#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abl s LEU 4 N 0.00 3.71 0.53 0.00 1.43 -1.26 -5.11 118.68 117.98 3abl s LEU 4 Ca 0.00 0.09 -0.16 0.00 -1.03 0.00 0.00 54.13 53.03 3abl s LEU 4 Cb 0.00 -1.91 -0.07 0.00 0.03 0.00 0.00 46.19 44.24 3abl s LEU 4 CO 0.00 0.23 0.99 0.00 0.23 0.00 0.00 176.35 177.80 3abl s ALA 5 N 0.01 3.08 -0.04 4.21 0.00 -1.26 -4.99 121.76 122.76 3abl s ALA 5 Ca 0.05 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.84 3abl s ALA 5 Cb -0.12 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 3abl s ALA 5 CO 0.01 -0.29 1.56 0.21 0.00 0.00 0.00 175.76 177.26 3abl s LYS 6 N -4.21 4.21 0.56 0.00 2.20 -1.26 -5.00 119.74 116.23 3abl s LYS 6 Ca 0.58 2.10 -0.05 0.00 -0.36 0.00 0.00 55.97 58.24 3abl s LYS 6 Cb -0.10 -3.84 -0.00 0.00 -1.51 0.00 0.00 37.83 32.37 3abl s LYS 6 CO 0.34 -0.77 0.86 -1.25 -0.36 0.00 0.00 175.35 174.17 3abl s PRO 7 N 3.53 3.06 0.13 4.03 0.04 -1.26 -5.02 135.00 139.52 3abl s PRO 7 Ca 0.69 -0.01 -0.35 0.00 0.04 0.00 0.00 61.00 61.37 3abl s PRO 7 Cb -0.32 -2.32 -0.15 0.00 0.04 0.00 0.00 34.50 31.75 3abl s PRO 7 CO 0.27 -0.56 1.45 1.04 0.04 0.00 0.00 177.00 179.25 3abl n GLN 8 N -2.47 1.69 0.00 4.56 1.13 -1.26 -4.92 117.38 116.10 3abl n GLN 8 Ca 0.03 0.61 0.00 0.00 -1.94 0.00 0.00 57.00 55.70 3abl n GLN 8 Cb 0.57 -2.31 0.00 0.00 0.11 0.00 0.00 30.24 28.61 3abl n GLN 8 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 3abl n MET 9 N 2.92 4.43 -4.48 -1.09 2.81 -1.26 -5.00 117.12 115.45 3abl n MET 9 Ca 0.17 0.00 -0.32 0.00 -1.81 0.00 0.00 57.70 55.75 3abl n MET 9 Cb 0.25 -0.64 -0.11 0.00 -0.71 0.00 0.00 33.22 32.01 3abl n MET 9 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3abl s ARG 10 N -1.25 2.45 -1.12 0.03 0.52 -1.26 -4.67 118.95 113.64 3abl s ARG 10 Ca 0.00 -0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 54.42 3abl s ARG 10 Cb 0.00 -2.44 0.00 0.00 0.52 0.00 0.00 34.95 33.03 3abl s ARG 10 CO 0.00 0.59 0.14 0.41 0.02 0.00 0.00 175.30 176.46 3abl n GLY 11 N 1.50 -0.17 0.25 -3.53 0.00 -1.26 -4.94 105.19 97.05 3abl n GLY 11 Ca -0.15 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 3abl n GLY 11 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3abl h LEU 12 N -0.33 0.81 -0.02 0.99 3.38 -1.95 -1.11 115.31 117.08 3abl h LEU 12 Ca -0.34 -0.27 0.02 0.00 0.09 0.00 0.00 57.88 57.38 3abl h LEU 12 Cb 1.24 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 3abl h LEU 12 CO 0.38 0.88 -0.11 0.25 0.09 0.00 0.00 178.44 179.93 3abl h LEU 13 N 0.71 -0.32 -1.25 1.67 5.85 -1.98 -1.54 115.31 118.45 3abl h LEU 13 Ca 0.15 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 3abl h LEU 13 Cb 0.43 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 3abl h LEU 13 CO 0.01 -0.16 0.07 0.00 -0.34 0.00 0.00 178.44 178.03 3abl