#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1udd s MET 4 N 0.00 4.28 0.22 7.34 1.00 -1.26 -4.87 119.30 126.00 1udd s MET 4 Ca 0.00 2.11 -0.17 0.00 0.00 0.00 0.00 55.69 57.63 1udd s MET 4 Cb 0.00 -2.97 0.22 0.00 0.00 0.00 0.00 34.83 32.08 1udd s MET 4 CO 0.00 -0.21 1.58 0.82 0.00 0.00 0.00 175.02 177.21 1udd h ILE 5 N 2.84 0.14 -0.79 2.53 2.04 -1.90 -0.43 117.51 121.94 1udd h ILE 5 Ca -0.49 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.45 1udd h ILE 5 Cb 1.23 0.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.38 1udd h ILE 5 CO 0.65 0.00 0.45 0.74 0.00 0.00 0.00 178.15 179.98 1udd h THR 6 N -0.07 0.93 -0.11 -0.27 2.02 -1.90 0.13 112.91 113.64 1udd h THR 6 Ca 0.31 -0.27 -0.09 0.00 0.77 0.00 0.00 66.41 67.14 1udd h THR 6 Cb 0.57 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1udd h THR 6 CO -0.80 0.14 -0.33 0.44 0.37 0.00 0.00 175.52 175.34 1udd h ASP 7 N 0.78 0.22 -0.15 4.18 3.32 -1.49 -1.63 116.42 121.66 1udd h ASP 7 Ca 0.37 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1udd h ASP 7 Cb 0.30 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1udd h ASP 7 CO -0.22 0.55 -0.01 0.11 -1.72 0.00 0.00 179.24 177.94 1udd h LYS 8 N 0.19 0.26 -0.44 3.56 1.57 -0.24 -1.08 116.57 120.39 1udd h LYS 8 Ca 0.02 -0.09 0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1udd h LYS 8 Cb 0.68 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.91 1udd h LYS 8 CO 0.05 0.51 0.12 -0.07 -0.57 0.00 0.00 179.45 179.48 1udd h LEU 9 N -0.01 0.07 -0.60 2.94 3.38 -0.73 0.60 115.31 120.96 1udd h LEU 9 Ca 0.04 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.12 1udd h LEU 9 Cb 0.39 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 1udd h LEU 9 CO 0.01 0.07 0.34 -0.09 0.09 0.00 0.00 178.44 178.86 1udd h ARG 10 N 0.26 0.63 -0.55 1.13 9.65 -1.20 -2.42 114.38 121.89 1udd h ARG 10 Ca 0.21 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.03 1udd h ARG 10 Cb 0.25 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.66 1udd h ARG 10 CO -0.25 0.42 0.26 -0.09 2.80 0.00 0.00 179.97 183.10 1udd h ARG 11 N 0.65 0.79 0.00 0.20 2.43 -0.02 -1.99 114.38 116.44 1udd h ARG 11 Ca 0.26 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1udd h ARG 11 Cb 0.12 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1udd h ARG 11 CO -0.15 0.65 0.00 -0.25 -1.51 0.00 0.00 179.97 178.72 1udd n ASP 12 N -4.56 0.00 -0.13 -3.80 8.00 0.09 -2.96 116.55 113.19 1udd n ASP 12 Ca 0.03 -0.80 0.03 0.00 0.71 0.00 0.00 54.79 54.76 1udd n ASP 12 Cb 0.13 -0.05 0.05 0.00 -0.02 0.00 0.00 41.12 41.22 1udd n ASP 12 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1udd n SER 13 N -1.05 1.37 -0.17 -2.24 3.41 -0.94 -4.86 113.62 109.14 1udd n SER 13 Ca 0.21 -2.20 -0.01 0.00 -0.26 0.00 0.00 58.87 56.61 1udd n SER 13 Cb 0.13 -0.19 0.08 0.00 -0.26 0.00 0.00 64.21 63.97 1udd n SER 13 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1udd h GLU 14 N 0.00 0.18 -0.64 4.33 4.22 -1.25 -1.75 114.58 119.66 1udd h GLU 14 Ca 0.00 -0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.44 1udd h GLU 14 Cb 0.94 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 1udd h GLU 14 CO 0.00 0.12 0.42 1.96 -2.18 0.00 0.00 179.01 179.33 1udd h GLN 15 N 0.19 0.81 -0.07 1.92 4.20 -1.89 -1.85 115.11 118.42 1udd h GLN 15 Ca 0.28 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.90 1udd h GLN 15 Cb 0.41 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1udd h GLN 15 CO -0.40 0.54 -0.09 0.82 -0.67 0.00 0.00 178.83 179.03 1udd h ILE 16 N 0.84 1.39 -0.16 2.54 2.04 -1.72 -3.00 117.51 119.43 1udd h ILE 16 Ca 0.24 -1.30 -0.03 0.00 1.00 0.00 0.00 64.86 64.77 1udd h ILE 16 Cb -0.06 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1udd h ILE 16 CO -0.06 0.36 -0.04 -0.50 0.00 0.00 0.00 178.15 177.92 1udd h TRP 17 N -0.27 0.24 -0.88 1.37 4.06 -1.23 -0.18 115.95 119.06 1udd h TRP 17 Ca 0.01 -0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.92 1udd h TRP 17 Cb 0.62 -0.07 -0.04 0.00 -1.00 0.00 0.00 29.16 28.67 1udd h TRP 17 CO 0.10 0.29 0.45 0.87 -3.56 0.00 0.00 178.44 176.59 1udd h LYS 18 N 0.24 1.25 -0.24 0.49 1.79 -1.31 -0.41 116.57 118.38 1udd h LYS 18 Ca 0.05 -0.17 -0.09 0.00 -2.18 0.00 0.00 60.65 58.27 1udd h LYS 18 Cb 0.22 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 1udd h LYS 18 CO 0.01 0.94 -0.25 0.87 -1.08 0.00 0.00 179.45 179.93 1udd h LYS 19 N 1.25 0.45 -0.07 3.15 1.57 -0.93 -2.64 116.57 119.35 1udd h LYS 19 Ca 0.31 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1udd h LYS 19 Cb 0.07 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1udd h LYS 19 CO -0.04 0.67 -0.03 0.82 -0.57 0.00 0.00 179.45 180.30 1udd h ILE 20 N 0.40 1.31 -1.00 1.86 2.04 -0.62 -1.80 117.51 119.71 1udd h ILE 20 Ca 0.06 -1.00 0.14 0.00 1.00 0.00 0.00 64.86 65.06 1udd h ILE 20 Cb 0.65 1.84 -0.09 0.00 -0.74 0.00 0.00 36.82 38.48 1udd h ILE 20 CO 0.05 0.28 0.62 -0.26 0.00 0.00 0.00 178.15 178.84 1udd h PHE 21 N -0.23 1.12 -0.73 1.37 0.04 -0.98 -1.98 116.94 115.56 1udd h PHE 21 Ca 0.02 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1udd h PHE 21 Cb 0.45 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1udd h PHE 21 CO 0.06 0.40 0.00 0.39 -0.60 0.00 0.00 178.31 178.56 1udd n GLU 22 N -4.66 2.74 -1.92 1.51 -0.58 -1.01 -4.48 120.64 112.24 1udd n GLU 22 Ca 0.20 -2.63 -0.41 0.00 -0.42 0.00 0.00 57.16 53.89 1udd n GLU 22 Cb 0.40 -1.58 -0.02 0.00 -0.57 0.00 0.00 31.44 29.67 1udd n GLU 22 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1udd s HIS 23 N -1.07 2.86 0.33 -0.32 2.46 -0.68 -4.77 115.29 114.10 1udd s HIS 23 Ca 0.49 1.04 0.10 0.00 0.47 0.00 0.00 55.06 57.16 1udd s HIS 23 Cb 0.26 -3.91 0.87 0.00 -0.13 0.00 0.00 32.58 29.67 1udd s HIS 23 CO 0.33 -2.88 1.76 -1.35 -2.47 0.00 0.00 174.74 170.13 1udd h PRO 24 N 4.35 0.60 -0.07 2.88 0.11 -1.90 0.29 132.00 138.26 1udd h PRO 24 Ca -0.48 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1udd h PRO 24 Cb 1.22 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1udd h PRO 24 CO 0.74 0.40 0.03 0.35 -0.21 0.00 0.00 178.00 179.31 1udd h PHE 25 N 0.62 0.10 0.26 0.65 3.57 -1.90 -1.10 116.94 119.15 1udd h PHE 25 Ca 0.60 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 62.08 1udd h PHE 25 Cb 1.12 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.84 1udd h PHE 25 CO -0.00 0.18 -0.13 0.28 -2.23 0.00 0.00 178.31 176.41 1udd h VAL 26 N -0.01 0.77 -0.26 1.41 2.07 -1.60 -1.01 116.25 117.62 1udd h VAL 26 Ca 0.02 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.42 1udd h VAL 26 Cb 0.12 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1udd h VAL 26 CO -0.00 0.04 -0.06 0.58 0.02 0.00 0.00 177.57 178.14 1udd h VAL 27 N -0.44 0.74 -0.22 2.57 2.07 -0.94 -1.76 116.25 118.26 1udd h VAL 27 Ca -0.04 -0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.38 1udd h VAL 27 Cb 0.34 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1udd h VAL 27 CO 0.06 0.00 -0.29 1.56 0.02 0.00 0.00 177.57 178.92 1udd h GLN 28 N 0.00 0.44 0.15 1.57 4.20 -1.20 -0.34 115.11 119.92 1udd h GLN 28 Ca 0.12 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1udd h GLN 28 Cb 0.19 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1udd h GLN 28 CO -0.27 0.69 -0.07 1.25 -0.67 0.00 0.00 178.83 179.76 1udd h LEU 29 N 0.39 -0.17 -1.06 1.46 6.46 -0.68 0.23 115.31 121.93 1udd h LEU 29 Ca 0.05 -0.08 -0.09 0.00 -0.12 0.00 0.00 57.88 57.65 1udd h LEU 29 Cb 0.70 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.66 1udd h LEU 29 CO 0.05 -0.03 -0.41 1.88 -0.62 0.00 0.00 178.44 179.31 