0.66 -1.10 -0.31 0.00 0.00 175.10 173.42 1udy s GLN 207 N 2.77 3.11 0.04 4.82 -1.52 -0.28 -4.96 119.66 123.64 1udy s GLN 207 Ca 0.15 -0.97 -0.30 0.00 -1.95 0.00 0.00 55.36 52.29 1udy s GLN 207 Cb -0.20 -4.14 -0.04 0.00 -0.22 0.00 0.00 33.01 28.41 1udy s GLN 207 CO 0.11 -1.31 0.96 0.42 -0.25 0.00 0.00 175.29 175.22 1udy s ILE 208 N 2.70 4.73 0.15 1.08 1.01 -1.26 -1.15 121.20 128.44 1udy s ILE 208 Ca 0.15 2.04 -0.02 0.00 0.00 0.00 0.00 60.65 62.81 1udy s ILE 208 Cb -0.20 -4.31 0.03 0.00 0.01 0.00 0.00 42.46 37.99 1udy s ILE 208 CO 0.11 0.23 0.20 0.61 0.00 0.00 0.00 174.94 176.09 1udy n GLY 209 N 2.63 -1.20 3.85 6.18 0.00 0.17 -4.99 105.19 111.83 1udy n GLY 209 Ca 0.04 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1udy n GLY 209 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1udy s ARG 210 N -3.43 2.82 0.01 1.61 1.70 -1.26 -4.76 118.95 115.63 1udy s ARG 210 Ca 0.11 0.65 -0.30 0.00 -0.47 0.00 0.00 55.73 55.72 1udy s ARG 210 Cb -0.00 -2.00 -0.04 0.00 -0.57 0.00 0.00 34.95 32.34 1udy s ARG 210 CO 0.08 -1.11 1.13 0.21 -1.08 0.00 0.00 175.30 174.53 1udy s LYS 211 N -5.21 4.45 0.25 3.89 2.20 -1.26 -4.16 119.74 119.89 1udy s LYS 211 Ca 0.58 1.63 -0.24 0.00 -0.36 0.00 0.00 55.97 57.59 1udy s LYS 211 Cb -0.12 -3.44 -0.09 0.00 -1.51 0.00 0.00 37.83 32.67 1udy s LYS 211 CO 0.53 -0.25 0.83 -1.21 -0.36 0.00 0.00 175.35 174.89 1udy s GLU 212 N 1.37 4.47 -0.22 4.03 0.41 -0.73 -5.03 118.70 123.02 1udy s GLU 212 Ca 0.56 1.13 -0.12 0.00 -0.41 0.00 0.00 54.97 56.12 1udy s GLU 212 Cb -0.25 -2.96 -0.05 0.00 -1.78 0.00 0.00 34.13 29.09 1udy s GLU 212 CO 0.26 0.40 0.23 0.42 -0.49 0.00 0.00 175.26 176.08 1udy s ILE 213 N -1.45 5.32 0.24 -1.63 -1.09 -1.26 -4.79 121.20 116.54 1udy s ILE 213 Ca 0.44 0.34 0.07 0.00 -2.23 0.00 0.00 60.65 59.28 1udy s ILE 213 Cb -0.19 -3.57 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 1udy s ILE 213 CO 0.24 0.33 -0.11 0.20 -1.23 0.00 0.00 174.94 174.37 1udy s ASN 214 N 0.94 2.72 0.35 3.58 0.02 -1.26 -5.05 114.94 116.24 1udy s ASN 214 Ca 0.11 -1.10 0.06 0.00 -1.02 0.00 0.00 52.86 50.92 1udy s ASN 214 Cb -0.14 -0.16 0.66 0.00 0.02 0.00 0.00 41.25 41.63 1udy s ASN 214 CO 0.05 -0.23 1.87 -0.03 0.02 0.00 0.00 177.10 178.77 1udy h MET 215 N 2.42 0.39 -4.97 -0.60 1.85 -1.98 -3.44 114.93 108.59 1udy h MET 215 Ca -0.39 -0.09 -0.43 0.00 -0.61 0.00 0.00 59.70 58.18 1udy h MET 215 Cb 1.23 -0.05 -0.14 0.00 0.43 0.00 0.00 31.60 33.07 1udy h MET 215 CO 0.64 0.49 -0.58 0.20 -0.40 0.00 0.00 176.91 177.27 1udy s GLY 216 N -3.96 2.05 -1.56 1.39 0.00 -1.25 -4.72 107.32 99.26 1udy s GLY 216 Ca -0.06 -1.76 -0.10 0.00 0.00 0.00 0.00 44.72 42.80 1udy s GLY 216 CO 0.75 -1.67 0.61 -1.06 0.00 0.00 0.00 173.10 171.74 1udy n GLN 217 N -0.62 -3.31 0.26 2.90 6.02 -1.26 -4.84 117.38 116.54 1udy n GLN 217 Ca -0.01 0.39 0.13 0.00 -0.01 0.00 0.00 57.00 57.50 1udy n GLN 217 Cb 0.66 -4.82 0.80 0.00 1.02 0.00 0.00 30.24 27.89 1udy n GLN 217 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1udy h ARG 218 N -1.70 0.00 -0.01 -1.09 3.08 -1.85 -2.62 114.38 110.19 1udy h ARG 218 Ca -0.61 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.44 1udy h ARG 218 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.43 1udy h ARG 218 CO 0.70 0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 179.59 1udy s SER 220 N -2.07 7.08 -0.30 0.00 0.15 -0.99 -4.19 113.70 113.39 1udy s SER 220 Ca 0.41 1.29 -0.28 0.00 0.70 0.00 0.00 55.95 58.06 1udy s SER 220 Cb 0.21 -2.38 0.01 0.00 -1.71 0.00 0.00 66.02 62.15 1udy s SER 220 CO 0.37 0.20 1.04 -0.62 1.20 0.00 0.00 173.24 175.43 1udy s ASP 221 N -0.75 6.94 -0.08 5.45 2.15 -1.26 -4.98 116.67 124.13 1udy s ASP 221 Ca 0.31 1.09 -0.03 0.00 0.43 0.00 0.00 52.55 54.35 1udy s ASP 221 Cb -0.20 -2.53 0.04 0.00 -0.30 0.00 0.00 42.92 39.94 1udy s ASP 221 CO 0.20 -0.81 0.09 0.28 -0.17 0.00 0.00 175.17 174.76 1udy s THR 222 N 3.49 -0.15 0.20 1.71 -1.32 -1.26 0.48 115.64 118.80 1udy s THR 222 Ca 0.44 0.26 -0.11 0.00 -1.21 0.00 0.00 61.69 61.07 1udy s THR 222 Cb -0.13 -0.29 -0.00 0.00 -1.51 0.00 0.00 72.50 70.56 1udy s THR 222 CO 0.13 0.06 0.38 0.00 -2.21 0.00 0.00 174.62 172.98 1udy s ARG 223 N 2.19 1.34 0.68 7.08 1.70 -0.95 -1.76 118.95 129.23 1udy s ARG 223 Ca 0.04 -1.18 -0.10 0.00 -0.47 0.00 0.00 55.73 54.02 1udy s ARG 223 Cb -0.13 0.43 0.01 0.00 -0.57 0.00 0.00 34.95 34.69 1udy s ARG 223 CO -0.05 -0.53 1.05 0.20 -1.08 0.00 0.00 175.30 174.89 1udy s GLY 224 N -2.98 1.62 -0.19 3.88 0.00 -1.26 -1.80 107.32 106.60 1udy s GLY 224 Ca 0.19 -0.43 -0.10 0.00 0.00 0.00 0.00 44.72 44.38 1udy s GLY 224 CO 0.04 -0.08 0.45 -0.42 0.00 0.00 0.00 173.10 173.09 1udy s ILE 225 N -3.28 -0.02 -0.02 0.90 1.01 0.12 -0.66 121.20 119.25 1udy s ILE 225 Ca 0.57 0.08 0.01 0.00 0.00 0.00 0.00 60.65 61.31 1udy s ILE 225 Cb -0.11 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 1udy s ILE 225 CO 0.50 0.03 -0.00 -0.69 0.00 0.00 0.00 174.94 174.78 1udy s VAL 226 N 1.40 4.18 -0.30 2.92 1.01 -0.30 -0.10 120.40 129.19 1udy s VAL 226 Ca -0.09 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1udy s VAL 226 Cb -0.08 -2.83 0.06 0.00 0.00 0.00 0.00 36.38 33.53 1udy s VAL 226 CO -0.13 0.43 0.00 -0.36 0.00 0.00 0.00 175.10 175.04 1udy s PHE 227 N -1.04 3.33 -0.33 5.22 0.40 0.15 -1.12 117.98 124.58 1udy s PHE 227 Ca 0.18 -2.08 -0.06 0.00 -0.60 0.00 0.00 56.93 54.37 1udy s PHE 227 Cb -0.11 -2.23 0.04 0.00 0.51 0.00 0.00 43.02 41.22 1udy s PHE 227 CO 0.08 -0.84 0.09 -2.00 0.70 0.00 0.00 175.22 173.25 1udy s GLU 228 N 1.19 2.65 -1.33 0.44 2.12 -0.31 -1.69 118.70 121.77 1udy s GLU 228 Ca -0.04 -1.15 -0.21 0.00 0.36 0.00 0.00 54.97 53.93 1udy s GLU 228 Cb -0.20 -3.43 0.03 0.00 0.26 0.00 0.00 34.13 30.79 1udy s GLU 228 CO -0.03 -0.64 0.46 -0.25 -0.54 0.00 0.00 175.26 174.26 1udy n ASP 229 N 4.80 -2.36 -4.70 -1.70 8.00 -1.18 -4.46 116.55 114.95 1udy n ASP 229 Ca -0.13 -1.26 -0.40 0.00 0.71 0.00 0.00 54.79 53.71 1udy n ASP 229 Cb 0.45 -1.82 -0.05 0.00 -0.02 0.00 0.00 41.12 39.68 1udy n ASP 229 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1udy s VAL 230 N -3.82 5.04 -0.40 2.53 1.01 -0.80 -4.81 120.40 119.14 1udy s VAL 230 Ca 0.31 1.36 -0.12 0.00 0.00 0.00 0.00 61.98 63.53 1udy s VAL 230 Cb -0.17 -4.01 0.04 0.00 0.00 0.00 0.00 36.38 32.24 1udy s VAL 230 CO 0.97 0.21 0.26 -0.13 0.00 0.00 0.00 175.10 176.41 1udy s ARG 231 N 1.11 2.85 -0.10 2.72 0.52 -1.26 -0.64 118.95 124.14 1udy s ARG 231 Ca 0.35 -1.14 -0.02 0.00 -0.52 0.00 0.00 55.73 54.39 1udy s ARG 231 Cb -0.17 -3.84 -0.03 0.00 0.52 0.00 0.00 34.95 31.42 1udy s ARG 231 CO 0.15 -0.78 -0.00 0.54 0.02 0.00 0.00 175.30 175.23 