h ALA 14 N 0.81 1.39 -0.18 1.25 0.00 -1.94 -0.85 119.26 119.74 3abl h ALA 14 Ca 0.05 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3abl h ALA 14 Cb 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3abl h ALA 14 CO -0.13 0.43 -0.03 -0.09 0.00 0.00 0.00 179.25 179.44 3abl h ARG 15 N 0.57 0.34 -0.89 0.00 2.43 -1.03 -1.61 114.38 114.19 3abl h ARG 15 Ca 0.13 -0.12 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3abl h ARG 15 Cb 0.26 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 3abl h ARG 15 CO 0.00 0.59 0.59 -0.09 -1.51 0.00 0.00 179.97 179.55 3abl h ARG 16 N 0.06 1.17 -0.29 0.20 2.43 -0.90 -2.65 114.38 114.39 3abl h ARG 16 Ca 0.05 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3abl h ARG 16 Cb 0.46 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3abl h ARG 16 CO 0.02 0.78 0.09 1.25 -1.51 0.00 0.00 179.97 180.59 3abl h LEU 17 N 1.21 0.43 0.28 3.80 5.85 -0.89 -2.08 115.31 123.91 3abl h LEU 17 Ca 0.33 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3abl h LEU 17 Cb -0.14 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 3abl h LEU 17 CO -0.07 0.53 -0.31 0.03 -0.34 0.00 0.00 178.44 178.28 3abl h ARG 18 N 0.31 -0.61 -0.51 1.25 3.08 -1.20 0.78 114.38 117.48 3abl h ARG 18 Ca 0.09 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.25 3abl h ARG 18 Cb 0.26 0.14 -0.09 0.00 0.08 0.00 0.00 29.97 30.36 3abl h ARG 18 CO -0.00 -0.41 -0.53 0.35 -1.07 0.00 0.00 179.97 178.31 3abl h PHE 19 N -0.64 -1.62 0.00 3.04 3.04 -1.48 -1.06 116.94 118.22 3abl h PHE 19 Ca -0.01 0.09 -0.15 0.00 3.98 0.00 0.00 57.97 61.88 3abl h PHE 19 Cb 0.59 0.78 -0.02 0.00 2.56 0.00 0.00 35.95 39.86 3abl h PHE 19 CO -0.20 -0.46 -0.71 0.45 -2.02 0.00 0.00 178.31 175.37 3abl h HIS 20 N -0.32 0.00 -0.33 0.41 3.86 -1.13 -0.91 115.15 116.72 3abl h HIS 20 Ca 0.11 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3abl h HIS 20 Cb 0.57 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 3abl h HIS 20 CO -0.75 0.71 0.11 0.82 0.86 0.00 0.00 177.93 179.67 3abl h ILE 21 N 0.00 1.20 -0.65 2.45 1.08 -0.74 -0.54 117.51 120.31 3abl h ILE 21 Ca -0.01 -0.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.79 3abl h ILE 21 Cb 1.32 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 36.05 3abl h ILE 21 CO 0.09 0.22 0.35 0.58 -0.69 0.00 0.00 178.15 178.71 3abl h VAL 22 N 0.39 1.21 -0.56 1.67 2.07 -1.01 -1.48 116.25 118.54 3abl h VAL 22 Ca 0.11 -0.52 0.05 0.00 0.82 0.00 0.00 66.70 67.15 3abl h VAL 22 Cb 0.24 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 3abl h VAL 22 CO -0.00 0.23 0.30 1.23 0.02 0.00 0.00 177.57 179.34 3abl h GLY 23 N 0.89 0.80 1.28 2.17 0.00 -0.99 -1.91 103.07 105.30 3abl h GLY 23 Ca 0.23 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 3abl h GLY 23 CO -0.04 