1udd h TYR 30 N -0.30 0.00 0.00 1.25 -1.99 -1.23 -2.94 116.97 111.76 1udd h TYR 30 Ca -0.02 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.54 1udd h TYR 30 Cb 0.24 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.94 1udd h TYR 30 CO -0.04 0.41 -0.89 0.66 -0.00 0.00 0.00 178.16 178.31 1udd h SER 31 N 0.00 0.00 0.00 3.88 4.64 -0.89 -3.24 113.55 117.94 1udd h SER 31 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1udd h SER 31 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1udd h SER 31 CO 0.05 0.74 0.00 0.61 -0.87 0.00 0.00 176.83 177.37 1udd n GLY 32 N 1.32 0.62 0.15 -0.77 0.00 0.70 -4.45 105.19 102.75 1udd n GLY 32 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1udd n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1udd n THR 33 N -1.68 0.00 -1.85 2.61 5.66 -0.53 -4.73 114.28 113.76 1udd n THR 33 Ca 0.00 -0.08 -0.42 0.00 -3.05 0.00 0.00 64.05 60.50 1udd n THR 33 Cb 0.00 0.15 -0.03 0.00 -1.55 0.00 0.00 70.33 68.90 1udd n THR 33 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1udd s LEU 34 N -2.59 4.38 0.21 1.09 2.96 -0.93 -4.92 118.68 118.86 1udd s LEU 34 Ca 0.23 2.48 -0.32 0.00 -0.22 0.00 0.00 54.13 56.30 1udd s LEU 34 Cb 0.19 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 43.21 1udd s LEU 34 CO 0.53 -0.97 1.63 -2.65 -1.32 0.00 0.00 176.35 173.57 1udd n PRO 35 N 6.89 2.48 -0.29 0.98 -0.02 -1.26 -4.83 135.00 138.96 1udd n PRO 35 Ca 0.18 0.89 0.26 0.00 -2.02 0.00 0.00 63.50 62.81 1udd n PRO 35 Cb 0.41 -2.69 0.60 0.00 -0.02 0.00 0.00 33.50 31.81 1udd n PRO 35 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1udd h LEU 36 N 5.97 0.26 -0.68 2.45 6.46 -1.97 -0.14 115.31 127.66 1udd h LEU 36 Ca -0.44 0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 57.31 1udd h LEU 36 Cb 1.23 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.13 1udd h LEU 36 CO 0.89 0.06 0.22 -0.33 -0.62 0.00 0.00 178.44 178.66 1udd h GLU 37 N 0.23 1.04 -0.81 1.25 4.39 -1.99 -0.33 114.58 118.36 1udd h GLU 37 Ca 0.54 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.99 1udd h GLU 37 Cb 1.67 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 30.13 1udd h GLU 37 CO -0.16 0.90 0.40 0.87 -1.16 0.00 0.00 179.01 179.86 1udd h LYS 38 N 0.98 1.16 -0.55 2.33 1.57 -1.38 -1.32 116.57 119.36 1udd h LYS 38 Ca 0.22 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1udd h LYS 38 Cb 0.29 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1udd h LYS 38 CO -0.01 0.89 0.24 0.35 -0.57 0.00 0.00 179.45 180.36 1udd h PHE 39 N 1.14 0.82 -0.91 -1.35 3.57 -1.21 -1.98 116.94 117.03 1udd h PHE 39 Ca 0.28 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 1udd h PHE 39 Cb 0.10 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 1udd h PHE 39 CO 0.01 0.65 0.56 0.87 -2.23 0.00 0.00 178.31 178.17 1udd h LYS 40 N 0.75 1.23 -0.51 1.11 1.57 -0.54 0.65 116.57 120.82 1udd h LYS 40 Ca 0.19 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1udd h LYS 40 Cb 0.16 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 1udd h LYS 40 CO -0.02 0.85 0.33 0.35 -0.57 0.00 0.00 179.45 180.39 1udd h PHE 41 N 1.25 0.66 0.17 -1.35 3.57 -0.91 -1.59 116.94 118.74 1udd h PHE 41 Ca 0.33 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.83 1udd h PHE 41 Cb -0.07 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.45 1udd h PHE 41 CO 0.00 0.43 -0.08 -0.92 -2.23 0.00 0.00 178.31 175.51 1udd h TYR 42 N 0.69 -0.21 -0.06 0.41 3.20 -0.72 -2.73 116.97 117.55 1udd h TYR 42 Ca 0.19 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.07 1udd h TYR 42 Cb -0.06 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.28 1udd h TYR 42 CO -0.03 -0.09 0.05 0.28 -1.64 0.00 0.00 178.16 176.73 1udd h VAL 43 N -0.29 0.89 0.00 1.81 2.07 -0.71 -1.44 116.25 118.59 1udd h VAL 43 Ca -0.02 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.32 1udd h VAL 43 Cb 0.22 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1udd h VAL 43 CO 0.04 0.00 -0.82 -0.07 0.02 0.00 0.00 177.57 176.74 1udd h LEU 44 N 0.00 0.05 -0.90 2.57 -0.00 -1.06 -2.84 115.31 113.12 1udd h LEU 44 Ca 0.03 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1udd h LEU 44 Cb 0.13 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.77 1udd h LEU 44 CO -0.00 0.84 0.00 1.56 -0.00 0.00 0.00 178.44 180.84 1udd h GLN 45 N 0.02 0.00 0.00 1.13 1.08 -0.99 -3.16 115.11 113.19 1udd h GLN 45 Ca -0.01 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1udd h GLN 45 Cb 1.44 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.86 1udd h GLN 45 CO 0.11 0.00 -0.08 -0.44 -0.95 0.00 0.00 178.83 177.47 1udd h ASP 46 N 0.00 0.00 0.08 1.46 3.32 -1.16 -3.01 116.42 117.10 1udd h ASP 46 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1udd h ASP 46 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1udd h ASP 46 CO 0.00 0.08 -0.04 0.15 -1.72 0.00 0.00 179.24 177.71 1udd h PHE 47 N 0.00 -0.09 -0.59 4.55 3.57 -1.69 0.54 116.94 123.24 1udd h PHE 47 Ca -0.00 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1udd h PHE 47 Cb 0.26 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1udd h PHE 47 CO 0.00 -0.02 0.39 -0.97 -2.23 0.00 0.00 178.31 175.48 1udd h ASN 48 N -0.14 0.54 -0.33 0.41 -1.24 -1.76 -1.45 115.58 111.60 1udd h ASN 48 Ca -0.01 -0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.95 1udd h ASN 48 Cb 0.11 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 1udd h ASN 48 CO 0.02 0.36 0.03 0.22 -1.29 0.00 0.00 177.43 176.76 1udd h TYR 49 N 0.62 0.60 -0.47 0.67 -0.00 -1.39 0.11 116.97 117.11 1udd h TYR 49 Ca 0.24 -0.09 -0.02 0.00 -0.00 0.00 0.00 58.73 58.86 1udd h TYR 49 Cb 0.19 -0.16 -0.02 0.00 -0.00 0.00 0.00 36.73 36.74 1udd h TYR 49 CO -0.00 0.66 0.21 1.25 -0.00 0.00 0.00 178.16 180.28 1udd h LEU 50 N 0.38 0.64 -0.07 2.82 6.46 -0.06 -0.61 115.31 124.86 1udd h LEU 50 Ca 0.10 -0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 1udd h LEU 50 Cb 0.40 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.16 1udd h LEU 50 CO 0.01 0.61 0.00 0.58 -0.62 0.00 0.00 178.44 179.02 1udd h VAL 51 N 0.62 1.25 -0.80 1.05 2.07 -1.21 -2.36 116.25 116.86 1udd h VAL 51 Ca 0.16 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 66.97 1udd h VAL 51 Cb 0.15 1.62 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 1udd h VAL 51 CO -0.02 0.21 0.49 1.23 0.02 0.00 0.00 177.57 179.50 1udd h GLY 52 N -0.16 1.19 1.03 2.17 0.00 -0.65 0.98 103.07 107.62 1udd h GLY 52 Ca 0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1udd h GLY 52 CO 0.00 0.25 0.50 -2.00 0.00 0.00 0.00 176.54 175.30 1udd h LEU 53 N 0.90 1.13 -0.46 3.11 5.85 -1.08 -1.58 115.31 123.18 1udd h LEU 53 Ca 0.34 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 1udd h LEU 53 Cb 0.14 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1udd h LEU 53 CO -0.16 0.91 0.00 0.74 -0.34 0.00 0.00 178.44 179.58 1udd h THR 54 N 1.27 1.26 -0.13 1.05 2.02 -0.62 -1.85 112.91 115.92 1udd h THR 54 Ca 0.32 -1.05 0.01 0.00 0.77 0.00 0.00 66.41 66.45 1udd h THR 54 Cb 0.02 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1udd h THR 54 CO -0.05 0.37 0.07 0.03 0.37 0.00 0.00 175.52 176.30 1udd h ARG 55 N 0.67 0.14 -0.71 6.66 3.08 -0.38 -0.63 114.38 123.20 1udd h ARG 55 Ca 0.13 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1udd h ARG 55 Cb 0.50 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1udd h ARG 55 CO 0.02 0.09 0.44 0.00 -1.07 0.00 0.00 179.97 179.46 1udd h ALA 56 N 1.06 0.91 -0.43 0.04 0.00 -1.24 -1.80 119.26 117.80 1udd h ALA 56 Ca 0.05 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1udd