1udy s VAL 232 N 1.58 4.27 0.41 3.52 0.11 -0.21 -4.93 120.40 125.16 1udy s VAL 232 Ca 0.03 -0.25 -0.24 0.00 -2.93 0.00 0.00 61.98 58.59 1udy s VAL 232 Cb -0.20 -2.82 -0.09 0.00 -1.53 0.00 0.00 36.38 31.75 1udy s VAL 232 CO 0.07 0.58 1.06 -2.16 -3.33 0.00 0.00 175.10 171.32 1udy s PRO 233 N -0.60 4.10 0.66 1.54 0.04 -1.26 -0.04 135.00 139.44 1udy s PRO 233 Ca 0.10 1.54 0.34 0.00 0.04 0.00 0.00 61.00 63.01 1udy s PRO 233 Cb -0.12 -2.50 1.85 0.00 0.04 0.00 0.00 34.50 33.77 1udy s PRO 233 CO 0.02 -0.20 2.06 0.87 0.04 0.00 0.00 177.00 179.79 1udy h LYS 234 N 2.40 0.00 0.00 4.56 1.57 -1.87 0.35 116.57 123.57 1udy h LYS 234 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1udy h LYS 234 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1udy h LYS 234 CO 0.62 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.89 1udy n GLU 235 N -3.06 0.05 -0.26 3.15 -0.58 -1.26 -2.11 120.64 116.57 1udy n GLU 235 Ca -0.02 0.38 0.07 0.00 -0.42 0.00 0.00 57.16 57.17 1udy n GLU 235 Cb 0.30 -1.62 0.19 0.00 -0.57 0.00 0.00 31.44 29.74 1udy n GLU 235 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1udy n ASN 236 N -1.73 3.25 -4.72 1.62 5.03 0.12 -4.91 115.26 113.92 1udy n ASN 236 Ca 0.02 -2.20 -0.41 0.00 0.87 0.00 0.00 54.58 52.85 1udy n ASN 236 Cb 0.13 -0.32 -0.04 0.00 -1.02 0.00 0.00 39.78 38.53 1udy n ASN 236 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1udy s VAL 237 N -1.37 4.85 0.00 2.41 1.01 -0.90 -1.98 120.40 124.43 1udy s VAL 237 Ca 0.29 1.87 0.00 0.00 0.00 0.00 0.00 61.98 64.15 1udy s VAL 237 Cb 0.18 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1udy s VAL 237 CO 0.16 0.22 0.59 -0.11 0.00 0.00 0.00 175.10 175.96 1udy n LEU 238 N 3.62 0.00 -0.07 3.92 7.94 -0.39 -4.64 117.00 127.37 1udy n LEU 238 Ca 0.03 0.59 -0.11 0.00 -1.11 0.00 0.00 56.01 55.40 1udy n LEU 238 Cb 0.51 -0.09 -0.07 0.00 0.53 0.00 0.00 43.42 44.31 1udy n LEU 238 CO 0.50 -0.09 -0.99 0.41 -1.11 0.00 0.00 177.39 176.11 1udy n THR 239 N -0.93 0.85 -3.56 1.96 -1.04 -1.17 -4.38 114.28 106.01 1udy n THR 239 Ca 0.00 -0.31 0.03 0.00 -2.04 0.00 0.00 64.05 61.74 1udy n THR 239 Cb 0.00 -1.14 -0.00 0.00 -1.82 0.00 0.00 70.33 67.36 1udy n THR 239 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1udy s GLY 240 N -5.41 -0.47 -0.38 3.41 0.00 -1.26 -5.06 107.32 98.15 1udy s GLY 240 Ca -0.20 1.06 -0.29 0.00 0.00 0.00 0.00 44.72 45.29 1udy s GLY 240 CO 0.33 0.22 1.18 1.85 0.00 0.00 0.00 173.10 176.68 1udy s GLU 241 N -2.02 3.87 0.00 2.90 2.12 -1.26 -3.10 118.70 121.21 1udy s GLU 241 Ca 0.15 0.92 0.00 0.00 0.36 0.00 0.00 54.97 56.40 1udy s GLU 241 Cb 0.07 -3.86 0.00 0.00 0.26 0.00 0.00 34.13 30.60 1udy s GLU 241 CO -0.06 -1.18 0.00 0.41 -0.54 0.00 0.00 175.26 173.88 1udy n GLY 242 N 4.42 1.07 1.74 -1.50 0.00 -0.77 -4.96 105.19 105.18 1udy n GLY 242 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1udy n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1udy n ALA 243 N -0.47 4.92 0.06 4.61 0.00 -1.11 -3.85 120.51 124.67 1udy n ALA 243 Ca 0.00 -2.94 -0.11 0.00 0.00 0.00 0.00 53.44 50.39 1udy n ALA 243 Cb 0.00 -1.12 -0.13 0.00 0.00 0.00 0.00 19.45 18.20 1udy n ALA 243 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1udy h GLY 244 N 1.17 0.13 1.06 0.00 0.00 -1.41 -3.30 103.07 100.72 1udy h GLY 244 Ca 0.42 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 1udy h GLY 244 CO 0.76 0.29 -0.03 -2.75 0.00 0.00 0.00 176.54 174.81 1udy h PHE 245 N 0.03 1.10 -0.52 5.60 3.57 -1.80 -2.95 116.94 121.97 1udy h PHE 245 Ca -0.12 -0.20 -0.12 0.00 3.53 0.00 0.00 57.97 61.06 1udy h PHE 245 Cb 1.89 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.34 1udy h PHE 245 CO 0.03 1.00 -0.16 -0.22 -2.23 0.00 0.00 178.31 176.73 1udy h LYS 246 N 0.89 1.03 -0.75 1.11 3.11 -1.87 -2.20 116.57 117.89 1udy h LYS 246 Ca 0.16 -0.41 0.02 0.00 -2.81 0.00 0.00 60.65 57.61 1udy h LYS 246 Cb 0.58 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.72 1udy h LYS 246 CO 0.03 1.10 0.49 0.82 -2.81 0.00 0.00 179.45 179.08 1udy h ILE 247 N 0.90 1.15 -0.20 2.00 2.04 -1.61 0.13 117.51 121.91 1udy h ILE 247 Ca 0.13 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1udy h ILE 247 Cb 0.74 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1udy h ILE 247 CO 0.06 0.18 -0.04 0.00 0.00 0.00 0.00 178.15 178.34 1udy h ALA 248 N 1.30 0.28 -0.87 1.87 0.00 -1.44 0.20 119.26 120.60 1udy h ALA 248 Ca 0.29 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1udy h ALA 248 Cb -0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1udy h ALA 248 CO -0.09 0.05 0.57 0.52 0.00 0.00 0.00 179.25 180.30 1udy h MET 249 N 0.11 0.94 0.00 0.00 2.86 -1.04 0.13 114.93 117.93 1udy h MET 249 Ca 0.05 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1udy h MET 249 Cb 0.49 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1udy h MET 249 CO 0.02 0.62 -0.52 0.78 1.06 0.00 0.00 176.91 178.87 1udy h GLY 250 N 0.97 0.00 1.58 8.32 0.00 -0.44 -3.08 103.07 110.42 1udy h GLY 250 Ca 0.38 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.55 1udy h GLY 250 CO -0.14 0.00 -0.55 -0.84 0.00 0.00 0.00 176.54 175.01 1udy h THR 251 N 0.00 1.34 -0.42 4.70 2.02 0.10 -3.16 112.91 117.49 1udy h THR 251 Ca -0.01 -1.82 -0.10 0.00 0.77 0.00 0.00 66.41 65.26 1udy h THR 251 Cb 1.00 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 1udy h THR 251 CO 0.07 0.56 -0.11 -0.26 0.37 0.00 0.00 175.52 176.15 1udy h PHE 252 N 0.34 0.92 -0.77 3.16 0.04 -1.24 0.10 116.94 119.49 1udy h PHE 252 Ca 0.01 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.57 1udy h PHE 252 Cb 1.07 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.96 1udy h PHE 252 CO 0.04 0.94 0.46 -0.44 -0.60 0.00 0.00 178.31 178.70 1udy h ASP 253 N 0.64 0.93 0.69 2.17 3.32 -1.59 0.76 116.42 123.34 1udy h ASP 253 Ca 0.11 -0.06 -0.22 0.00 0.02 0.00 0.00 57.03 56.88 1udy h ASP 253 Cb 0.64 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1udy h ASP 253 CO 0.04 0.72 -0.99 0.11 -1.72 0.00 0.00 179.24 177.40 1udy h LYS 254 N 1.07 0.17 0.00 3.56 1.57 -1.49 -3.36 116.57 118.09 1udy h LYS 254 Ca 0.28 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.69 1udy h LYS 254 Cb -0.03 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1udy h LYS 254 CO -0.05 1.02 -1.67 -2.37 -0.57 0.00 0.00 179.45 175.81 1udy n THR 255 N -3.56 0.84 -0.11 -0.16 5.66 0.34 -4.35 114.28 112.94 1udy n THR 255 Ca -0.04 -0.65 -0.01 0.00 -3.05 0.00 0.00 64.05 60.30 1udy n THR 255 Cb 0.89 -0.45 0.24 0.00 -1.55 0.00 0.00 70.33 69.47 1udy n THR 255 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 1udy h ARG 256 N 0.00 0.78 -0.81 1.09 