0.14 0.19 0.00 0.00 0.00 0.00 176.54 176.83 3abl h ALA 24 N 1.30 1.19 -0.24 3.60 0.00 -0.61 0.00 119.26 124.51 3abl h ALA 24 Ca 0.25 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3abl h ALA 24 Cb 0.14 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3abl h ALA 24 CO -0.16 0.57 0.13 0.35 0.00 0.00 0.00 179.25 180.14 3abl h PHE 25 N 0.89 0.33 0.32 0.00 3.57 -0.99 -1.71 116.94 119.35 3abl h PHE 25 Ca 0.20 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 3abl h PHE 25 Cb 0.26 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3abl h PHE 25 CO 0.02 0.28 -0.46 0.52 -2.23 0.00 0.00 178.31 176.44 3abl h MET 26 N 0.27 -0.80 -0.99 1.11 2.86 -0.43 -2.15 114.93 114.79 3abl h MET 26 Ca 0.08 0.05 0.22 0.00 -2.06 0.00 0.00 59.70 57.99 3abl h MET 26 Cb 0.07 0.18 -0.10 0.00 0.06 0.00 0.00 31.60 31.81 3abl h MET 26 CO -0.01 -0.54 0.62 0.28 1.06 0.00 0.00 176.91 178.32 3abl h VAL 27 N -0.83 0.64 0.31 -2.22 2.07 -1.02 -2.25 116.25 112.94 3abl h VAL 27 Ca -0.02 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3abl h VAL 27 Cb 0.77 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 3abl h VAL 27 CO -0.14 0.11 -0.15 0.28 0.02 0.00 0.00 177.57 177.68 3abl h SER 28 N 0.59 -0.35 -0.54 0.57 0.02 -0.75 -0.08 113.55 113.00 3abl h SER 28 Ca 0.57 -0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.45 3abl h SER 28 Cb 1.13 0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.69 3abl h SER 28 CO -0.33 -0.08 -0.32 0.18 -1.14 0.00 0.00 176.83 175.14 3abl n LEU 29 N -5.18 -0.57 0.09 5.07 4.32 -0.86 -0.66 117.00 119.20 3abl n LEU 29 Ca -0.10 1.11 0.04 0.00 -0.02 0.00 0.00 56.01 57.04 3abl n LEU 29 Cb 0.24 -0.20 0.44 0.00 -1.62 0.00 0.00 43.42 42.28 3abl n LEU 29 CO 0.33 -0.86 1.03 1.23 -1.22 0.00 0.00 177.39 177.90 3abl h GLY 30 N 0.00 0.36 0.62 -0.72 0.00 -1.31 -1.63 103.07 100.40 3abl h GLY 30 Ca 0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3abl h GLY 30 CO -0.50 0.16 -0.11 -2.75 0.00 0.00 0.00 176.54 173.34 3abl h PHE 31 N 0.34 -0.29 -0.87 5.60 3.04 -0.29 -1.92 116.94 122.56 3abl h PHE 31 Ca 0.08 -0.01 0.22 0.00 3.98 0.00 0.00 57.97 62.25 3abl h PHE 31 Cb 0.14 0.10 -0.13 0.00 2.56 0.00 0.00 35.95 38.61 3abl h PHE 31 CO 0.00 0.06 0.28 0.00 -2.02 0.00 0.00 178.31 176.63 3abl h ALA 32 N -0.07 1.29 0.71 2.41 0.00 -0.69 0.14 119.26 123.04 3abl h ALA 32 Ca -0.03 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3abl h ALA 32 Cb 0.48 0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.53 3abl h ALA 32 CO 0.05 -0.42 -0.34 1.15 0.00 0.00 0.00 179.25 179.70 3abl h THR 33 N 0.27 0.21 -0.75 0.00 2.02 -1.30 0.02 112.91 113.39 3abl h THR 33 Ca 0.54 -0.18 0.16 0.00 0.77 0.00 0.00 66.41 67.70 3abl h THR 33 Cb 1.06 0.25 -0.11 0.00 -1.74 0.00 0.00 68.15 67.61 3abl h THR 33 CO -0.60 0.02 