h ALA 56 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1udd h ALA 56 CO -0.03 0.36 -0.02 -0.07 0.00 0.00 0.00 179.25 179.49 1udd h LEU 57 N 0.97 0.67 -0.20 0.00 3.38 -1.10 -0.93 115.31 118.11 1udd h LEU 57 Ca 0.26 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1udd h LEU 57 Cb -0.06 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1udd h LEU 57 CO -0.05 0.75 0.12 0.00 0.09 0.00 0.00 178.44 179.36 1udd h ALA 58 N 1.32 0.25 -0.12 1.53 0.00 -0.50 -0.25 119.26 121.49 1udd h ALA 58 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1udd h ALA 58 Cb 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1udd h ALA 58 CO 0.02 -0.25 0.07 0.28 0.00 0.00 0.00 179.25 179.37 1udd h VAL 59 N 0.25 1.07 -0.52 0.00 2.07 -1.00 -0.29 116.25 117.83 1udd h VAL 59 Ca 0.07 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.45 1udd h VAL 59 Cb 0.01 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1udd h VAL 59 CO -0.01 0.07 0.23 0.40 0.02 0.00 0.00 177.57 178.27 1udd h ILE 60 N 0.11 0.89 -0.47 4.57 2.04 -0.92 -1.81 117.51 121.92 1udd h ILE 60 Ca 0.04 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.69 1udd h ILE 60 Cb 0.05 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1udd h ILE 60 CO -0.01 0.08 0.03 0.77 0.00 0.00 0.00 178.15 179.03 1udd h SER 61 N 0.45 0.72 0.01 1.72 4.64 -0.79 -1.70 113.55 118.60 1udd h SER 61 Ca 0.24 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1udd h SER 61 Cb 0.21 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1udd h SER 61 CO -0.20 0.77 -0.00 0.77 -0.87 0.00 0.00 176.83 177.29 1udd h SER 62 N 0.72 0.00 0.00 4.97 4.64 -0.18 -2.36 113.55 121.34 1udd h SER 62 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1udd h SER 62 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1udd h SER 62 CO 0.01 0.00 -0.85 0.29 -0.87 0.00 0.00 176.83 175.41 1udd n LYS 63 N -3.44 1.69 -2.15 4.77 5.02 -0.81 -5.03 118.16 118.21 1udd n LYS 63 Ca -0.03 -0.02 -0.29 0.00 -2.02 0.00 0.00 58.31 55.96 1udd n LYS 63 Cb 0.08 -1.25 0.03 0.00 -0.02 0.00 0.00 35.03 33.87 1udd n LYS 63 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1udd s ALA 64 N -2.55 3.13 0.50 7.82 0.00 -0.70 -4.96 121.76 124.99 1udd s ALA 64 Ca 0.04 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 51.44 1udd s ALA 64 Cb 0.12 -2.84 -0.06 0.00 0.00 0.00 0.00 23.12 20.34 1udd s ALA 64 CO 0.64 -0.86 0.91 -1.21 0.00 0.00 0.00 175.76 175.24 1udd s GLU 65 N -5.13 3.77 0.27 0.00 0.41 -1.26 -4.59 118.70 112.17 1udd s GLU 65 Ca 0.55 0.67 -0.21 0.00 -0.41 0.00 0.00 54.97 55.57 1udd s GLU 65 Cb -0.11 -2.23 -0.09 0.00 -1.78 0.00 0.00 34.13 29.92 1udd s GLU 65 CO 0.49 -0.26 0.80 -0.47 -0.49 0.00 0.00 175.26 175.33 1udd s TYR 66 N -2.68 3.62 -1.76 1.61 6.14 -1.26 -0.79 117.35 122.22 1udd s TYR 66 Ca 0.54 1.50 0.29 0.00 0.64 0.00 0.00 57.07 60.04 1udd s TYR 66 Cb -0.10 -2.71 1.33 0.00 0.42 0.00 0.00 41.96 40.90 1udd s TYR 66 CO 0.38 0.25 1.92 -2.30 0.64 0.00 0.00 175.55 176.44 1udd n PRO 67 N 0.50 0.80 -0.34 4.97 -0.02 -1.26 -4.89 135.00 134.76 1udd n PRO 67 Ca -0.00 -0.25 -0.01 0.00 -2.02 0.00 0.00 63.50 61.22 1udd n PRO 67 Cb 0.51 -1.49 0.14 0.00 -0.02 0.00 0.00 33.50 32.64 1udd n PRO 67 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1udd h LEU 68 N 0.60 1.09 -1.50 2.45 5.85 -1.70 -1.20 115.31 120.90 1udd h LEU 68 Ca 0.00 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1udd h LEU 68 Cb 0.31 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1udd h LEU 68 CO 0.00 0.79 0.35 0.00 -0.34 0.00 0.00 178.44 179.24 1udd h MET 69 N 1.29 0.65 -0.21 1.25 -0.00 -1.21 0.16 114.93 116.86 1udd h MET 69 Ca 0.35 -0.04 -0.06 0.00 -0.00 0.00 0.00 59.70 59.95 1udd h MET 69 Cb -0.15 -0.15 -0.01 0.00 -0.00 0.00 0.00 31.60 31.30 1udd h MET 69 CO -0.08 0.43 -0.10 0.00 -0.00 0.00 0.00 176.91 177.16 1udd h ALA 70 N 1.68 0.29 -0.73 -3.00 0.00 -1.51 -1.21 119.26 114.78 1udd h ALA 70 Ca 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1udd h ALA 70 Cb -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1udd h ALA 70 CO -0.05 0.13 0.41 1.49 0.00 0.00 0.00 179.25 181.23 1udd h GLU 71 N 0.14 1.01 -0.27 0.00 4.81 -0.53 -2.15 114.58 117.60 1udd h GLU 71 Ca 0.05 -0.11 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 1udd h GLU 71 Cb 0.60 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1udd h GLU 71 CO 0.03 0.75 -0.47 -0.07 -0.73 0.00 0.00 179.01 178.52 1udd h LEU 72 N 1.01 0.77 -1.23 1.64 3.38 -0.64 -2.83 115.31 117.41 1udd h LEU 72 Ca 0.26 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 1udd h LEU 72 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1udd h LEU 72 CO -0.04 1.12 -0.33 0.40 0.09 0.00 0.00 178.44 179.67 1udd h ILE 73 N 0.57 1.26 -0.60 1.22 2.04 -1.06 -1.15 117.51 119.79 1udd h ILE 73 Ca 0.03 -1.22 -0.10 0.00 1.00 0.00 0.00 64.86 64.57 1udd h ILE 73 Cb 1.02 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 1udd h ILE 73 CO 0.10 0.36 -0.01 -0.08 0.00 0.00 0.00 178.15 178.52 1udd h GLU 74 N 0.08 1.05 -0.51 2.37 4.57 -1.25 0.69 114.58 121.57 1udd h GLU 74 Ca 0.01 -0.34 -0.09 0.00 -1.18 0.00 0.00 59.36 57.76 1udd h GLU 74 Cb 0.63 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 1udd h GLU 74 CO 0.05 1.03 -0.05 1.25 -1.18 0.00 0.00 179.01 180.11 1udd h LEU 75 N 0.96 0.93 -0.57 1.64 5.85 -1.17 0.13 115.31 123.08 1udd h LEU 75 Ca 0.17 -0.33 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 1udd h LEU 75 Cb 0.56 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1udd h LEU 75 CO 0.03 1.04 0.11 0.00 -0.34 0.00 0.00 178.44 179.28 1udd h ALA 76 N 0.92 0.75 -0.41 1.25 0.00 -0.91 -2.19 119.26 118.68 1udd h ALA 76 Ca 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1udd h ALA 76 Cb 0.59 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1udd h ALA 76 CO 0.04 0.49 0.16 -0.09 0.00 0.00 0.00 179.25 179.84 1udd h ARG 77 N 0.83 0.62 -0.84 0.00 1.12 -0.68 -2.75 114.38 112.68 1udd h ARG 77 Ca 0.17 -0.11 0.01 0.00 -1.11 0.00 0.00 59.98 58.94 1udd h ARG 77 Cb 0.39 -0.10 -0.04 0.00 -0.01 0.00 0.00 29.97 30.21 1udd h ARG 77 CO 0.01 0.58 0.56 -0.44 -3.11 0.00 0.00 179.97 177.56 1udd h ASP 78 N 0.52 0.96 -0.27 -3.80 3.32 -0.72 -1.71 116.42 114.71 1udd h ASP 78 Ca 0.14 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.18 1udd h ASP 78 Cb 0.19 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1udd h ASP 78 CO -0.01 0.70 0.12 -0.33 -1.72 0.00 0.00 179.24 177.99 1udd h GLU 79 N 1.14 0.25 -0.10 3.56 4.39 -1.10 0.21 114.58 122.93 1udd h GLU 79 Ca 0.31 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1udd h GLU 79 Cb -0.13 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.46 1udd h GLU 79 CO -0.07 0.17 0.00 1.33 -1.16 0.00 0.00 179.01 179.28 1udd n VAL 80 N -4.99 0.11 0.00 3.13 0.24 -1.09 -3.07 118.33 112.66 1udd n VAL 80 Ca -0.01 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1udd n VAL 80 Cb 0.08 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1udd n VAL 80 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1udd n THR 81 N 0.19 0.00 -0.17 3.34 -2.24 -0.66 -4.57 114.28 110.16 1udd n THR 81 Ca 0.17 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.94 1udd n THR 81 Cb 0.32 -0.26 0.08 0.00 -2.10 0.00 0.00 70.33 68.37 1udd n THR 81 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1udd h VAL 82 N 0.00 0.69 0.00 2.28 2.07 -1.60 -1.58 116.25 118.11 1udd h VAL 82 Ca 0.00 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1udd h VAL 82 Cb 0.00 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1udd h VAL 82 CO 0.00 0.04 -0.30 -0.33 0.02 0.00 0.00 177.57 177.01 1udd h GLU 83 N 0.24 0.00 -0.37 1.57 4.39 -1.09 -2.19 114.58 117.13 1udd h GLU 83 Ca 0.27 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.81 1udd h GLU 83 Cb 0.37 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1udd h GLU 83 CO -0.35 0.30 -0.40 0.28 -1.16 0.00 0.00 179.01 177.68 1udd h VAL 84 N 0.00 1.27 -0.50 3.13 2.07 -1.24 -0.52 116.25 120.46 1udd h VAL 84 Ca -0.00 -1.57 -0.03 0.00 0.82 0.00 0.00 66.70 65.92 1udd h VAL 84 Cb 0.71 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1udd h VAL 84 CO 0.04 0.52 0.21 -0.33 0.02 0.00 0.00 177.57 178.04 1udd h GLU 85 N 0.75 0.75 -0.46 1.57 5.08 -1.00 0.34 114.58 121.60 1udd h GLU 85 Ca 0.06 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 1udd h GLU 85 Cb 0.99 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1udd h GLU 85 CO 0.10 0.65 -0.06 -0.91 -1.00 0.00 0.00 179.01 177.79 1udd h ASN 86 N 0.67 0.78 -0.51 1.42 2.35 -1.33 -1.25 115.58 117.72 1udd h ASN 86 Ca 0.17 -0.21 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1udd h ASN 86 Cb 0.17 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1udd h ASN 86 CO -0.02 0.88 -0.14 0.22 -1.65 0.00 0.00 177.43 176.73 1udd h TYR 87 N 0.74 1.13 -0.54 1.19 3.20 -0.53 -0.60 116.97 121.55 1udd h TYR 87 Ca 0.13 -0.25 -0.07 0.00 3.14 0.00 0.00 58.73 61.69 1udd h TYR 87 Cb 0.53 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1udd h TYR 87 CO 0.03 1.06 0.05 0.28 -1.64 0.00 0.00 178.16 177.94 1udd h VAL 88 N 0.86 1.25 -0.11 1.81 2.07 -0.09 0.36 116.25 122.40 1udd h VAL 88 Ca 0.13 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.60 1udd h VAL 88 Cb 0.71 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1udd h VAL 88 CO 0.05 0.36 -0.22 0.11 0.02 0.00 0.00 177.57 177.89 1udd h LYS 89 N 0.83 0.18 -0.14 1.57 1.57 -0.80 -0.49 116.57 119.29 1udd h LYS 89 Ca 0.17 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.75 1udd h LYS 89 Cb 0.43 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1udd h LYS 89 CO 0.01 0.39 -0.50 1.25 -0.57 0.00 0.00 179.45 180.04 1udd h LEU 90 N 0.16 0.68 -0.85 2.94 5.85 -0.36 -2.93 115.31 120.80 1udd h LEU 90 Ca 0.03 -0.61 0.07 0.00 0.84 0.00 0.00 57.88 58.21 1udd h LEU 90 Cb 0.48 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 1udd h LEU 90 CO 0.03 1.18 0.52 -0.07 -0.34 0.00 0.00 178.44 179.76 1udd h LEU 91 N 0.22 0.79 0.31 2.25 4.07 -0.38 -2.34 115.31 120.24 1udd h LEU 91 Ca -0.02 0.03 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1udd h LEU 91 Cb 1.13 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.72 1udd h LEU 91 CO 0.11 0.49 -0.28 0.50 -1.08 0.00 0.00 178.44 178.18 1udd h LYS 92 N 0.92 -0.58 -0.60 1.13 3.64 -1.04 0.33 116.57 120.37 1udd h LYS 92 Ca 0.39 0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.98 1udd h LYS 92 Cb 0.24 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1udd h LYS 92 CO -0.20 -0.39 0.63 0.93 -2.27 0.00 0.00 179.45 178.16 1udd h GLU 93 N -0.61 0.00 -0.70 1.90 5.08 -1.25 0.84 114.58 119.85 1udd h GLU 93 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1udd h GLU 93 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1udd h GLU 93 CO -0.03 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.26 1udd n LEU 94 N -3.65 4.25 -3.53 1.33 4.77 -0.43 -4.94 117.00 114.79 1udd n LEU 94 Ca 0.12 -2.17 -0.19 0.00 -0.03 0.00 0.00 56.01 53.74 1udd n LEU 94 Cb 0.85 -0.52 0.07 0.00 -2.33 0.00 0.00 43.42 41.49 1udd n LEU 94 CO 0.28 0.92 0.08 0.47 -1.33 0.00 0.00 177.39 177.81 1udd n ASP 95 N 1.44 -2.42 -4.21 -1.43 8.00 0.29 -5.01 116.55 113.21 1udd n ASP 95 Ca 0.25 -0.67 -0.12 0.00 0.71 0.00 0.00 54.79 54.96 1udd n ASP 95 Cb 0.72 -4.81 -0.10 0.00 -0.02 0.00 0.00 41.12 36.91 1udd n ASP 95 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1udd s LEU 96 N -6.58 2.35 0.18 0.64 1.43 0.10 -5.00 118.68 111.80 1udd s LEU 96 Ca 0.09 -1.08 0.08 0.00 -1.03 0.00 0.00 54.13 52.19 1udd s LEU 96 Cb -0.04 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 46.02 1udd s LEU 96 CO 0.75 -0.49 -0.16 0.42 0.23 0.00 0.00 176.35 177.11 1udd s THR 97 N -3.59 1.73 0.32 5.49 -4.23 -1.26 -3.20 115.64 110.89 1udd s THR 97 Ca 0.18 -2.03 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 1udd s THR 97 Cb 0.05 -1.90 0.31 0.00 1.34 0.00 0.00 72.50 72.30 1udd s THR 97 CO -0.00 -0.46 1.80 0.25 -0.54 0.00 0.00 174.62 175.67 1udd h LEU 98 N 2.96 0.76 -0.98 4.79 6.46 -1.96 0.23 115.31 127.56 1udd h LEU 98 Ca -0.40 0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.48 1udd h LEU 98 Cb 1.21 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 41.02 1udd h LEU 98 CO 0.56 0.31 0.64 -0.33 -0.62 0.00 0.00 178.44 179.00 1udd h GLU 99 N 0.76 1.17 -0.46 1.25 4.39 -1.97 0.91 114.58 120.63 1udd h GLU 99 Ca 0.54 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 60.20 1udd h GLU 99 Cb 0.85 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 1udd h GLU 99 CO -0.32 0.78 0.26 -0.44 -1.16 0.00 0.00 179.01 178.13 1udd h ASP 100 N 1.21 0.41 -0.13 1.42 3.32 -0.96 0.10 116.42 121.79 1udd h ASP 100 Ca 0.40 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1udd h ASP 100 Cb 0.06 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1udd h ASP 100 CO -0.14 0.29 0.02 0.00 -1.72 0.00 0.00 179.24 177.69 1udd h ALA 101 N 1.21 0.18 -0.67 3.45 0.00 -0.45 -2.20 119.26 120.79 1udd h ALA 101 Ca 0.19 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1udd h ALA 101 Cb 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1udd h ALA 101 CO -0.10 -0.16 0.44 0.82 0.00 0.00 0.00 179.25 180.25 1udd h ILE 102 N -0.01 1.08 -0.01 0.00 2.04 0.11 -1.56 117.51 119.17 1udd h ILE 102 Ca 0.04 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1udd h ILE 102 Cb 0.30 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1udd h ILE 102 CO 0.00 0.14 -0.09 0.29 0.00 0.00 0.00 178.15 178.49 1udd n LYS 103 N -4.46 1.06 -2.28 2.37 5.02 0.32 -4.88 118.16 115.31 1udd n LYS 103 Ca 0.08 -0.47 -0.41 0.00 -2.02 0.00 0.00 58.31 55.49 1udd n LYS 103 Cb 0.15 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 1udd n LYS 103 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1udd s THR 104 N -2.27 3.35 -0.31 -0.18 2.01 -0.59 -4.97 115.64 112.68 1udd s THR 104 Ca 0.33 1.12 -0.25 0.00 0.31 0.00 0.00 61.69 63.20 1udd s THR 104 Cb 0.20 -3.72 0.01 0.00 0.01 0.00 0.00 72.50 69.00 1udd s THR 104 CO 0.43 0.17 0.88 -0.70 -0.69 0.00 0.00 174.62 174.71 1udd s GLU 105 N -0.16 3.99 0.43 4.92 2.56 -1.26 -5.02 118.70 124.15 1udd s GLU 105 Ca 0.55 0.73 -0.25 0.00 0.00 0.00 0.00 54.97 56.00 1udd s GLU 105 Cb -0.35 -3.73 -0.08 0.00 2.00 0.00 0.00 34.13 31.96 1udd s GLU 105 CO 0.38 -0.75 1.34 -2.14 -0.56 0.00 0.00 175.26 173.53 1udd s PRO 106 N 3.17 3.82 0.95 4.30 0.02 -1.26 -5.00 135.00 141.01 1udd s PRO 106 Ca 0.36 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.49 1udd s PRO 106 Cb -0.14 -2.68 0.16 0.00 0.02 0.00 0.00 34.50 31.87 1udd s PRO 106 CO 0.13 -0.64 1.11 0.95 -0.33 0.00 0.00 177.00 178.23 1udd s THR 107 N -1.26 2.07 0.23 0.99 -4.23 -1.26 -4.79 115.64 107.39 1udd s THR 107 Ca 0.59 0.02 -0.08 0.00 -1.18 0.00 0.00 61.69 61.05 1udd s THR 107 Cb -0.40 -2.64 0.20 0.00 1.34 0.00 0.00 72.50 71.01 1udd s THR 107 CO 0.51 -0.03 1.87 0.25 -0.54 0.00 0.00 174.62 176.68 1udd h LEU 108 N -1.70 1.05 -0.85 4.79 5.85 -1.96 -1.73 115.31 120.77 1udd h LEU 108 Ca -0.53 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.08 1udd h LEU 108 Cb 1.33 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 1udd h LEU 108 CO 0.60 0.81 0.23 0.58 -0.34 0.00 0.00 178.44 180.31 1udd h VAL 109 N 1.20 1.25 0.40 1.05 2.07 -1.96 0.20 116.25 120.47 1udd h VAL 109 Ca 0.31 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1udd h VAL 109 Cb -0.05 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1udd h VAL 109 CO -0.06 0.34 -0.19 -1.13 0.02 0.00 0.00 177.57 176.55 1udd h ASN 110 N 1.04 -0.45 -0.55 0.57 -0.73 -1.79 -0.19 115.58 113.48 1udd h ASN 110 Ca 0.23 -0.05 0.01 0.00 1.87 0.00 0.00 56.30 58.36 1udd h ASN 110 Cb 0.28 0.12 -0.03 0.00 0.27 0.00 0.00 38.32 38.96 1udd h ASN 110 CO -0.01 -0.23 0.36 0.28 -0.37 0.00 0.00 177.43 177.46 1udd h SER 111 N -0.65 0.61 -0.38 1.15 0.02 -1.18 -2.19 113.55 110.92 1udd h SER 111 Ca -0.05 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 60.93 1udd h SER 111 Cb 0.48 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.83 1udd h SER 111 CO 0.09 0.44 0.13 0.00 -1.14 0.00 0.00 176.83 176.35 1udd h ALA 112 N 1.21 0.45 -0.17 3.77 0.00 -0.48 0.07 119.26 124.11 1udd h ALA 112 Ca 0.21 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1udd h ALA 112 Cb -0.06 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1udd h ALA 112 CO -0.06 -0.26 0.10 -0.92 0.00 0.00 0.00 179.25 178.12 1udd h TYR 113 N 0.29 0.24 -0.47 0.00 3.20 -0.69 0.47 116.97 120.01 1udd h TYR 113 Ca 0.18 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 1udd h TYR 113 Cb 0.15 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 1udd h TYR 113 CO -0.15 0.22 -0.05 0.52 -1.64 0.00 0.00 178.16 177.06 1udd h MET 114 N 0.19 0.81 -0.17 1.82 2.86 -1.25 -1.67 114.93 117.51 1udd h MET 114 Ca 0.06 -0.24 -0.10 0.00 -2.06 0.00 0.00 59.70 57.36 1udd h MET 114 Cb 0.06 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1udd h MET 114 CO -0.01 0.85 -0.33 -0.44 1.06 0.00 0.00 176.91 178.04 1udd h ASP 115 N 0.74 0.34 -0.44 1.22 3.32 -0.63 -1.10 116.42 119.87 1udd h ASP 115 Ca 0.13 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 1udd h ASP 115 Cb 0.53 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1udd h ASP 115 CO 0.03 0.66 0.12 0.15 -1.72 0.00 0.00 179.24 178.47 1udd h PHE 116 N 0.29 0.73 -0.02 4.55 3.57 -0.50 0.27 116.94 125.83 1udd h PHE 116 Ca 0.04 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 1udd h PHE 116 Cb 0.72 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1udd h PHE 116 CO 0.02 0.67 0.01 0.52 -2.23 0.00 0.00 178.31 177.30 1udd h MET 117 N 0.58 0.03 -0.19 1.11 2.86 -0.91 -0.04 114.93 118.38 1udd h MET 117 Ca 0.14 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1udd h MET 117 Cb 0.30 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1udd h MET 117 CO -0.00 0.11 0.08 1.25 1.06 0.00 0.00 176.91 179.40 1udd h LEU 118 N -0.05 0.26 -1.00 1.22 5.85 -1.11 -1.45 115.31 119.02 1udd h LEU 118 Ca 0.01 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1udd h LEU 118 Cb 0.08 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1udd h LEU 118 CO -0.00 0.34 0.66 0.00 -0.34 0.00 0.00 178.44 179.10 1udd h ALA 119 N 0.93 1.29 -0.35 1.25 0.00 -0.37 0.63 119.26 122.64 1udd h ALA 119 Ca 0.06 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1udd h ALA 119 Cb 0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1udd h ALA 119 CO -0.01 0.62 -0.38 1.15 0.00 0.00 0.00 179.25 180.64 1udd h THR 120 N 1.33 1.28 -0.64 0.00 2.02 -0.86 -1.81 112.91 114.23 1udd h THR 120 Ca 0.38 -1.55 -0.02 0.00 0.77 0.00 0.00 66.41 65.98 1udd h THR 120 Cb -0.10 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1udd h THR 120 CO -0.10 0.51 0.32 0.00 0.37 0.00 0.00 175.52 176.63 1udd h ALA 121 N 0.87 0.82 0.22 6.16 0.00 -0.54 -0.55 119.26 126.24 1udd h ALA 121 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1udd h ALA 121 Cb 0.95 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1udd h ALA 121 CO 0.09 0.37 -0.11 -0.92 0.00 0.00 0.00 179.25 178.68 1udd h TYR 122 N 0.87 -0.28 0.00 0.00 5.03 -0.69 -3.30 116.97 118.60 1udd h TYR 122 Ca 0.22 -0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.45 1udd h TYR 122 Cb 0.10 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 1udd h TYR 122 CO -0.00 -0.02 -0.45 1.57 -1.32 0.00 0.00 178.16 177.94 1udd h LYS 123 N -0.51 0.00 -6.38 1.82 2.10 -1.34 -3.47 116.57 108.78 1udd h LYS 123 Ca -0.03 0.00 -0.44 0.00 -2.00 0.00 0.00 60.65 58.18 1udd h LYS 123 Cb 0.38 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.72 1udd h LYS 123 CO 0.05 0.30 -0.30 0.20 -2.00 0.00 0.00 179.45 177.70 1udd s GLY 124 N -4.40 1.60 1.17 0.07 0.00 -0.22 -5.10 107.32 100.44 1udd s GLY 124 Ca 0.04 -1.40 -0.19 0.00 0.00 0.00 0.00 44.72 43.16 1udd s GLY 124 CO 0.73 -1.30 1.18 0.54 0.00 0.00 0.00 173.10 174.24 1udd s ASN 125 N -4.19 1.22 0.27 1.64 2.20 -1.26 -4.63 114.94 110.19 1udd s ASN 125 Ca 0.46 0.43 -0.00 0.00 -0.94 0.00 0.00 52.86 52.81 1udd s ASN 125 Cb -0.10 -0.54 0.54 0.00 -2.00 0.00 0.00 41.25 39.16 1udd s ASN 125 CO 0.32 -3.92 1.79 0.40 -2.94 0.00 0.00 177.10 172.75 1udd h ILE 126 N -2.45 0.79 -0.18 0.54 5.03 -1.92 -1.14 117.51 118.19 1udd h ILE 126 Ca -0.43 -0.26 -0.17 0.00 -0.12 0.00 0.00 64.86 63.88 1udd h ILE 126 Cb 1.27 -0.02 -0.00 0.00 -3.03 0.00 0.00 36.82 35.04 1udd h ILE 126 CO 0.30 0.14 -0.58 0.40 -0.68 0.00 0.00 178.15 177.73 1udd h ILE 127 N 0.74 1.32 -0.43 -0.67 1.08 -1.97 -2.02 117.51 115.57 1udd h ILE 127 Ca 0.47 -1.84 -0.09 0.00 -0.39 0.00 0.00 64.86 63.01 1udd h ILE 127 Cb 0.61 1.81 -0.01 0.00 -3.07 0.00 0.00 36.82 36.15 1udd h ILE 127 CO -0.33 0.57 -0.10 -0.33 -0.69 0.00 0.00 178.15 177.28 1udd h GLU 128 N 0.44 0.82 -0.15 2.37 5.08 -1.76 -0.38 114.58 121.00 1udd h GLU 128 Ca 0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1udd h GLU 128 Cb 1.14 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1udd h GLU 128 CO 0.11 0.94 0.09 0.78 -1.00 0.00 0.00 179.01 179.93 1udd h GLY 129 N 0.65 0.21 1.34 -3.84 0.00 -1.15 -2.35 103.07 97.92 1udd h GLY 129 Ca 0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 1udd h GLY 129 CO 0.04 0.08 0.23 1.41 0.00 0.00 0.00 176.54 178.30 1udd h LEU 130 N 0.19 0.77 -1.39 3.11 3.38 -1.28 -2.37 115.31 117.72 1udd h LEU 130 Ca 0.05 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1udd h LEU 130 Cb -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1udd h LEU 130 CO -0.01 0.70 -0.16 0.74 0.09 0.00 0.00 178.44 179.80 1udd h THR 131 N 0.84 1.18 0.00 0.22 2.02 -0.74 -1.05 112.91 115.38 1udd h THR 131 Ca 0.20 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 1udd h THR 131 Cb 0.18 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1udd h THR 131 CO -0.02 0.25 -0.03 0.00 0.37 0.00 0.00 175.52 176.09 1udd h ALA 132 N 1.65 1.05 0.00 6.16 0.00 -0.90 -2.55 119.26 124.66 1udd h ALA 132 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1udd h ALA 132 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1udd h ALA 132 CO 0.03 0.04 -1.31 1.28 0.00 0.00 0.00 179.25 179.29 1udd n LEU 133 N -3.20 0.69 -0.18 0.00 4.77 -0.48 -4.54 117.00 114.06 1udd n LEU 133 Ca -0.01 -0.34 -0.08 0.00 -0.03 0.00 0.00 56.01 55.55 1udd n LEU 133 Cb 0.24 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.34 1udd n LEU 133 CO 0.26 0.17 0.95 0.25 -1.33 0.00 0.00 177.39 177.69 1udd h LEU 134 N 0.00 0.71 -0.70 2.23 5.85 -0.88 -2.43 115.31 120.09 1udd h LEU 134 Ca 0.00 -0.18 0.13 0.00 0.84 0.00 0.00 57.88 58.67 1udd h LEU 134 Cb 0.66 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.41 1udd h LEU 134 CO 0.00 0.70 0.26 -0.65 -0.34 0.00 0.00 178.44 178.41 1udd h PRO 135 N 0.69 0.39 0.08 5.25 0.11 -1.80 0.14 132.00 136.86 1udd h PRO 135 Ca 0.17 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 1udd h PRO 135 Cb 0.