9.65 0.40 -3.05 114.38 122.44 1udy h ARG 256 Ca -0.17 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.58 1udy h ARG 256 Cb 1.47 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 29.87 1udy h ARG 256 CO 0.02 0.65 0.48 -1.35 2.80 0.00 0.00 179.97 182.58 1udy h PRO 257 N 0.77 1.10 -0.51 0.20 0.11 -1.76 -1.92 132.00 130.00 1udy h PRO 257 Ca 0.18 -0.10 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 1udy h PRO 257 Cb 0.18 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 1udy h PRO 257 CO -0.01 0.78 0.00 -1.35 -0.21 0.00 0.00 178.00 177.21 1udy h PRO 258 N 1.11 0.86 -0.43 1.05 0.11 -1.78 0.43 132.00 133.34 1udy h PRO 258 Ca 0.29 -0.24 0.03 0.00 0.11 0.00 0.00 66.00 66.19 1udy h PRO 258 Cb -0.03 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 30.94 1udy h PRO 258 CO -0.05 0.85 0.22 0.28 -0.21 0.00 0.00 178.00 179.09 1udy h VAL 259 N 0.80 0.98 -0.23 3.15 2.07 -1.41 0.40 116.25 122.01 1udy h VAL 259 Ca 0.15 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1udy h VAL 259 Cb 0.47 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1udy h VAL 259 CO 0.02 0.08 0.13 0.00 0.02 0.00 0.00 177.57 177.82 1udy h ALA 260 N 1.22 0.30 -0.20 1.67 0.00 -0.98 0.11 119.26 121.39 1udy h ALA 260 Ca 0.18 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1udy h ALA 260 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1udy h ALA 260 CO -0.12 -0.17 0.19 0.00 0.00 0.00 0.00 179.25 179.14 1udy h ALA 261 N 1.01 1.92 -0.30 0.00 0.00 -0.07 -0.51 119.26 121.31 1udy h ALA 261 Ca 0.08 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1udy h ALA 261 Cb 0.07 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1udy h ALA 261 CO -0.01 -0.29 -0.22 0.78 0.00 0.00 0.00 179.25 179.51 1udy h GLY 262 N 0.00 0.73 1.96 0.00 0.00 0.23 -2.43 103.07 103.56 1udy h GLY 262 Ca 0.09 -0.70 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 1udy h GLY 262 CO -0.00 0.64 -0.38 0.00 0.00 0.00 0.00 176.54 176.80 1udy h ALA 263 N 0.73 1.33 -0.16 3.60 0.00 -0.15 -2.35 119.26 122.26 1udy h ALA 263 Ca 0.06 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1udy h ALA 263 Cb 0.77 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1udy h ALA 263 CO 0.06 0.49 -0.39 0.28 0.00 0.00 0.00 179.25 179.69 1udy h VAL 264 N 0.04 1.30 -0.04 0.00 2.07 -1.18 -0.12 116.25 118.33 1udy h VAL 264 Ca 0.00 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 1udy h VAL 264 Cb 0.69 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1udy h VAL 264 CO 0.05 0.46 0.00 1.23 0.02 0.00 0.00 177.57 179.34 1udy h GLY 265 N 1.15 0.07 0.94 2.17 0.00 -0.93 0.12 103.07 106.59 1udy h GLY 265 Ca 0.03 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.33 1udy h GLY 265 CO 0.07 0.05 0.47 -2.00 0.00 0.00 0.00 176.54 175.12 1udy h LEU 266 N -0.20 0.80 -0.69 3.11 6.46 -1.28 -1.24 115.31 122.26 1udy h LEU 266 Ca 0.01 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1udy h LEU 266 Cb 0.29 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 40.00 1udy h LEU 266 CO 0.00 0.56 0.28 0.00 -0.62 0.00 0.00 178.44 178.67 1udy h ALA 267 N 1.29 0.89 -0.41 1.25 0.00 -0.89 -1.67 119.26 119.71 1udy h ALA 267 Ca 0.28 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1udy h ALA 267 Cb -0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1udy h ALA 267 CO -0.08 0.51 -0.02 0.37 0.00 0.00 0.00 179.25 180.02 1udy h GLN 268 N 0.98 0.68 -0.34 0.00 5.75 -0.45 -1.47 115.11 120.25 1udy h GLN 268 Ca 0.23 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.52 1udy h GLN 268 Cb 0.20 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 1udy h GLN 268 CO -0.02 0.71 0.06 -0.09 -2.65 0.00 0.00 178.83 176.84 1udy h ARG 269 N 0.64 0.56 -0.50 1.69 9.65 -0.82 -2.12 114.38 123.48 1udy h ARG 269 Ca 0.13 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1udy h ARG 269 Cb 0.43 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 1udy h ARG 269 CO 0.02 0.64 0.28 0.00 2.80 0.00 0.00 179.97 183.71 1udy h ALA 270 N 0.90 0.64 -0.83 2.80 0.00 -1.00 -2.09 119.26 119.69 1udy h ALA 270 Ca 0.10 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1udy h ALA 270 Cb 0.35 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1udy h ALA 270 CO 0.01 0.15 0.55 1.25 0.00 0.00 0.00 179.25 181.21 1udy h LEU 271 N 0.67 0.95 -0.20 0.00 5.85 -1.16 -1.91 115.31 119.51 1udy h LEU 271 Ca 0.18 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1udy h LEU 271 Cb 0.03 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 1udy h LEU 271 CO -0.03 0.68 -0.03 0.44 -0.34 0.00 0.00 178.44 179.17 1udy h ASP 272 N 1.12 0.37 0.15 1.25 3.32 -1.10 0.19 116.42 121.72 1udy h ASP 272 Ca 0.30 -0.35 0.01 0.00 0.02 0.00 0.00 57.03 57.02 1udy h ASP 272 Cb -0.13 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1udy h ASP 272 CO -0.07 0.63 -0.22 -0.33 -1.72 0.00 0.00 179.24 177.53 1udy h GLU 273 N 0.11 -0.42 -0.63 3.56 4.39 -1.22 0.38 114.58 120.74 1udy h GLU 273 Ca 0.05 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1udy h GLU 273 Cb 0.46 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 1udy h GLU 273 CO 0.02 -0.28 0.35 0.00 -1.16 0.00 0.00 179.01 177.93 1udy h ALA 274 N 0.32 0.81 -0.75 3.43 0.00 -1.39 -0.93 119.26 120.76 1udy h ALA 274 Ca 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1udy h ALA 274 Cb 0.44 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1udy h ALA 274 CO -0.10 0.33 0.32 1.15 0.00 0.00 0.00 179.25 180.95 1udy h THR 275 N 0.86 1.25 -0.09 0.00 2.02 -0.53 -0.10 112.91 116.32 1udy h THR 275 Ca 0.22 -0.74 -0.16 0.00 0.77 0.00 0.00 66.41 66.50 1udy h THR 275 Cb 0.04 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1udy h THR 275 CO -0.04 0.31 -0.64 0.11 0.37 0.00 0.00 175.52 175.63 1udy h LYS 276 N 1.07 0.34 0.26 6.66 1.57 0.10 -3.16 116.57 123.42 1udy h LYS 276 Ca 0.25 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1udy h LYS 276 Cb 0.17 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1udy h LYS 276 CO -0.03 0.87 -0.13 -0.92 -0.57 0.00 0.00 179.45 178.67 1udy h TYR 277 N 0.25 -0.33 -0.64 -1.35 3.20 -0.83 -3.13 116.97 114.15 1udy h TYR 277 Ca -0.01 -0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.04 1udy h TYR 277 Cb 1.17 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.52 1udy h TYR 277 CO 0.03 0.03 0.73 0.00 -1.64 0.00 0.00 178.16 177.32 1udy h ALA 278 N -0.26 2.42 -0.01 1.82 0.00 -1.09 1.68 119.26 123.83 1udy h ALA 278 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1udy h ALA 278 Cb 0.51 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1udy h ALA 278 CO 0.06 -1.06 -0.29 1.28 0.00 0.00 0.00 