0.22 0.15 0.37 0.00 0.00 175.52 175.68 3abl h PHE 34 N -1.10 0.35 -0.43 3.16 3.57 -0.93 -1.43 116.94 120.14 3abl h PHE 34 Ca -0.10 0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.32 3abl h PHE 34 Cb 0.76 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 3abl h PHE 34 CO -0.01 -0.05 -0.22 -0.92 -2.23 0.00 0.00 178.31 174.88 3abl h TYR 35 N 0.32 1.05 0.00 0.41 3.20 -0.61 0.92 116.97 122.25 3abl h TYR 35 Ca 0.42 -0.27 0.00 0.00 3.14 0.00 0.00 58.73 62.03 3abl h TYR 35 Cb 0.71 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3abl h TYR 35 CO -0.23 1.06 0.00 0.87 -1.64 0.00 0.00 178.16 178.22 3abl h LYS 36 N 0.73 0.00 0.00 1.82 1.57 -0.49 -0.96 116.57 119.24 3abl h LYS 36 Ca 0.09 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.52 3abl h LYS 36 Cb 0.80 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.05 3abl h LYS 36 CO 0.07 0.00 -1.97 0.34 -0.57 0.00 0.00 179.45 177.32 3abl n PHE 37 N -2.43 0.42 0.83 -1.35 -0.00 -0.58 -1.92 117.46 112.43 3abl n PHE 37 Ca -0.00 0.18 0.13 0.00 -0.00 0.00 0.00 57.45 57.76 3abl n PHE 37 Cb 0.13 -1.02 0.44 0.00 -0.00 0.00 0.00 39.48 39.03 3abl n PHE 37 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3abl n ALA 38 N -3.91 2.57 0.08 3.13 0.00 0.31 -3.41 120.51 119.28 3abl n ALA 38 Ca -0.44 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3abl n ALA 38 Cb 0.79 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3abl n ALA 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3abl n VAL 39 N -1.81 0.52 -0.06 0.00 0.31 -0.41 -4.76 118.33 112.13 3abl n VAL 39 Ca 0.06 0.17 -0.11 0.00 -0.01 0.00 0.00 64.34 64.45 3abl n VAL 39 Cb 0.38 -1.04 -0.10 0.00 -0.91 0.00 0.00 33.84 32.16 3abl n VAL 39 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3abl h ALA 40 N 0.00 -0.01 -0.63 3.52 0.00 -1.61 0.05 119.26 120.58 3abl h ALA 40 Ca 0.00 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 3abl h ALA 40 Cb 0.09 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3abl h ALA 40 CO 0.00 -0.04 0.14 0.93 0.00 0.00 0.00 179.25 180.29 3abl h GLU 41 N -0.96 1.01 -0.78 0.00 4.39 -1.57 -1.24 114.58 115.43 3abl h GLU 41 Ca -0.00 -0.25 0.14 0.00 0.34 0.00 0.00 59.36 59.59 3abl h GLU 41 Cb 0.78 -0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 29.20 3abl h GLU 41 CO 0.00 0.92 0.34 -0.22 -1.16 0.00 0.00 179.01 178.89 3abl h LYS 42 N 0.93 0.47 -0.26 2.33 3.64 -1.58 0.10 116.57 122.20 3abl h LYS 42 Ca 0.20 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.36 3abl h LYS 42 Cb 0.37 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3abl h LYS 42 CO 0.00 0.31 -0.59 -0.09 -2.27 0.00 0.00 179.45 176.82 3abl h ARG 43 N 0.49 0.86 -0.10 1.90 2.43 -0.23 -0.21 114.38 119.51 3abl h ARG 43 Ca 0.43 -0.57 -0.11 0.00 -0.81 0.00 0.00 59.98 58.92 3abl