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1udd h PRO 135 CO -0.01 0.26 -0.11 0.00 -0.21 0.00 0.00 178.00 177.93 1udd h PHE 137 N -0.19 -0.16 -0.18 0.00 -1.00 -1.11 -2.90 116.94 111.40 1udd h PHE 137 Ca -0.01 0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.72 1udd h PHE 137 Cb 0.17 0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 1udd h PHE 137 CO -0.18 -0.11 -0.15 2.35 -1.61 0.00 0.00 178.31 178.61 1udd h TRP 138 N -0.07 0.49 -0.47 -0.55 7.01 -0.78 -3.20 115.95 118.38 1udd h TRP 138 Ca 0.06 -0.14 -0.03 0.00 2.11 0.00 0.00 58.89 60.89 1udd h TRP 138 Cb 0.17 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 1udd h TRP 138 CO -0.19 0.77 0.16 0.66 -2.79 0.00 0.00 178.44 177.06 1udd h SER 139 N 0.08 0.63 0.05 2.65 4.64 -0.83 -0.77 113.55 119.99 1udd h SER 139 Ca 0.03 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 1udd h SER 139 Cb 0.67 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1udd h SER 139 CO 0.04 0.59 -0.10 1.88 -0.87 0.00 0.00 176.83 178.37 1udd h TYR 140 N 0.68 0.13 0.11 4.77 -1.99 -1.53 0.62 116.97 119.75 1udd h TYR 140 Ca 0.16 -0.01 -0.26 0.00 2.00 0.00 0.00 58.73 60.62 1udd h TYR 140 Cb 0.18 -0.04 0.03 0.00 2.00 0.00 0.00 36.73 38.89 1udd h TYR 140 CO 0.01 0.23 -1.08 0.00 -0.00 0.00 0.00 178.16 177.31 1udd h ALA 141 N 1.78 -0.02 -0.50 3.88 0.00 -1.28 -3.17 119.26 119.95 1udd h ALA 141 Ca 0.03 -0.73 -0.06 0.00 0.00 0.00 0.00 54.91 54.15 1udd h ALA 141 Cb 0.25 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1udd h ALA 141 CO 0.01 0.58 0.07 0.93 0.00 0.00 0.00 179.25 180.85 1udd h GLU 142 N 0.11 0.79 -0.29 0.00 4.39 -0.75 -1.99 114.58 116.84 1udd h GLU 142 Ca -0.17 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.34 1udd h GLU 142 Cb 1.79 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 30.31 1udd h GLU 142 CO 0.21 0.75 0.12 0.82 -1.16 0.00 0.00 179.01 179.75 1udd h ILE 143 N 0.76 1.17 -0.43 3.13 2.04 -0.98 -0.30 117.51 122.90 1udd h ILE 143 Ca 0.16 -0.52 -0.11 0.00 1.00 0.00 0.00 64.86 65.38 1udd h ILE 143 Cb 0.36 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1udd h ILE 143 CO 0.01 0.18 -0.18 0.00 0.00 0.00 0.00 178.15 178.16 1udd h ALA 144 N 0.97 0.88 -0.39 1.87 0.00 -1.49 -1.04 119.26 120.05 1udd h ALA 144 Ca 0.10 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1udd h ALA 144 Cb 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1udd h ALA 144 CO -0.01 0.63 0.16 1.49 0.00 0.00 0.00 179.25 181.53 1udd h GLU 145 N 0.73 0.57 -0.54 0.00 4.57 -1.24 0.43 114.58 119.11 1udd h GLU 145 Ca 0.11 -0.10 0.03 0.00 -1.18 0.00 0.00 59.36 58.22 1udd h GLU 145 Cb 0.69 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.15 1udd h GLU 145 CO 0.05 0.54 0.32 -0.92 -1.18 0.00 0.00 179.01 177.81 1udd h TYR 146 N 0.48 0.59 -0.61 0.92 3.20 -0.85 -2.88 116.97 117.83 1udd h TYR 146 Ca 0.13 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1udd h TYR 146 Cb 0.17 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1udd h TYR 146 CO -0.00 0.33 0.00 0.72 -1.64 0.00 0.00 178.16 177.56 1udd n HIS 147 N -4.79 1.31 -0.34 -3.82 8.25 -0.41 -4.67 115.22 110.74 1udd n HIS 147 Ca 0.04 -0.61 0.24 0.00 -0.26 0.00 0.00 57.72 57.13 1udd n HIS 147 Cb 0.09 -0.20 0.51 0.00 1.12 0.00 0.00 29.99 31.51 1udd n HIS 147 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1udd h LYS 148 N 3.79 0.37 -0.49 -0.41 2.10 0.10 -1.04 116.57 120.99 1udd h LYS 148 Ca 0.00 -0.02 -0.09 0.00 -2.00 0.00 0.00 60.65 58.54 1udd h LYS 148 Cb 1.34 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 32.57 1udd h LYS 148 CO 0.19 0.24 -0.05 -0.44 -2.00 0.00 0.00 179.45 177.39 1udd h ASP 149 N 0.38 0.83 0.56 7.07 3.32 -1.84 -2.81 116.42 123.92 1udd h ASP 149 Ca 0.63 -0.23 -0.14 0.00 0.02 0.00 0.00 57.03 57.31 1udd h ASP 149 Cb 1.59 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 1udd h ASP 149 CO -0.34 0.92 -0.62 0.11 -1.72 0.00 0.00 179.24 177.59 1udd h LYS 150 N 0.78 0.06 -0.69 3.56 1.57 -1.48 -3.23 116.57 117.14 1udd h LYS 150 Ca 0.14 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1udd h LYS 150 Cb 0.54 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.82 1udd h LYS 150 CO 0.03 0.67 0.45 1.25 -0.57 0.00 0.00 179.45 181.27 1udd h LEU 151 N 0.04 0.76 -1.22 2.94 6.46 -1.22 0.13 115.31 123.20 1udd h LEU 151 Ca -0.01 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1udd h LEU 151 Cb 1.11 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.86 1udd h LEU 151 CO 0.09 0.54 0.00 0.08 -0.62 0.00 0.00 178.44 178.53 1udd h ARG 152 N 0.90 0.00 -0.01 1.25 0.11 -1.57 -2.07 114.38 112.99 1udd h ARG 152 Ca 0.26 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.34 1udd h ARG 152 Cb -0.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.02 1udd h ARG 152 CO -0.07 0.00 -0.27 -3.47 0.10 0.00 0.00 179.97 176.26 1udd n ASP 153 N -3.03 1.63 -4.67 0.08 -0.08 -0.61 -4.92 116.55 104.95 1udd n ASP 153 Ca 0.01 -1.30 -0.42 0.00 -1.51 0.00 0.00 54.79 51.57 1udd n ASP 153 Cb 0.33 0.22 -0.03 0.00 2.34 0.00 0.00 41.12 43.98 1udd n ASP 153 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1udd s ASN 154 N -2.38 6.72 0.44 1.67 3.84 0.34 -4.92 114.94 120.66 1udd s ASN 154 Ca 0.25 2.18 0.24 0.00 0.21 0.00 0.00 52.86 55.73 1udd s ASN 154 Cb 0.19 -2.54 0.96 0.00 -0.55 0.00 0.00 41.25 39.31 1udd s ASN 154 CO 0.49 -0.87 1.85 -0.65 -2.79 0.00 0.00 177.10 175.12 1udd h PRO 155 N 9.04 0.00 -5.64 0.43 0.11 -1.89 -3.43 132.00 130.63 1udd h PRO 155 Ca -0.38 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.10 1udd h PRO 155 Cb 1.17 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.14 1udd h PRO 155 CO 0.95 0.23 0.33 0.42 -0.21 0.00 0.00 178.00 179.72 1udd s ILE 156 N -3.71 4.64 0.28 4.15 1.09 -1.26 -4.94 121.20 121.45 1udd s ILE 156 Ca 0.00 0.22 0.03 0.00 -1.10 0.00 0.00 60.65 59.80 1udd s ILE 156 Cb 0.11 -4.36 0.27 0.00 -1.06 0.00 0.00 42.46 37.42 1udd s ILE 156 CO 0.63 -0.81 1.74 0.50 -0.10 0.00 0.00 174.94 176.90 1udd h LYS 157 N 9.05 0.54 -0.45 2.79 3.64 -2.00 -0.47 116.57 129.68 1udd h LYS 157 Ca -0.26 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.06 1udd h LYS 157 Cb 1.09 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1udd h LYS 157 CO 0.98 0.36 0.15 0.82 -2.27 0.00 0.00 179.45 179.49 1udd h ILE 158 N 0.56 1.18 -0.18 2.00 2.04 -1.98 -1.51 117.51 119.62 1udd h ILE 158 Ca 0.53 -0.59 -0.21 0.00 1.00 0.00 0.00 64.86 65.59 1udd h ILE 158 Cb 0.88 0.68 0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1udd h ILE 158 CO -0.43 0.22 -0.69 1.88 0.00 0.00 0.00 178.15 179.13 1udd h TYR 159 N 0.64 1.04 -0.59 1.37 0.05 -1.46 -1.92 116.97 116.10 1udd h TYR 159 Ca 0.15 -0.44 -0.01 0.00 0.05 0.00 0.00 58.73 58.48 1udd h TYR 159 Cb 0.17 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 37.72 1udd h TYR 159 CO 0.01 1.26 0.31 0.00 -1.05 0.00 0.00 178.16 178.69 1udd h ARG 160 N 0.51 0.83 -0.31 4.88 3.08 -1.08 0.11 114.38 122.41 1udd h ARG 160 Ca -0.04 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1udd h ARG 160 Cb 1.32 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 1udd h ARG 160 CO 0.15 0.65 0.14 0.93 -1.07 0.00 0.00 179.97 180.76 1udd h GLU 161 N 0.79 0.45 0.12 0.04 5.08 -1.29 -0.50 114.58 119.27 1udd h GLU 161 Ca 0.20 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1udd h GLU 161 Cb 0.07 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1udd h GLU 161 CO -0.03 0.44 -0.20 2.35 -1.00 0.00 0.00 179.01 180.56 1udd h TRP 162 N 0.35 -0.53 -0.07 4.33 7.01 -0.94 -3.04 115.95 