179.25 179.24 1udy n LEU 279 N -3.51 0.90 -0.05 0.00 4.32 -1.19 -1.49 117.00 115.99 1udy n LEU 279 Ca 0.13 -0.20 -0.09 0.00 -0.02 0.00 0.00 56.01 55.82 1udy n LEU 279 Cb 0.96 -0.15 -0.03 0.00 -1.62 0.00 0.00 43.42 42.58 1udy n LEU 279 CO 0.26 0.17 -0.63 1.21 -1.22 0.00 0.00 177.39 177.18 1udy n GLU 280 N -0.81 0.32 -1.91 3.23 2.13 0.56 -4.95 120.64 119.21 1udy n GLU 280 Ca 0.11 0.13 -0.41 0.00 0.66 0.00 0.00 57.16 57.65 1udy n GLU 280 Cb 0.34 -1.05 -0.01 0.00 0.27 0.00 0.00 31.44 30.99 1udy n GLU 280 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1udy s ARG 281 N -2.44 4.20 -0.03 5.31 6.06 -0.32 -4.93 118.95 126.80 1udy s ARG 281 Ca -0.19 2.45 0.06 0.00 -2.50 0.00 0.00 55.73 55.55 1udy s ARG 281 Cb 0.05 -3.01 -0.01 0.00 0.06 0.00 0.00 34.95 32.03 1udy s ARG 281 CO 0.26 -0.43 -0.22 0.15 -2.50 0.00 0.00 175.30 172.56 1udy s LYS 282 N -1.71 1.88 -0.09 5.12 1.02 -1.26 -1.98 119.74 122.71 1udy s LYS 282 Ca 0.53 -0.77 -0.07 0.00 0.02 0.00 0.00 55.97 55.67 1udy s LYS 282 Cb -0.44 -1.75 0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1udy s LYS 282 CO 0.57 0.43 0.23 0.95 -0.92 0.00 0.00 175.35 176.61 1udy s THR 283 N -0.39 -0.01 -1.47 2.17 -4.23 -0.01 -4.85 115.64 106.86 1udy s THR 283 Ca 0.05 0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.51 1udy s THR 283 Cb -0.10 -0.33 0.03 0.00 1.34 0.00 0.00 72.50 73.44 1udy s THR 283 CO 0.00 0.01 0.70 0.49 -0.54 0.00 0.00 174.62 175.28 1udy n PHE 284 N 3.14 -2.09 -1.40 3.99 3.72 -1.26 -2.13 117.46 121.43 1udy n PHE 284 Ca -0.14 0.61 -0.09 0.00 -0.05 0.00 0.00 57.45 57.78 1udy n PHE 284 Cb 0.58 -4.20 -0.03 0.00 -0.94 0.00 0.00 39.48 34.88 1udy n PHE 284 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1udy n GLY 285 N -1.53 0.89 3.24 1.37 0.00 -1.26 -5.02 105.19 102.87 1udy n GLY 285 Ca -0.06 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.22 1udy n GLY 285 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udy s LYS 286 N -3.02 0.72 0.71 1.61 1.02 -0.91 -5.14 119.74 114.73 1udy s LYS 286 Ca 0.00 -0.35 -0.15 0.00 0.02 0.00 0.00 55.97 55.50 1udy s LYS 286 Cb 0.00 0.31 0.03 0.00 -0.52 0.00 0.00 37.83 37.65 1udy s LYS 286 CO 0.00 -0.21 1.17 -0.51 -0.92 0.00 0.00 175.35 174.88 1udy s LEU 287 N -1.66 3.32 0.25 3.17 2.01 -1.26 -0.83 118.68 123.68 1udy s LEU 287 Ca -0.10 2.22 -0.03 0.00 0.01 0.00 0.00 54.13 56.22 1udy s LEU 287 Cb -0.03 -4.57 0.43 0.00 0.01 0.00 0.00 46.19 42.02 1udy s LEU 287 CO 0.01 -2.07 1.81 -0.07 1.01 0.00 0.00 176.35 177.04 1udy h LEU 288 N -0.25 0.68 -2.19 1.79 4.07 -0.87 -1.84 115.31 116.70 1udy h LEU 288 Ca -0.47 0.05 0.05 0.00 0.08 0.00 0.00 57.88 57.60 1udy h LEU 288 Cb 1.28 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.93 1udy h LEU 288 CO 0.51 0.37 0.18 0.00 -1.08 0.00 0.00 178.44 178.42 1udy h ALA 289 N 1.48 1.90 -0.01 1.53 0.00 -1.57 -1.34 119.26 121.25 1udy h ALA 289 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1udy h ALA 289 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1udy h ALA 289 CO -0.26 -0.27 0.00 0.39 0.00 0.00 0.00 179.25 179.11 1udy n GLU 290 N -4.00 1.15 -3.34 0.00 1.02 -0.69 -4.35 120.64 110.42 1udy n GLU 290 Ca 0.02 -0.21 -0.42 0.00 -0.02 0.00 0.00 57.16 56.52 1udy n GLU 290 Cb 0.30 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.16 1udy n GLU 290 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1udy s HIS 291 N -1.99 3.18 0.51 -0.32 3.76 -0.50 -4.94 115.29 114.98 1udy s HIS 291 Ca 0.44 -0.23 0.34 0.00 -0.15 0.00 0.00 55.06 55.46 1udy s HIS 291 Cb 0.21 -2.83 1.48 0.00 1.11 0.00 0.00 32.58 32.55 1udy s HIS 291 CO 0.35 -0.61 1.75 0.37 -0.85 0.00 0.00 174.74 175.75 1udy h GLN 292 N 8.63 0.08 -0.51 1.40 4.15 -1.86 0.65 115.11 127.65 1udy h GLN 292 Ca -0.28 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.12 1udy h GLN 292 Cb 1.12 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.77 1udy h GLN 292 CO 0.76 0.05 0.24 0.78 -1.93 0.00 0.00 178.83 178.74 1udy h GLY 293 N 0.09 0.77 1.47 2.39 0.00 -1.92 -1.22 103.07 104.64 1udy h GLY 293 Ca 0.65 -0.35 -0.26 0.00 0.00 0.00 0.00 47.33 47.37 1udy h GLY 293 CO -0.11 0.34 -1.37 -2.22 0.00 0.00 0.00 176.54 173.18 1udy h ILE 294 N 0.72 1.28 0.34 2.60 1.08 0.01 -3.02 117.51 120.53 1udy h ILE 294 Ca 0.18 -3.02 -0.01 0.00 -0.39 0.00 0.00 64.86 61.62 1udy h ILE 294 Cb 0.08 2.69 -0.01 0.00 -3.07 0.00 0.00 36.82 36.51 1udy h ILE 294 CO -0.02 0.78 -0.26 0.28 -0.69 0.00 0.00 178.15 178.23 1udy h SER 295 N 0.02 -0.68 -0.88 1.72 0.02 -0.82 0.13 113.55 113.07 1udy h SER 295 Ca -0.16 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1udy h SER 295 Cb 1.92 0.22 -0.05 0.00 0.14 0.00 0.00 62.40 64.62 1udy h SER 295 CO 0.12 -0.40 0.58 -0.26 -1.14 0.00 0.00 176.83 175.73 1udy h PHE 296 N -0.60 1.07 -0.04 3.45 -1.00 -1.36 0.05 116.94 118.50 1udy h PHE 296 Ca -0.03 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1udy h PHE 296 Cb 0.52 -0.36 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 1udy h PHE 296 CO -0.13 0.63 0.02 1.25 -1.61 0.00 0.00 178.31 178.47 1udy h LEU 297 N 1.11 0.04 -0.57 1.54 5.85 -1.30 -1.70 115.31 120.29 1udy h LEU 297 Ca 0.34 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 1udy h LEU 297 Cb -0.01 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1udy h LEU 297 CO -0.10 0.06 0.33 -0.07 -0.34 0.00 0.00 178.44 178.32 1udy h LEU 298 N 0.02 0.70 -0.75 2.25 4.07 -0.42 -2.66 115.31 118.51 1udy h LEU 298 Ca 0.01 -0.08 0.06 0.00 0.08 0.00 0.00 57.88 57.96 1udy h LEU 298 Cb 0.03 -0.18 -0.06 0.00 1.08 0.00 0.00 40.66 41.53 1udy h LEU 298 CO -0.00 0.57 0.43 0.00 -1.08 0.00 0.00 178.44 178.36 1udy h ALA 299 N 1.16 1.02 -0.29 1.53 0.00 -0.79 -0.54 119.26 121.35 1udy h ALA 299 Ca 0.20 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1udy h ALA 299 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1udy h ALA 299 CO -0.04 0.12 -0.12 -0.44 0.00 0.00 0.00 179.25 178.78 1udy h ASP 300 N 0.78 0.47 0.03 0.00 3.32 -1.02 -0.22 116.42 119.78 1udy h ASP 300 Ca 0.34 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 1udy h ASP 300 Cb 0.21 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1udy h ASP 300 CO -0.19 0.62 -0.01 0.24 -1.72 0.00 0.00 179.24 178.18 1udy h MET 301 N 0.45 -0.03 -0.30 3.56 2.86 -1.02 -1.90 114.93 118.55 1udy h MET 301 Ca 0.08 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.79 1udy h MET 301 Cb 0.48 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.08 1udy h MET 301 CO 0.03 0.37 -0.15 0.00 1.06 0.00 0.00 176.91 178.23 1udy h ALA 302 N 0.51 0.09 -0.35 6.32 0.00 -0.94 -0.93 119.26 123.96 1udy h ALA 302 Ca -0.00 