h ARG 43 Cb 0.65 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 3abl h ARG 43 CO -0.40 1.20 -0.41 0.87 -1.51 0.00 0.00 179.97 179.73 3abl h LYS 44 N 0.63 0.23 -0.06 0.20 1.57 -0.72 -2.13 116.57 116.28 3abl h LYS 44 Ca 0.00 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.50 3abl h LYS 44 Cb 1.20 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.52 3abl h LYS 44 CO 0.13 0.60 -0.62 -0.22 -0.57 0.00 0.00 179.45 178.77 3abl h LYS 45 N 0.19 0.54 -0.73 3.15 3.64 -0.75 -1.97 116.57 120.63 3abl h LYS 45 Ca 0.02 -0.49 0.08 0.00 -1.27 0.00 0.00 60.65 58.99 3abl h LYS 45 Cb 0.81 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 32.68 3abl h LYS 45 CO 0.06 1.12 0.39 0.00 -2.27 0.00 0.00 179.45 178.75 3abl h ALA 46 N 0.43 1.01 -0.22 5.00 0.00 -0.59 0.25 119.26 125.14 3abl h ALA 46 Ca -0.06 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3abl h ALA 46 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 3abl h ALA 46 CO 0.13 0.02 -0.32 1.88 0.00 0.00 0.00 179.25 180.95 3abl h TYR 47 N 0.67 0.74 -0.18 0.00 -1.99 -1.41 -1.96 116.97 112.85 3abl h TYR 47 Ca 0.35 -0.25 -0.02 0.00 2.00 0.00 0.00 58.73 60.81 3abl h TYR 47 Cb 0.32 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 38.90 3abl h TYR 47 CO -0.09 0.98 0.04 0.00 -0.00 0.00 0.00 178.16 179.09 3abl h ALA 48 N 0.63 0.24 -0.81 3.88 0.00 -0.94 -2.10 119.26 120.16 3abl h ALA 48 Ca 0.02 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 54.89 3abl h ALA 48 Cb 0.90 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 3abl h ALA 48 CO 0.07 -0.10 0.53 -0.44 0.00 0.00 0.00 179.25 179.31 3abl h ASP 49 N 0.10 0.61 -0.21 0.00 3.45 -0.58 -1.77 116.42 118.02 3abl h ASP 49 Ca 0.06 0.02 -0.06 0.00 0.43 0.00 0.00 57.03 57.48 3abl h ASP 49 Cb 0.29 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 3abl h ASP 49 CO 0.00 0.34 -0.08 0.15 -1.57 0.00 0.00 179.24 178.08 3abl h PHE 50 N 0.66 0.50 -0.00 4.55 3.57 -0.91 -3.15 116.94 122.15 3abl h PHE 50 Ca 0.38 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3abl h PHE 50 Cb 0.58 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.20 3abl h PHE 50 CO -0.00 0.70 -0.19 0.66 -2.23 0.00 0.00 178.31 177.25 3abl n TYR 51 N -4.56 0.00 -0.11 0.41 4.02 -0.83 -3.67 117.16 112.41 3abl n TYR 51 Ca -0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.75 3abl n TYR 51 Cb 0.31 -0.19 -0.02 0.00 -0.02 0.00 0.00 39.34 39.42 3abl n TYR 51 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 3abl h ARG 52 N 0.67 0.52 -0.01 -0.72 2.43 -1.28 -3.05 114.38 112.94 3abl h ARG 52 Ca 0.00 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 3abl h ARG 52 Cb 0.43 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3abl h ARG 52 CO 0.00 0.55 -0.39 0.09 -1.51 0.00 0.00 179.97 178.71 3abl n ASN 53 