123.05 1udd h TRP 162 Ca 0.10 0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.02 1udd h TRP 162 Cb 0.15 0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.41 1udd h TRP 162 CO -0.01 -0.30 -0.39 0.78 -2.79 0.00 0.00 178.44 175.73 1udd h GLY 163 N -0.39 0.17 1.47 2.65 0.00 -0.71 -3.16 103.07 103.10 1udd h GLY 163 Ca 0.02 -0.15 0.07 0.00 0.00 0.00 0.00 47.33 47.28 1udd h GLY 163 CO -0.10 0.14 0.19 0.50 0.00 0.00 0.00 176.54 177.27 1udd h LYS 164 N 0.13 0.00 -0.62 4.80 1.57 -0.96 -2.56 116.57 118.93 1udd h LYS 164 Ca 0.01 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.88 1udd h LYS 164 Cb 0.76 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.99 1udd h LYS 164 CO 0.06 0.00 0.24 0.28 -0.57 0.00 0.00 179.45 179.46 1udd h VAL 165 N 0.00 0.79 0.00 0.50 2.07 -1.61 -1.74 116.25 116.26 1udd h VAL 165 Ca 0.12 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1udd h VAL 165 Cb 0.51 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1udd h VAL 165 CO -0.00 0.08 0.00 -1.22 0.02 0.00 0.00 177.57 176.45 1udd n TYR 166 N -4.98 0.12 0.72 1.57 4.02 -0.97 -2.30 117.16 115.35 1udd n TYR 166 Ca 0.09 0.04 0.11 0.00 -0.01 0.00 0.00 57.90 58.13 1udd n TYR 166 Cb 0.27 -0.57 -0.02 0.00 -0.02 0.00 0.00 39.34 39.00 1udd n TYR 166 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1udd n LEU 167 N -1.60 0.67 -4.77 7.72 4.32 -0.69 -4.63 117.00 118.02 1udd n LEU 167 Ca 0.05 -0.19 -0.35 0.00 -0.02 0.00 0.00 56.01 55.51 1udd n LEU 167 Cb 0.25 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 41.99 1udd n LEU 167 CO 0.20 0.12 0.77 -0.94 -1.22 0.00 0.00 177.39 176.32 1udd s SER 168 N -3.54 5.53 0.45 -1.43 1.04 -0.97 -4.87 113.70 109.91 1udd s SER 168 Ca 0.05 2.14 0.11 0.00 0.48 0.00 0.00 55.95 58.73 1udd s SER 168 Cb 0.15 -2.57 1.02 0.00 0.10 0.00 0.00 66.02 64.72 1udd s SER 168 CO 0.82 -1.35 2.06 0.78 0.98 0.00 0.00 173.24 176.54 1udd h ASN 169 N 0.86 0.21 0.04 7.02 2.35 -1.94 -0.91 115.58 123.21 1udd h ASN 169 Ca -0.49 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.24 1udd h ASN 169 Cb 1.26 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1udd h ASN 169 CO 0.56 0.21 -0.02 -0.33 -1.65 0.00 0.00 177.43 176.20 1udd h GLU 170 N 0.24 -0.05 -0.25 0.81 3.07 -1.92 0.99 114.58 117.48 1udd h GLU 170 Ca 0.06 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1udd h GLU 170 Cb 0.07 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 1udd h GLU 170 CO -0.01 0.17 0.10 -0.92 -1.40 0.00 0.00 179.01 176.96 1udd h TYR 171 N -0.27 0.37 -0.98 4.33 3.20 -1.71 -1.72 116.97 120.20 1udd h TYR 171 Ca -0.01 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1udd h TYR 171 Cb 0.24 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 1udd h TYR 171 CO -0.00 0.38 0.65 -0.07 -1.64 0.00 0.00 178.16 177.48 1udd h LEU 172 N 0.26 1.11 -0.94 2.82 3.38 -1.13 -1.67 115.31 119.14 1udd h LEU 172 Ca 0.08 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1udd h LEU 172 Cb 0.16 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1udd h LEU 172 CO -0.01 0.79 0.29 0.78 0.09 0.00 0.00 178.44 180.39 1udd h ASN 173 N 1.31 0.97 -0.67 -0.43 -0.26 -0.52 -0.86 115.58 115.12 1udd h ASN 173 Ca 0.37 -0.14 -0.02 0.00 -0.56 0.00 0.00 56.30 55.95 1udd h ASN 173 Cb -0.11 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 36.86 1udd h ASN 173 CO -0.09 0.86 0.36 0.25 -1.06 0.00 0.00 177.43 177.75 1udd h LEU 174 N 1.04 0.85 -0.44 1.61 5.85 -0.44 -0.07 115.31 123.72 1udd h LEU 174 Ca 0.24 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1udd h LEU 174 Cb 0.19 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1udd h LEU 174 CO -0.02 0.71 0.22 0.58 -0.34 0.00 0.00 178.44 179.59 1udd h VAL 175 N 0.92 1.17 -0.56 1.05 2.07 -0.92 -1.66 116.25 118.32 1udd h VAL 175 Ca 0.23 -0.46 0.07 0.00 0.82 0.00 0.00 66.70 67.36 1udd h VAL 175 Cb 0.06 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.45 1udd h VAL 175 CO -0.04 0.18 0.26 1.23 0.02 0.00 0.00 177.57 179.22 1udd h GLY 176 N 0.56 0.79 0.95 2.17 0.00 -0.64 0.51 103.07 107.43 1udd h GLY 176 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1udd h GLY 176 CO -0.02 0.06 0.00 -0.09 0.00 0.00 0.00 176.54 176.49 1udd h ARG 177 N 0.48 0.00 -0.30 4.80 2.43 -0.67 0.13 114.38 121.26 1udd h ARG 177 Ca 0.27 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.47 1udd h ARG 177 Cb 0.24 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1udd h ARG 177 CO -0.22 0.05 0.09 -0.07 -1.51 0.00 0.00 179.97 178.30 1udd h LEU 178 N -0.04 0.07 -0.59 3.80 3.38 -0.86 -0.25 115.31 120.82 1udd h LEU 178 Ca 0.00 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1udd h LEU 178 Cb 0.05 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1udd h LEU 178 CO -0.00 0.08 0.34 0.03 0.09 0.00 0.00 178.44 178.98 1udd h ARG 179 N 0.21 0.81 -0.19 1.13 3.08 -0.72 -2.41 114.38 116.29 1udd h ARG 179 Ca 0.13 -0.08 0.04 0.00 0.07 0.00 0.00 59.98 60.14 1udd h ARG 179 Cb 0.12 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 1udd h ARG 179 CO -0.15 0.59 -0.06 -0.22 -1.07 0.00 0.00 179.97 179.06 1udd h LYS 180 N 0.79 -0.01 -0.50 0.04 3.64 0.08 0.40 116.57 121.00 1udd h LYS 180 Ca 0.21 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.67 1udd h LYS 180 Cb 0.01 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.76 1udd h LYS 180 CO -0.04 -0.01 0.13 0.82 -2.27 0.00 0.00 179.45 178.09 1udd h ILE 181 N -0.01 0.76 -0.29 2.00 2.04 -0.85 -0.27 117.51 120.89 1udd h ILE 181 Ca 0.09 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 1udd h ILE 181 Cb 0.15 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1udd h ILE 181 CO -0.20 0.05 -0.10 0.40 0.00 0.00 0.00 178.15 178.30 1udd h ILE 182 N 0.28 1.29 0.00 -0.67 2.04 -0.93 -3.16 117.51 116.36 1udd h ILE 182 Ca 0.25 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1udd h ILE 182 Cb 0.31 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1udd h ILE 182 CO -0.30 0.37 0.00 0.44 0.00 0.00 0.00 178.15 178.67 1udd h ASP 183 N 0.33 0.00 -0.43 1.72 3.32 0.25 -2.70 116.42 118.91 1udd h ASP 183 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1udd h ASP 183 Cb 0.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1udd h ASP 183 CO 0.04 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.02 1udd n SER 184 N -2.83 2.82 -4.88 6.45 3.41 -0.15 -4.78 113.62 113.66 1udd n SER 184 Ca 0.01 -2.15 -0.21 0.00 -0.26 0.00 0.00 58.87 56.26 1udd n SER 184 Cb 0.28 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 63.91 1udd n SER 184 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1udd s SER 185 N -0.86 4.93 1.02 4.04 1.04 -1.02 -5.08 113.70 117.77 1udd s SER 185 Ca 0.31 -0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.26 1udd s SER 185 Cb 0.18 -0.30 0.20 0.00 0.10 0.00 0.00 66.02 66.21 1udd s SER 185 CO 0.18 -1.42 0.46 0.61 0.98 0.00 0.00 173.24 174.05 1udd n GLY 186 N -2.46 -2.17 0.00 7.32 0.00 -1.26 -4.95 105.19 101.67 1udd n GLY 186 Ca 0.12 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.52 1udd n GLY 186 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1udd n HIS 187 N -4.48 0.00 -1.96 1.61 -0.00 -1.26 -5.00 115.22 104.13 1udd n HIS 187 Ca 0.07 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.95 1udd n HIS 187 Cb 0.32 -0.15 0.03 0.00 -0.12 0.00 0.00 29.99 30.07 1udd n HIS 187 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 1udd s SER 188 N -3.02 5.83 -1.18 0.26 1.04 -1.26 -4.06 113.70 111.30 1udd s SER 188 Ca 0.01 1.21 0.00 0.00 0.48 0.00 0.00 55.95 57.65 1udd s SER 188 Cb 0.11 