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1udy h ALA 302 Cb 0.42 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 1udy h ALA 302 CO 0.01 -0.54 -0.26 1.98 0.00 0.00 0.00 179.25 180.44 1udy h MET 303 N -0.10 -0.21 -0.49 0.00 -1.53 -0.98 -1.48 114.93 110.13 1udy h MET 303 Ca 0.16 0.01 -0.04 0.00 -3.44 0.00 0.00 59.70 56.39 1udy h MET 303 Cb 0.34 0.05 -0.02 0.00 -0.55 0.00 0.00 31.60 31.41 1udy h MET 303 CO -0.37 -0.14 0.15 0.87 0.14 0.00 0.00 176.91 177.56 1udy h LYS 304 N -0.22 0.73 -0.17 0.39 1.57 -0.74 -2.13 116.57 116.00 1udy h LYS 304 Ca 0.17 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1udy h LYS 304 Cb 0.49 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 1udy h LYS 304 CO -0.47 0.64 -0.14 -0.24 -0.57 0.00 0.00 179.45 178.67 1udy h VAL 305 N 0.71 1.33 -0.22 0.50 3.04 -0.51 -1.31 116.25 119.79 1udy h VAL 305 Ca 0.16 -1.27 0.03 0.00 -1.01 0.00 0.00 66.70 64.61 1udy h VAL 305 Cb 0.22 1.78 -0.03 0.00 -2.01 0.00 0.00 31.29 31.25 1udy h VAL 305 CO -0.01 0.38 0.06 -0.33 -1.01 0.00 0.00 177.57 176.66 1udy h GLU 306 N 0.06 0.14 -0.67 4.17 4.39 -1.14 -0.87 114.58 120.66 1udy h GLU 306 Ca 0.03 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.69 1udy h GLU 306 Cb 0.66 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1udy h GLU 306 CO 0.04 0.10 0.26 -0.07 -1.16 0.00 0.00 179.01 178.17 1udy h LEU 307 N 0.15 0.90 -0.63 1.33 4.07 -1.39 -1.89 115.31 117.85 1udy h LEU 307 Ca 0.10 -0.13 -0.14 0.00 0.08 0.00 0.00 57.88 57.79 1udy h LEU 307 Cb 0.08 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1udy h LEU 307 CO -0.12 0.81 -0.42 0.00 -1.08 0.00 0.00 178.44 177.63 1udy h ALA 308 N 1.32 0.81 -0.55 1.53 0.00 -0.86 -2.50 119.26 119.01 1udy h ALA 308 Ca 0.23 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1udy h ALA 308 Cb 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1udy h ALA 308 CO -0.02 0.65 0.16 -0.09 0.00 0.00 0.00 179.25 179.96 1udy h ARG 309 N 0.49 0.86 -0.81 0.00 2.43 -0.84 -2.76 114.38 113.75 1udy h ARG 309 Ca 0.04 -0.19 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1udy h ARG 309 Cb 0.93 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.32 1udy h ARG 309 CO 0.08 0.79 0.53 -0.07 -1.51 0.00 0.00 179.97 179.80 1udy h LEU 310 N 0.77 0.93 -1.05 3.80 4.07 -1.22 -2.72 115.31 119.89 1udy h LEU 310 Ca 0.18 -0.03 -0.08 0.00 0.08 0.00 0.00 57.88 58.03 1udy h LEU 310 Cb 0.30 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 1udy h LEU 310 CO -0.00 0.68 -0.13 0.77 -1.08 0.00 0.00 178.44 178.67 1udy h SER 311 N 1.10 0.51 0.79 -0.43 4.64 -1.16 -1.96 113.55 117.04 1udy h SER 311 Ca 0.30 -0.14 -0.18 0.00 -0.47 0.00 0.00 61.79 61.30 1udy h SER 311 Cb -0.12 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.81 1udy h SER 311 CO -0.06 0.68 -0.85 0.10 -0.87 0.00 0.00 176.83 175.82 1udy h TYR 312 N 0.48 0.06 -0.65 4.77 -0.00 -1.41 -2.56 116.97 117.65 1udy h TYR 312 Ca 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 58.73 58.72 1udy h TYR 312 Cb 0.52 -0.01 -0.03 0.00 0.00 0.00 0.00 36.73 37.22 1udy h TYR 312 CO 0.02 0.87 0.16 1.96 -0.00 0.00 0.00 178.16 181.17 1udy h GLN 313 N 0.02 1.03 0.00 0.10 4.20 -1.16 -0.02 115.11 119.28 1udy h GLN 313 Ca -0.02 -0.24 -0.09 0.00 0.06 0.00 0.00 58.65 58.37 1udy h GLN 313 Cb 1.50 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.12 1udy h GLN 313 CO 0.11 0.92 -0.41 -0.09 -0.67 0.00 0.00 178.83 178.70 1udy h ARG 314 N 0.98 0.00 0.12 1.46 9.65 -1.27 -1.59 114.38 123.73 1udy h ARG 314 Ca 0.21 0.00 -0.27 0.00 -1.10 0.00 0.00 59.98 58.82 1udy h ARG 314 Cb 0.35 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.93 1udy h ARG 314 CO 0.00 0.41 -1.22 0.00 2.80 0.00 0.00 179.97 181.96 1udy h ALA 315 N 1.59 0.12 -0.17 2.80 0.00 -0.98 -2.90 119.26 119.73 1udy h ALA 315 Ca -0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 54.91 53.98 1udy h ALA 315 Cb 0.75 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1udy h ALA 315 CO 0.05 0.96 -0.10 0.00 0.00 0.00 0.00 179.25 180.16 1udy h ALA 316 N 0.60 0.24 -0.76 0.00 0.00 -0.86 -2.98 119.26 115.49 1udy h ALA 316 Ca -0.13 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1udy h ALA 316 Cb 1.94 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 1udy h ALA 316 CO 0.20 0.07 0.49 2.35 0.00 0.00 0.00 179.25 182.36 1udy h TRP 317 N 0.03 0.92 -0.60 0.00 7.01 -1.39 0.07 115.95 121.99 1udy h TRP 317 Ca 0.03 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.06 1udy h TRP 317 Cb 0.60 -0.31 -0.03 0.00 -2.10 0.00 0.00 29.16 27.32 1udy h TRP 317 CO 0.07 0.55 0.39 1.49 -2.79 0.00 0.00 178.44 178.14 1udy h GLU 318 N 0.97 0.80 0.00 2.65 4.57 -1.50 -0.41 114.58 121.66 1udy h GLU 318 Ca 0.30 -0.06 -0.18 0.00 -1.18 0.00 0.00 59.36 58.24 1udy h GLU 318 Cb -0.03 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.36 1udy h GLU 318 CO -0.10 0.55 -0.86 0.97 -1.18 0.00 0.00 179.01 178.40 1udy h ILE 319 N 0.82 1.59 0.00 2.32 6.09 -1.35 -2.52 117.51 124.46 1udy h ILE 319 Ca 0.22 -2.96 -0.03 0.00 -1.37 0.00 0.00 64.86 60.72 1udy h ILE 319 Cb -0.07 2.61 -0.00 0.00 0.47 0.00 0.00 36.82 39.82 1udy h ILE 319 CO -0.05 0.84 -0.15 0.44 -3.07 0.00 0.00 178.15 176.16 1udy h ASP 320 N 0.00 0.00 -0.37 2.19 3.32 -0.58 -2.40 116.42 118.59 1udy h ASP 320 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1udy h ASP 320 Cb 1.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.09 1udy h ASP 320 CO 0.11 0.15 0.00 -1.20 -1.72 0.00 0.00 179.24 176.58 1udy n SER 321 N -3.35 2.10 -0.07 6.45 7.64 -0.20 -4.91 113.62 121.28 1udy n SER 321 Ca -0.00 -2.04 -0.01 0.00 1.01 0.00 0.00 58.87 57.83 1udy n SER 321 Cb 0.37 -0.28 -0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1udy n SER 321 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1udy n GLY 322 N 1.03 0.48 3.56 0.23 0.00 -0.90 -5.04 105.19 104.54 1udy n GLY 322 Ca 0.13 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 1udy n GLY 322 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1udy s ARG 323 N -1.33 2.48 0.18 1.61 0.52 -0.96 -5.04 118.95 116.41 1udy s ARG 323 Ca 0.00 -0.75 -0.33 0.00 -0.52 0.00 0.00 55.73 54.13 1udy s ARG 323 Cb 0.00 -2.44 -0.13 0.00 0.52 0.00 0.00 34.95 32.90 1udy s ARG 323 CO 0.00 0.60 1.62 -2.13 0.02 0.00 0.00 175.30 175.41 1udy n ARG 324 N 1.70 2.35 -0.44 3.54 0.63 -1.26 -3.80 116.66 119.39 1udy n ARG 324 Ca -0.16 0.85 0.06 0.00 -0.92 0.00 0.00 57.85 57.68 1udy n ARG 324 Cb 0.52 -2.64 0.19 0.00 0.45 0.00 0.00 32.46 30.99 1udy n ARG 324 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1udy n ASN 325 N 3.50 2.29 -0.11 6.15 6.94 -1.26 -4.84 115.26 127.93 1udy n ASN 325 Ca 0.16 -3.51 -0.07 