N -4.67 1.87 -4.73 -3.80 3.02 -1.26 -5.05 115.26 100.64 3abl n ASN 53 Ca -0.01 -3.74 -0.42 0.00 -0.03 0.00 0.00 54.58 50.38 3abl n ASN 53 Cb 0.17 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 3abl n ASN 53 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3abl s TYR 54 N -3.17 3.15 -0.32 3.10 5.04 -1.15 -4.99 117.35 119.01 3abl s TYR 54 Ca 0.37 1.04 0.04 0.00 -2.44 0.00 0.00 57.07 56.08 3abl s TYR 54 Cb 0.35 -3.73 0.09 0.00 0.35 0.00 0.00 41.96 39.03 3abl s TYR 54 CO -0.05 -2.41 0.01 0.34 -1.34 0.00 0.00 175.55 172.11 3abl s ASP 55 N 0.58 4.68 0.12 4.32 2.15 -1.26 -5.02 116.67 122.25 3abl s ASP 55 Ca 0.61 -1.98 -0.12 0.00 0.43 0.00 0.00 52.55 51.49 3abl s ASP 55 Cb -0.39 -1.60 -0.10 0.00 -0.30 0.00 0.00 42.92 40.53 3abl s ASP 55 CO 0.38 -0.34 1.38 0.77 -0.17 0.00 0.00 175.17 177.19 3abl h SER 56 N 7.65 0.98 -0.35 -0.34 4.64 -1.99 -1.33 113.55 122.81 3abl h SER 56 Ca -0.07 -0.55 0.06 0.00 -0.47 0.00 0.00 61.79 60.75 3abl h SER 56 Cb 1.02 -0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 62.78 3abl h SER 56 CO 0.51 1.35 0.04 0.24 -0.87 0.00 0.00 176.83 178.10 3abl h MET 57 N 0.65 0.14 -0.47 4.77 2.86 -1.99 0.13 114.93 121.02 3abl h MET 57 Ca -0.00 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 3abl h MET 57 Cb 1.22 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.82 3abl h MET 57 CO 0.13 0.09 0.23 -0.22 1.06 0.00 0.00 176.91 178.21 3abl h LYS 58 N 0.14 0.65 -0.28 1.72 3.64 -1.96 0.84 116.57 121.32 3abl h LYS 58 Ca 0.17 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3abl h LYS 58 Cb 0.22 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3abl h LYS 58 CO -0.25 0.51 -0.02 0.22 -2.27 0.00 0.00 179.45 177.63 3abl h ASP 59 N 0.66 0.50 -0.68 4.20 -0.00 -0.57 -1.99 116.42 118.54 3abl h ASP 59 Ca 0.17 -0.33 -0.01 0.00 -0.00 0.00 0.00 57.03 56.86 3abl h ASP 59 Cb 0.06 -0.13 -0.03 0.00 -0.00 0.00 0.00 39.33 39.23 3abl h ASP 59 CO -0.02 0.71 0.37 0.15 -0.00 0.00 0.00 179.24 180.44 3abl h PHE 60 N 0.28 0.94 -0.29 0.28 3.04 -0.32 -2.20 116.94 118.67 3abl h PHE 60 Ca 0.08 -0.03 -0.12 0.00 3.98 0.00 0.00 57.97 61.88 3abl h PHE 60 Cb 0.46 -0.30 -0.01 0.00 2.56 0.00 0.00 35.95 38.66 3abl h PHE 60 CO 0.04 0.67 -0.31 1.49 -2.02 0.00 0.00 178.31 178.18 3abl h GLU 61 N 0.93 0.61 -0.56 1.11 4.57 -0.76 0.24 114.58 120.72 3abl h GLU 61 Ca 0.24 -0.27 0.05 0.00 -1.18 0.00 0.00 59.36 58.20 3abl h GLU 61 Cb 0.05 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.57 3abl h GLU 61 CO -0.04 0.85 0.29 0.93 -1.18 0.00 0.00 179.01 179.86 3abl h GLU 62 N 0.52 0.54 -0.30 1.92 5.08 -1.13 -0.60 114.58 120.61 3abl h GLU 62 Ca 0.06 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 3abl h GLU 62 Cb 0.79 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3abl h GLU 62 CO 0.06 