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.08 1udd s SER 188 CO 0.65 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 174.40 1udd n GLY 189 N -2.83 1.21 0.35 7.32 0.00 -1.26 -4.90 105.19 105.09 1udd n GLY 189 Ca 0.06 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.74 1udd n GLY 189 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1udd h TYR 190 N 0.00 1.09 -0.58 1.61 3.20 -1.95 -2.17 116.97 118.18 1udd h TYR 190 Ca -0.23 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.69 1udd h TYR 190 Cb 0.81 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1udd h TYR 190 CO 0.37 0.54 0.38 -0.44 -1.64 0.00 0.00 178.16 177.37 1udd h ASP 191 N 1.06 0.64 -0.44 -2.11 3.32 -1.93 0.23 116.42 117.18 1udd h ASP 191 Ca 0.42 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.34 1udd h ASP 191 Cb 0.22 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1udd h ASP 191 CO -0.19 0.45 -0.18 0.08 -1.72 0.00 0.00 179.24 177.68 1udd h ARG 192 N 0.75 0.90 -0.76 3.56 -0.00 -1.80 -2.07 114.38 114.96 1udd h ARG 192 Ca 0.22 -0.38 -0.01 0.00 -0.00 0.00 0.00 59.98 59.80 1udd h ARG 192 Cb -0.04 -0.03 -0.04 0.00 -0.00 0.00 0.00 29.97 29.86 1udd h ARG 192 CO -0.05 1.03 0.43 -0.07 -0.00 0.00 0.00 179.97 181.31 1udd h LEU 193 N 0.74 0.95 -0.36 0.08 3.38 -0.96 -1.46 115.31 117.67 1udd h LEU 193 Ca 0.10 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1udd h LEU 193 Cb 0.75 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1udd h LEU 193 CO 0.06 0.76 0.22 -0.09 0.09 0.00 0.00 178.44 179.48 1udd h ARG 194 N 1.05 0.44 -0.74 1.13 2.43 -0.38 -0.13 114.38 118.18 1udd h ARG 194 Ca 0.27 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 1udd h ARG 194 Cb 0.02 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 1udd h ARG 194 CO -0.04 0.29 0.25 0.00 -1.51 0.00 0.00 179.97 178.95 1udd h ARG 195 N 0.45 1.13 -0.35 0.20 3.08 -1.08 -0.81 114.38 117.00 1udd h ARG 195 Ca 0.14 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1udd h ARG 195 Cb -0.02 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1udd h ARG 195 CO -0.05 0.95 0.09 0.82 -1.07 0.00 0.00 179.97 180.70 1udd h ILE 196 N 1.09 1.22 -0.29 2.04 2.04 -0.86 -1.69 117.51 121.06 1udd h ILE 196 Ca 0.24 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 1udd h ILE 196 Cb 0.28 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1udd h ILE 196 CO -0.01 0.26 0.06 0.15 0.00 0.00 0.00 178.15 178.61 1udd h PHE 197 N 0.42 0.50 -0.28 1.37 3.57 -0.87 -1.51 116.94 120.15 1udd h PHE 197 Ca 0.11 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.57 1udd h PHE 197 Cb 0.30 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1udd h PHE 197 CO 0.02 0.56 0.11 0.82 -2.23 0.00 0.00 178.31 177.58 1udd h ILE 198 N 0.30 0.94 -0.34 1.41 2.04 -1.10 0.90 117.51 121.67 1udd h ILE 198 Ca 0.09 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.90 1udd h ILE 198 Cb 0.32 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1udd h ILE 198 CO 0.00 0.04 0.13 0.74 0.00 0.00 0.00 178.15 179.07 1udd h THR 199 N 0.24 0.92 -0.73 -0.27 2.02 -1.20 0.39 112.91 114.27 1udd h THR 199 Ca 0.12 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1udd h THR 199 Cb 0.08 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1udd h THR 199 CO -0.11 0.05 0.40 1.23 0.37 0.00 0.00 175.52 177.45 1udd h GLY 200 N 0.28 1.09 1.27 2.16 0.00 -0.82 -1.25 103.07 105.80 1udd h GLY 200 Ca 0.15 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 1udd h GLY 200 CO -0.14 0.47 -0.15 1.76 0.00 0.00 0.00 176.54 178.47 1udd h SER 201 N 1.02 0.86 -0.17 0.19 0.02 -0.06 -1.91 113.55 113.50 1udd h SER 201 Ca 0.26 -0.28 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 1udd h SER 201 Cb 0.03 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 1udd h SER 201 CO -0.04 1.01 -0.17 0.11 -1.14 0.00 0.00 176.83 176.59 1udd h LYS 202 N 0.76 0.58 -0.53 3.45 1.57 -0.45 -2.10 116.57 119.84 1udd h LYS 202 Ca 0.12 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1udd h LYS 202 Cb 0.67 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 1udd h LYS 202 CO 0.05 0.72 0.15 0.74 -0.57 0.00 0.00 179.45 180.55 1udd h PHE 203 N 0.52 0.87 -0.20 -1.35 0.04 -0.96 -0.60 116.94 115.27 1udd h PHE 203 Ca 0.09 -0.09 0.04 0.00 2.80 0.00 0.00 57.97 60.81 1udd h PHE 203 Cb 0.59 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 38.45 1udd h PHE 203 CO 0.02 0.75 -0.07 0.93 -0.60 0.00 0.00 178.31 179.34 1udd h GLU 204 N 0.74 -0.04 -0.85 1.51 4.39 -0.96 0.52 114.58 119.89 1udd h GLU 204 Ca 0.17 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.93 1udd h GLU 204 Cb 0.30 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.90 1udd h GLU 204 CO -0.00 -0.02 0.53 1.25 -1.16 0.00 0.00 179.01 179.61 1udd h LEU 205 N -0.04 0.86 -0.74 1.33 5.85 -1.15 -1.58 115.31 119.84 1udd h LEU 205 Ca 0.10 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 1udd h LEU 205 Cb 0.19 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1udd h LEU 205 CO -0.23 0.56 -0.14 0.00 -0.34 0.00 0.00 178.44 178.29 1udd h ALA 206 N 1.39 0.93 -0.28 1.25 0.00 -0.24 -1.76 119.26 120.54 1udd h ALA 206 Ca 0.36 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1udd h ALA 206 Cb 0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1udd h ALA 206 CO -0.15 0.62 0.10 0.35 0.00 0.00 0.00 179.25 180.16 1udd h PHE 207 N 0.73 0.45 -0.71 0.00 3.57 0.72 0.40 116.94 122.09 1udd h PHE 207 Ca 0.11 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1udd h PHE 207 Cb 0.65 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1udd h PHE 207 CO 0.03 0.47 0.31 -1.49 -2.23 0.00 0.00 178.31 175.40 1udd h TRP 208 N 0.30 1.03 -0.33 0.41 4.06 -1.21 -0.87 115.95 119.35 1udd h TRP 208 Ca 0.09 -0.06 -0.04 0.00 2.06 0.00 0.00 58.89 60.95 1udd h TRP 208 Cb 0.22 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 28.05 1udd h TRP 208 CO 0.00 0.77 0.05 1.49 -3.56 0.00 0.00 178.44 177.20 1udd h GLU 209 N 1.02 0.54 -0.12 0.49 4.57 -0.90 -1.77 114.58 118.41 1udd h GLU 209 Ca 0.24 -0.15 -0.10 0.00 -1.18 0.00 0.00 59.36 58.18 1udd h GLU 209 Cb 0.15 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1udd h GLU 209 CO -0.03 0.63 -0.36 0.00 -1.18 0.00 0.00 179.01 178.08 1udd h MET 210 N 0.37 0.24 -0.74 1.92 -0.00 -0.62 -0.44 114.93 115.66 1udd h MET 210 Ca 0.10 -0.10 -0.06 0.00 -0.00 0.00 0.00 59.70 59.64 1udd h MET 210 Cb 0.35 -0.01 -0.03 0.00 -0.00 0.00 0.00 31.60 31.91 1udd h MET 210 CO 0.01 0.57 0.24 0.00 -0.00 0.00 0.00 176.91 177.73 1udd h ALA 211 N 1.43 1.02 -0.36 -3.00 0.00 -0.97 0.98 119.26 118.36 1udd h ALA 211 Ca 0.02 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1udd h ALA 211 Cb 0.73 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1udd h ALA 211 CO 0.06 0.66 -0.21 2.35 0.00 0.00 0.00 179.25 182.10 1udd h TRP 212 N 1.10 0.91 0.00 0.00 2.91 -0.84 -2.93 115.95 117.10 1udd h TRP 212 Ca 0.24 -0.24 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1udd h TRP 212 Cb 0.29 -0.21 0.00 0.00 -0.51 0.00 0.00 29.16 28.73 1udd h TRP 212 CO 0.02 0.99 0.00 0.00 -1.03 0.00 0.00 178.44 178.42 1udd h ARG 213 N 0.57 0.00 -1.35 2.65 3.08 -0.80 -3.47 114.38 115.07 1udd h ARG 213 Ca 0.08 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.93 1udd h ARG 213 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1udd h ARG 213 CO 0.06 0.00 -0.25 0.41 -1.07 0.00 0.00 179.97 179.12 1udd n GLY 214 N 0.41 0.02 0.00 0.04 0.00 0.28 -5.08 105.19 100.86 1udd n GLY 214 Ca 0.02 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1udd n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93