0.00 -0.02 0.00 0.00 54.58 51.14 1udy n ASN 325 Cb 0.31 -0.52 -0.01 0.00 -2.36 0.00 0.00 39.78 37.20 1udy n ASN 325 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 1udy h THR 326 N 0.74 0.25 -0.32 5.53 2.02 -1.91 0.08 112.91 119.31 1udy h THR 326 Ca 0.04 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.29 1udy h THR 326 Cb 1.16 0.25 -0.08 0.00 -1.74 0.00 0.00 68.15 67.75 1udy h THR 326 CO 0.09 0.00 -0.21 0.22 0.37 0.00 0.00 175.52 175.99 1udy h TYR 327 N -0.24 -0.54 -0.15 3.16 3.20 -1.93 -2.13 116.97 118.34 1udy h TYR 327 Ca 0.17 0.04 -0.16 0.00 3.14 0.00 0.00 58.73 61.93 1udy h TYR 327 Cb 0.53 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.08 1udy h TYR 327 CO -0.52 -0.29 -0.57 1.88 -1.64 0.00 0.00 178.16 177.03 1udy h TYR 328 N -0.18 0.59 0.01 -3.82 0.05 -1.85 -2.91 116.97 108.87 1udy h TYR 328 Ca 0.16 -0.21 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1udy h TYR 328 Cb 0.43 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1udy h TYR 328 CO -0.41 0.92 -0.00 0.00 -1.05 0.00 0.00 178.16 177.62 1udy h ALA 329 N 1.03 -0.01 -0.82 3.88 0.00 -0.77 -2.02 119.26 120.55 1udy h ALA 329 Ca 0.00 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1udy h ALA 329 Cb 1.10 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1udy h ALA 329 CO 0.10 -0.44 0.52 0.77 0.00 0.00 0.00 179.25 180.20 1udy h SER 330 N -0.14 0.85 -0.24 0.00 0.02 -1.42 -0.66 113.55 111.95 1udy h SER 330 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1udy h SER 330 Cb 0.14 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1udy h SER 330 CO 0.00 0.58 0.13 0.40 -1.14 0.00 0.00 176.83 176.81 1udy h ILE 331 N 1.00 1.11 -0.33 3.27 2.04 -1.40 0.06 117.51 123.26 1udy h ILE 331 Ca 0.33 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 1udy h ILE 331 Cb 0.04 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1udy h ILE 331 CO -0.13 0.11 0.15 0.00 0.00 0.00 0.00 178.15 178.28 1udy h ALA 332 N 1.02 0.43 -0.28 1.87 0.00 -0.99 -0.74 119.26 120.57 1udy h ALA 332 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1udy h ALA 332 Cb 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1udy h ALA 332 CO -0.01 0.02 0.11 -0.22 0.00 0.00 0.00 179.25 179.14 1udy h LYS 333 N 0.40 0.42 0.16 0.00 3.11 -1.03 -0.59 116.57 119.03 1udy h LYS 333 Ca 0.11 -0.08 -0.01 0.00 -2.81 0.00 0.00 60.65 57.87 1udy h LYS 333 Cb 0.16 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.32 1udy h LYS 333 CO -0.01 0.45 -0.08 0.00 -2.81 0.00 0.00 179.45 177.01 1udy h ALA 334 N 0.95 -0.21 -0.03 5.00 0.00 -0.89 -2.35 119.26 121.73 1udy h ALA 334 Ca 0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1udy h ALA 334 Cb 0.19 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1udy h ALA 334 CO -0.01 -0.58 0.00 -0.92 0.00 0.00 0.00 179.25 177.75 1udy h TYR 335 N -0.29 0.05 -0.99 0.00 3.20 -1.11 -2.12 116.97 115.72 1udy h TYR 335 Ca -0.02 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.93 1udy h TYR 335 Cb 0.22 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 38.41 1udy h TYR 335 CO -0.04 0.30 0.63 0.00 -1.64 0.00 0.00 178.16 177.41 1udy h ALA 336 N 0.74 1.43 -0.17 1.82 0.00 -1.15 -0.88 119.26 121.05 1udy h ALA 336 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1udy h ALA 336 Cb 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1udy h ALA 336 CO 0.00 0.31 0.05 0.00 0.00 0.00 0.00 179.25 179.61 1udy h ALA 337 N 1.49 0.23 -0.77 0.00 0.00 -1.32 0.10 119.26 118.98 1udy h ALA 337 Ca 0.46 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1udy h ALA 337 Cb 0.33 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1udy h ALA 337 CO -0.22 -0.14 0.31 -0.44 0.00 0.00 0.00 179.25 178.75 1udy h ASP 338 N 0.09 1.06 1.48 0.00 3.45 -0.72 -2.67 116.42 119.12 1udy h ASP 338 Ca 0.05 -0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.34 1udy h ASP 338 Cb 0.25 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 38.74 1udy h ASP 338 CO -0.00 0.94 -0.34 0.16 -1.57 0.00 0.00 179.24 178.43 1udy h ILE 339 N 1.11 0.00 -0.01 0.35 -0.00 -1.14 -2.65 117.51 115.18 1udy h ILE 339 Ca 0.26 -0.82 -0.13 0.00 -0.00 0.00 0.00 64.86 64.16 1udy h ILE 339 Cb 0.21 1.63 -0.02 0.00 -0.00 0.00 0.00 36.82 38.65 1udy h ILE 339 CO -0.02 0.00 -0.61 0.00 -0.00 0.00 0.00 178.15 177.52 1udy h ALA 340 N 2.18 0.96 0.08 0.16 0.00 -0.77 -1.78 119.26 120.10 1udy h ALA 340 Ca 0.00 -0.56 -0.26 0.00 0.00 0.00 0.00 54.91 54.09 1udy h ALA 340 Cb 0.91 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.62 1udy h ALA 340 CO 0.00 0.76 -1.13 -0.91 0.00 0.00 0.00 179.25 177.97 1udy h ASN 341 N 0.03 0.59 -0.52 0.00 4.21 -1.43 -3.03 115.58 115.44 1udy h ASN 341 Ca -0.01 -0.54 -0.09 0.00 1.21 0.00 0.00 56.30 56.87 1udy h ASN 341 Cb 1.09 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 38.08 1udy h ASN 341 CO 0.08 1.37 -0.03 1.56 -1.29 0.00 0.00 177.43 179.13 1udy h GLN 342 N 0.19 0.97 0.00 0.81 4.20 -1.33 -3.02 115.11 116.92 1udy h GLN 342 Ca -0.13 -0.30 -0.10 0.00 0.06 0.00 0.00 58.65 58.18 1udy h GLN 342 Cb 1.81 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.48 1udy h GLN 342 CO 0.20 0.97 -0.46 -0.07 -0.67 0.00 0.00 178.83 178.80 1udy h LEU 343 N 0.88 0.00 0.14 1.46 4.07 -1.40 -2.93 115.31 117.53 1udy h LEU 343 Ca 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.11 1udy h LEU 343 Cb 0.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.30 1udy h LEU 343 CO 0.03 0.46 -0.07 0.00 -1.08 0.00 0.00 178.44 177.78 1udy h ALA 344 N 1.54 -0.19 0.00 1.53 0.00 -1.41 0.22 119.26 120.96 1udy h ALA 344 Ca -0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1udy h ALA 344 Cb 1.20 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1udy h ALA 344 CO 0.06 -0.45 -0.26 0.00 0.00 0.00 0.00 179.25 178.60 1udy h THR 345 N -0.50 0.76 0.00 0.00 1.03 -1.63 -1.26 112.91 111.31 1udy h THR 345 Ca -0.02 -1.08 -0.19 0.00 -0.01 0.00 0.00 66.41 65.11 1udy h THR 345 Cb 0.39 1.67 -0.03 0.00 -1.07 0.00 0.00 68.15 69.12 1udy h THR 345 CO 0.03 0.25 -0.96 0.44 -0.01 0.00 0.00 175.52 175.28 1udy h ASP 346 N 0.00 0.00 -0.19 0.00 3.32 -1.46 -1.98 116.42 116.12 1udy h ASP 346 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1udy h ASP 346 Cb 0.65 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 1udy h ASP 346 CO 0.03 0.83 -0.31 0.00 -1.72 0.00 0.00 179.24 178.07 1udy h ALA 347 N 1.17 0.29 -0.88 3.45 0.00 -0.44 -2.29 119.26 120.56 1udy h ALA 347 Ca -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1udy h ALA 347 Cb 1.67 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 1udy h ALA 347 CO 0.10 0.32 0.46 0.28 0.00 0.00 0.00 179.25 