0.36 -0.08 0.52 -1.00 0.00 0.00 179.01 178.87 3abl h MET 63 N 0.55 0.58 0.17 2.33 2.86 -0.53 -2.10 114.93 118.79 3abl h MET 63 Ca 0.25 -0.23 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3abl h MET 63 Cb 0.16 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 3abl h MET 63 CO -0.17 0.78 -0.27 -0.09 1.06 0.00 0.00 176.91 178.21 3abl h ARG 64 N 0.35 -0.49 -0.56 1.72 2.43 -0.44 -2.01 114.38 115.37 3abl h ARG 64 Ca 0.08 0.03 0.16 0.00 -0.81 0.00 0.00 59.98 59.44 3abl h ARG 64 Cb 0.57 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3abl h ARG 64 CO 0.03 -0.33 0.42 0.87 -1.51 0.00 0.00 179.97 179.45 3abl h LYS 65 N -0.51 0.00 0.00 0.20 1.57 -0.98 0.92 116.57 117.77 3abl h LYS 65 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3abl h LYS 65 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3abl h LYS 65 CO -0.13 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.75 3abl n ALA 66 N -2.61 2.42 -1.53 3.86 0.00 -0.79 -4.94 120.51 116.92 3abl n ALA 66 Ca 0.11 -0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.33 3abl n ALA 66 Cb 0.65 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 3abl n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abl n GLY 67 N 1.19 0.69 0.24 0.00 0.00 0.32 -4.97 105.19 102.66 3abl n GLY 67 Ca 0.13 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.63 3abl n GLY 67 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3abl h ILE 68 N 0.00 0.54 -3.10 -0.61 3.07 -1.65 -3.46 117.51 112.31 3abl h ILE 68 Ca -0.17 -0.85 -0.60 0.00 1.55 0.00 0.00 64.86 64.79 3abl h ILE 68 Cb 0.72 1.57 -0.05 0.00 -0.27 0.00 0.00 36.82 38.79 3abl h ILE 68 CO 0.23 0.17 -0.17 -0.36 -1.05 0.00 0.00 178.15 176.98 3abl s PHE 69 N -3.89 3.71 0.09 0.16 2.99 -1.26 -4.97 117.98 114.81 3abl s PHE 69 Ca -0.01 1.02 -0.12 0.00 0.00 0.00 0.00 56.93 57.82 3abl s PHE 69 Cb 0.11 -2.32 -0.20 0.00 0.00 0.00 0.00 43.02 40.61 3abl s PHE 69 CO 0.61 0.59 1.22 0.37 -0.00 0.00 0.00 175.22 178.01 3abl h GLN 70 N 4.41 0.67 0.00 0.44 4.15 -2.02 -3.39 115.11 119.38 3abl h GLN 70 Ca -0.51 -0.70 0.00 0.00 0.77 0.00 0.00 58.65 58.21 3abl h GLN 70 Cb 1.21 0.20 0.00 0.00 0.21 0.00 0.00 27.48 29.10 3abl h GLN 70 CO 0.63 1.29 -1.24 -1.13 -1.93 0.00 0.00 178.83 176.45 3abl n SER 71 N -3.85 0.56 -3.68 -0.69 3.41 -1.26 -4.60 113.62 103.52 3abl n SER 71 Ca -0.10 -0.30 -0.29 0.00 -0.26 0.00 0.00 58.87 57.92 3abl n SER 71 Cb 0.86 1.09 -0.13 0.00 -0.26 0.00 0.00 64.21 65.77 3abl n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3abl s ALA 72 N -3.24 1.95 -2.00 7.33 0.00 -1.26 -5.28 121.76 119.26 3abl s ALA 72 Ca 0.02 -2.44 0.24 0.00 0.00 0.00 0.00 51.96 49.78 3abl s ALA 72 Cb 0.14 -1.84 1.45 0.00 0.00 0.00 0.00 23.12 22.88 3abl s ALA 72 CO 0.84 -2.05 1.81 1.63 0.00 0.00 0.00 175.76 177.99