180.40 1udy h VAL 348 N 0.20 1.26 -0.91 0.00 2.07 -1.30 -2.76 116.25 114.81 1udy h VAL 348 Ca 0.01 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1udy h VAL 348 Cb 0.90 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 1udy h VAL 348 CO 0.07 0.30 0.59 -0.61 0.02 0.00 0.00 177.57 177.94 1udy h GLN 349 N 1.24 0.95 0.00 1.57 5.75 -1.10 -1.93 115.11 121.59 1udy h GLN 349 Ca 0.31 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.74 1udy h GLN 349 Cb 0.07 -0.21 -0.00 0.00 1.07 0.00 0.00 27.48 28.40 1udy h GLN 349 CO -0.04 0.63 -0.03 -0.39 -2.65 0.00 0.00 178.83 176.34 1udy h VAL 350 N 0.98 0.06 0.00 2.39 -1.51 -1.12 -2.80 116.25 114.25 1udy h VAL 350 Ca 0.40 -0.98 -0.14 0.00 -1.23 0.00 0.00 66.70 64.75 1udy h VAL 350 Cb 0.28 1.93 -0.02 0.00 -2.13 0.00 0.00 31.29 31.35 1udy h VAL 350 CO -0.16 0.03 -0.67 -0.26 -1.23 0.00 0.00 177.57 175.28 1udy h PHE 351 N 0.00 0.00 0.00 5.19 -1.00 -1.29 -3.47 116.94 116.37 1udy h PHE 351 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1udy h PHE 351 Cb 0.92 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.48 1udy h PHE 351 CO 0.00 0.67 0.00 0.41 -1.61 0.00 0.00 178.31 177.78 1udy n GLY 352 N 0.95 1.80 0.41 -1.45 0.00 -0.90 -3.63 105.19 102.37 1udy n GLY 352 Ca 0.00 -0.45 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 1udy n GLY 352 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1udy h GLY 353 N 0.00 -0.94 -0.14 -0.02 0.00 -1.91 -2.30 103.07 97.76 1udy h GLY 353 Ca 0.00 0.45 0.26 0.00 0.00 0.00 0.00 47.33 48.04 1udy h GLY 353 CO 0.00 -0.32 0.66 3.43 0.00 0.00 0.00 176.54 180.30 1udy h ASN 354 N -0.82 0.49 -0.66 0.19 2.35 -1.94 0.42 115.58 115.62 1udy h ASN 354 Ca -0.04 0.09 0.10 0.00 -0.55 0.00 0.00 56.30 55.91 1udy h ASN 354 Cb 0.72 0.02 -0.04 0.00 0.05 0.00 0.00 38.32 39.07 1udy h ASN 354 CO -0.05 0.09 0.44 1.23 -1.65 0.00 0.00 177.43 177.49 1udy h GLY 355 N 0.43 0.70 1.48 2.83 0.00 -1.53 1.00 103.07 107.98 1udy h GLY 355 Ca 0.61 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1udy h GLY 355 CO -0.33 0.12 -0.07 0.33 0.00 0.00 0.00 176.54 176.59 1udy n PHE 356 N -4.48 0.00 -3.50 5.60 7.35 0.14 -3.57 117.46 119.00 1udy n PHE 356 Ca 0.11 0.00 -0.36 0.00 -0.76 0.00 0.00 57.45 56.44 1udy n PHE 356 Cb 0.37 -0.32 -0.06 0.00 0.35 0.00 0.00 39.48 39.83 1udy n PHE 356 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1udy s ASN 357 N -2.70 6.73 0.00 -2.13 3.04 0.35 -4.98 114.94 115.25 1udy s ASN 357 Ca 0.23 0.91 0.17 0.00 0.04 0.00 0.00 52.86 54.21 1udy s ASN 357 Cb 0.20 -2.22 1.02 0.00 -1.54 0.00 0.00 41.25 38.71 1udy s ASN 357 CO 0.50 0.19 1.53 0.35 -3.04 0.00 0.00 177.10 176.63 1udy n THR 358 N 1.10 0.00 1.00 -5.21 -2.24 -1.26 -2.41 114.28 105.27 1udy n THR 358 Ca -0.09 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.82 1udy n THR 358 Cb 0.52 -0.44 0.30 0.00 -2.10 0.00 0.00 70.33 68.61 1udy n THR 358 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1udy n GLU 359 N -0.84 0.01 -4.85 -0.78 4.07 -1.26 -4.80 120.64 112.19 1udy n GLU 359 Ca 0.13 -0.01 -0.33 0.00 -0.06 0.00 0.00 57.16 56.89 1udy n GLU 359 Cb 0.06 -1.50 -0.13 0.00 -0.06 0.00 0.00 31.44 29.81 1udy n GLU 359 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1udy s TYR 360 N -2.99 2.74 -0.64 4.31 1.51 -1.01 -5.04 117.35 116.22 1udy s TYR 360 Ca 0.12 -0.18 0.06 0.00 -1.01 0.00 0.00 57.07 56.06 1udy s TYR 360 Cb 0.18 -1.66 0.33 0.00 -0.11 0.00 0.00 41.96 40.70 1udy s TYR 360 CO 0.68 0.17 1.14 -0.35 -1.11 0.00 0.00 175.55 176.07 1udy n PRO 361 N 2.41 0.04 0.01 -1.71 -0.04 -1.26 -3.76 135.00 130.69 1udy n PRO 361 Ca -0.17 0.50 -0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1udy n PRO 361 Cb 0.52 -1.70 -0.13 0.00 -0.04 0.00 0.00 33.50 32.15 1udy n PRO 361 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1udy h VAL 362 N 0.00 1.18 -0.11 0.52 -1.51 -1.89 -3.30 116.25 111.13 1udy h VAL 362 Ca 0.00 -2.98 -0.03 0.00 -1.23 0.00 0.00 66.70 62.46 1udy h VAL 362 Cb 0.14 2.58 -0.01 0.00 -2.13 0.00 0.00 31.29 31.87 1udy h VAL 362 CO 0.00 0.67 -0.07 1.05 -1.23 0.00 0.00 177.57 177.99 1udy h GLU 363 N 0.00 0.17 -0.51 5.19 -0.00 -1.65 -1.51 114.58 116.27 1udy h GLU 363 Ca -0.18 -0.03 -0.08 0.00 -0.00 0.00 0.00 59.36 59.07 1udy h GLU 363 Cb 1.92 -0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 30.62 1udy h GLU 363 CO 0.10 0.26 -0.01 -0.22 -0.00 0.00 0.00 179.01 179.13 1udy h LYS 364 N 0.16 0.90 -0.84 1.06 3.64 -1.81 -2.66 116.57 117.02 1udy h LYS 364 Ca 0.04 -0.29 0.07 0.00 -1.27 0.00 0.00 60.65 59.19 1udy h LYS 364 Cb 0.24 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.92 1udy h LYS 364 CO 0.01 0.93 0.51 -0.07 -2.27 0.00 0.00 179.45 178.57 1udy h LEU 365 N 0.76 0.79 -0.90 5.20 4.07 -1.36 0.15 115.31 124.02 1udy h LEU 365 Ca 0.14 0.02 -0.05 0.00 0.08 0.00 0.00 57.88 58.08 1udy h LEU 365 Cb 0.53 -0.14 -0.03 0.00 1.08 0.00 0.00 40.66 42.10 1udy h LEU 365 CO 0.03 0.50 0.26 -0.03 -1.08 0.00 0.00 178.44 178.12 1udy h MET 366 N 0.92 1.07 -0.18 1.13 4.05 -1.22 -0.68 114.93 120.03 1udy h MET 366 Ca 0.38 -0.20 -0.10 0.00 -0.28 0.00 0.00 59.70 59.50 1udy h MET 366 Cb 0.21 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1udy h MET 366 CO -0.19 0.88 -0.27 0.00 0.23 0.00 0.00 176.91 177.56 1udy h ARG 367 N 1.04 0.49 -0.53 0.39 3.08 -0.96 -3.29 114.38 114.61 1udy h ARG 367 Ca 0.24 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1udy h ARG 367 Cb 0.23 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1udy h ARG 367 CO -0.02 0.89 0.20 -0.44 -1.07 0.00 0.00 179.97 179.53 1udy h ASP 368 N 0.14 0.74 -0.79 7.04 3.32 -0.57 -3.32 116.42 122.98 1udy h ASP 368 Ca 0.02 -0.18 0.08 0.00 0.02 0.00 0.00 57.03 56.97 1udy h ASP 368 Cb 0.85 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 40.14 1udy h ASP 368 CO 0.06 0.72 0.45 0.00 -1.72 0.00 0.00 179.24 178.75 1udy h ALA 369 N 1.05 1.10 -1.09 3.45 0.00 -1.19 -3.21 119.26 119.37 1udy h ALA 369 Ca 0.17 0.02 0.30 0.00 0.00 0.00 0.00 54.91 55.41 1udy h ALA 369 Cb 0.22 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1udy h ALA 369 CO -0.01 0.10 0.74 -0.22 0.00 0.00 0.00 179.25 179.87 1udy h LYS 370 N 0.78 0.18 0.00 0.00 1.63 -1.66 -1.43 116.57 116.08 1udy h LYS 370 Ca 0.37 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 60.13 1udy h LYS 370 Cb 0.30 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.88 1udy h LYS 370 CO -0.22 0.12 -0.12 0.97 -3.45 0.00 0.00 179.45 176.74 1udy h ILE 371 N 0.19 0.53 0.00 2.00 6.09 -1.80 -2.75 117.51 121.77 1udy h ILE 371 Ca 0.57 -0.58 -0.00 0.00 -1.37 0.00 0.00 64.86 63.48 1udy h ILE 371 Cb 1.85 1.39 -0.00 0.00 0.47 0.00 0.00 36.82 40.53 1udy h ILE 371 CO -0.15 0.12 -0.01 1.88 -3.07 0.00 0.00 178.15 176.92 1udy h TYR 372 N 0.00 0.00 -0.01 2.19 0.05 -1.48 0.12 116.97 117.83 1udy h TYR 372 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1udy h TYR 372 Cb 0.38 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.12 1udy h TYR 372 CO 0.00 0.01 -0.06 1.04 -1.05 0.00 0.00 178.16 178.09 1udy n GLN 373 N -3.13 1.37 0.01 4.88 6.02 -1.04 -4.53 117.38 120.96 1udy n GLN 373 Ca -0.02 -0.74 -0.02 0.00 -0.01 0.00 0.00 57.00 56.21 1udy n GLN 373 Cb 0.16 -1.48 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 1udy n GLN 373 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1udy n ILE 374 N -0.17 1.17 -2.67 5.09 2.08 -0.04 -1.72 119.36 123.11 1udy n ILE 374 Ca 0.18 0.31 -0.35 0.00 0.56 0.00 0.00 62.75 63.45 1udy n ILE 374 Cb 0.33 -1.73 -0.05 0.00 -0.75 0.00 0.00 39.64 37.44 1udy n ILE 374 CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 1udy s TYR 375 N -2.12 3.27 -0.52 1.39 -0.85 -0.76 -2.69 117.35 115.07 1udy s TYR 375 Ca -0.07 1.64 -0.02 0.00 -0.52 0.00 0.00 57.07 58.09 1udy s TYR 375 Cb 0.01 -2.99 0.00 0.00 0.38 0.00 0.00 41.96 39.36 1udy s TYR 375 CO 0.11 -0.40 0.29 0.39 -1.52 0.00 0.00 175.55 174.42 1udy n GLU 376 N -0.40 -2.11 -0.32 -3.49 -0.58 -1.26 -4.72 120.64 107.75 1udy n GLU 376 Ca 0.06 0.31 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1udy n GLU 376 Cb 0.52 -3.86 0.00 0.00 -0.57 0.00 0.00 31.44 27.53 1udy n GLU 376 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1udy n GLY 377 N -1.02 -0.47 3.73 0.62 0.00 -1.24 -5.00 105.19 101.80 1udy n GLY 377 Ca -0.02 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 1udy n GLY 377 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1udy s THR 378 N 0.00 2.85 0.28 2.61 -4.23 -1.09 -4.64 115.64 111.42 1udy s THR 378 Ca 0.00 0.28 0.01 0.00 -1.18 0.00 0.00 61.69 60.80 1udy s THR 378 Cb 0.00 -2.70 0.27 0.00 1.34 0.00 0.00 72.50 71.42 1udy s THR 378 CO 0.00 -0.36 1.70 0.00 -0.54 0.00 0.00 174.62 175.41 1udy h ALA 379 N -1.45 1.30 -0.47 3.99 0.00 -1.65 -0.99 119.26 119.99 1udy h ALA 379 Ca -0.47 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1udy h ALA 379 Cb 1.26 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1udy h ALA 379 CO 0.52 -0.32 0.14 1.96 0.00 0.00 0.00 179.25 181.54 1udy h GLN 380 N 0.38 0.73 -0.48 0.00 7.50 -1.91 -2.75 115.11 118.59 1udy h GLN 380 Ca 0.52 -0.16 -0.07 0.00 0.50 0.00 0.00 58.65 59.44 1udy h GLN 380 Cb 0.94 -0.10 -0.02 0.00 0.05 0.00 0.00 27.48 28.35 1udy h GLN 380 CO -0.52 0.70 0.02 0.82 -1.50 0.00 0.00 178.83 178.35 1udy h ILE 381 N 0.63 1.24 -0.97 2.54 1.08 -1.57 -2.39 117.51 118.06 1udy h ILE 381 Ca 0.15 -0.97 0.04 0.00 -0.39 0.00 0.00 64.86 63.69 1udy h ILE 381 Cb 0.28 0.85 -0.06 0.00 -3.07 0.00 0.00 36.82 34.82 1udy h ILE 381 CO -0.00 0.35 0.64 -0.61 -0.69 0.00 0.00 178.15 177.83 1udy h GLN 382 N 0.74 1.17 -0.11 2.37 5.75 -1.08 0.74 115.11 124.69 1udy h GLN 382 Ca 0.15 -0.07 -0.11 0.00 -0.15 0.00 0.00 58.65 58.46 1udy h GLN 382 Cb 0.43 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1udy h GLN 382 CO 0.02 0.77 -0.43 0.00 -2.65 0.00 0.00 178.83 176.54 1udy h ARG 383 N 1.21 0.26 -0.16 1.69 -0.00 -1.15 -0.04 114.38 116.18 1udy h ARG 383 Ca 0.40 -0.13 -0.06 0.00 -0.50 0.00 0.00 59.98 59.69 1udy h ARG 383 Cb 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.02 1udy h ARG 383 CO -0.13 0.65 -0.13 0.82 0.00 0.00 0.00 179.97 181.18 1udy h ILE 384 N 0.22 1.33 0.09 2.04 2.04 -0.69 -0.43 117.51 122.11 1udy h ILE 384 Ca 0.02 -1.24 -0.00 0.00 1.00 0.00 0.00 64.86 64.63 1udy h ILE 384 Cb 0.85 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1udy h ILE 384 CO 0.07 0.37 -0.04 0.40 0.00 0.00 0.00 178.15 178.94 1udy h ILE 385 N 0.03 0.98 -0.74 -0.67 2.04 -0.75 -1.34 117.51 117.05 1udy h ILE 385 Ca 0.03 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.71 1udy h ILE 385 Cb 0.64 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.80 1udy h ILE 385 CO 0.03 0.06 0.42 0.40 0.00 0.00 0.00 178.15 179.07 1udy h ILE 386 N -0.24 0.95 -0.12 -0.67 2.04 -1.01 -1.20 117.51 117.25 1udy h ILE 386 Ca -0.01 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 1udy h ILE 386 Cb 0.20 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1udy h ILE 386 CO 0.02 0.14 -0.17 0.00 0.00 0.00 0.00 178.15 178.14 1udy h ALA 387 N 1.39 1.49 -0.04 1.87 0.00 -0.83 -1.49 119.26 121.65 1udy h ALA 387 Ca 0.34 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1udy h ALA 387 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1udy h ALA 387 CO -0.21 0.36 -0.10 -0.09 0.00 0.00 0.00 179.25 179.22 1udy h ARG 388 N 0.19 0.14 0.06 0.00 2.43 -0.12 -2.47 114.38 114.60 1udy h ARG 388 Ca 0.04 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1udy h ARG 388 Cb 0.42 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1udy h ARG 388 CO 0.03 0.70 -0.03 0.93 -1.51 0.00 0.00 179.97 180.09 1udy h GLU 389 N -0.40 -0.08 -0.20 0.20 4.39 -1.17 -2.58 114.58 114.74 1udy h GLU 389 Ca -0.00 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.72 1udy h GLU 389 Cb 0.70 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 1udy h GLU 389 CO 0.02 0.01 0.09 1.25 -1.16 0.00 0.00 179.01 179.23 1udy h HIS 390 N -0.14 0.18 0.00 4.33 2.76 -1.37 -3.03 115.15 117.88 1udy h HIS 390 Ca -0.01 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.11 1udy h HIS 390 Cb 0.12 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1udy h HIS 390 CO -0.05 0.10 -0.28 0.82 -1.30 0.00 0.00 177.93 177.22 1udy h ILE 391 N 0.21 0.77 0.00 6.26 2.04 -1.47 -2.87 117.51 122.45 1udy h ILE 391 Ca 0.08 -1.17 -0.04 0.00 1.00 0.00 0.00 64.86 64.73 1udy h ILE 391 Cb 0.02 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1udy h ILE 391 CO -0.06 0.27 -0.21 1.23 0.00 0.00 0.00 178.15 179.38 1udy h GLY 392 N 1.69 0.00 0.85 5.37 0.00 -1.33 -2.65 103.07 107.00 1udy h GLY 392 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1udy h GLY 392 CO 0.04 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.12 1udy n ARG 393 N -3.60 0.80 -0.12 4.80 1.74 -1.08 -2.64 116.66 116.56 1udy n ARG 393 Ca -0.01 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.15 1udy n ARG 393 Cb 0.35 -1.42 0.14 0.00 -1.02 0.00 0.00 32.46 30.51 1udy n ARG 393 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1udy n TYR 394 N -0.92 0.15 -1.75 -1.55 4.02 -1.00 -5.15 117.16 110.96 1udy n TYR 394 Ca 0.16 -0.91 0.00 0.00 -0.01 0.00 0.00 57.90 57.14 1udy n TYR 394 Cb 0.07 -0.16 0.00 0.00 -0.02 0.00 0.00 39.34 39.24 1udy n TYR 394 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02