#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zza n SER 2 N 0.00 -4.63 -4.17 1.61 2.88 -1.26 -5.01 113.62 103.05 1zza n SER 2 Ca 0.00 -0.80 -0.12 0.00 -1.33 0.00 0.00 58.87 56.63 1zza n SER 2 Cb 0.00 -4.52 -0.09 0.00 -0.75 0.00 0.00 64.21 58.85 1zza n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1zza s MET 3 N -5.23 1.25 0.03 -1.46 0.00 -1.26 -5.06 119.30 107.57 1zza s MET 3 Ca 0.31 -1.58 0.13 0.00 0.00 0.00 0.00 55.69 54.55 1zza s MET 3 Cb -0.07 0.30 -0.18 0.00 0.00 0.00 0.00 34.83 34.87 1zza s MET 3 CO 0.78 -0.43 0.83 0.66 0.00 0.00 0.00 175.02 176.87 1zza h SER 4 N 2.57 0.00 0.00 -1.18 4.64 -2.07 -3.47 113.55 114.04 1zza h SER 4 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1zza h SER 4 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1zza h SER 4 CO 0.51 0.85 0.00 2.30 -0.87 0.00 0.00 176.83 179.62 1zza n ILE 5 N -3.05 0.00 0.00 0.95 -5.35 -1.26 -5.07 119.36 105.58 1zza n ILE 5 Ca -0.12 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 1zza n ILE 5 Cb 0.96 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.86 1zza n ILE 5 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 1zza n MET 6 N 0.00 0.00 0.00 6.28 2.81 -1.26 -4.87 117.12 120.08 1zza n MET 6 Ca 0.00 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1zza n MET 6 Cb 0.00 -0.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.87 1zza n MET 6 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1zza n ASP 7 N -1.76 0.00 -2.29 7.83 -0.08 -1.26 -4.39 116.55 114.60 1zza n ASP 7 Ca 0.00 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.04 1zza n ASP 7 Cb 0.00 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.45 1zza n ASP 7 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1zza n HIS 8 N 0.00 1.71 -3.59 -0.67 8.25 -1.26 -4.86 115.22 114.80 1zza n HIS 8 Ca 0.00 -2.02 -0.16 0.00 -0.26 0.00 0.00 57.72 55.28 1zza n HIS 8 Cb 0.00 -1.24 -0.07 0.00 1.12 0.00 0.00 29.99 29.81 1zza n HIS 8 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1zza s SER 9 N 0.13 -0.71 0.44 0.41 0.15 -1.26 -5.03 113.70 107.84 1zza s SER 9 Ca 0.50 1.15 0.31 0.00 0.70 0.00 0.00 55.95 58.61 1zza s SER 9 Cb 0.35 1.10 1.38 0.00 -1.71 0.00 0.00 66.02 67.14 1zza s SER 9 CO -0.14 -0.39 1.91 1.55 1.20 0.00 0.00 173.24 177.37 1zza h PRO 10 N 4.23 0.00 0.00 5.44 0.13 -2.00 -2.64 132.00 137.17 1zza h PRO 10 Ca -0.28 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.78 1zza h PRO 10 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1zza h PRO 10 CO 0.18 0.00 -0.31 0.00 -0.23 0.00 0.00 178.00 177.64 1zza h THR 11 N 0.00 1.22 -0.94 1.56 1.03 -1.97 -2.68 112.91 111.12 1zza h THR 11 Ca 0.00 -1.07 0.22 0.00 -0.01 0.00 0.00 66.41 65.55 1zza h THR 11 Cb 0.32 1.58 -0.07 0.00 -1.07 0.00 0.00 68.15 68.90 1zza h THR 11 CO 0.00 0.30 0.62 0.74 -0.01 0.00 0.00 175.52 177.18 1zza h THR 12 N 0.00 0.64 0.13 0.00 2.02 -1.85 0.41 112.91 114.26 1zza h THR 12 Ca -0.00 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1zza h THR 12 Cb 0.55 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1zza h THR 12 CO 0.04 0.07 -0.06 1.23 0.37 0.00 0.00 175.52 177.17 1zza h GLY 13 N 0.41 -0.18 0.64 2.16 0.00 -1.69 0.68 103.07 105.09 1zza h GLY 13 Ca 0.50 0.07 0.10 0.00 0.00 0.00 0.00 47.33 48.00 1zza h GLY 13 CO -0.20 -0.07 0.61 -2.08 0.00 0.00 0.00 176.54 174.80 1zza h VAL 14 N -0.79 0.98 -0.26 4.60 2.07 -1.30 0.21 116.25 121.76 1zza h VAL 14 Ca -0.02 -0.34 -0.16 0.00 0.82 0.00 0.00 66.70 67.00 1zza h VAL 14 Cb 0.55 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1zza h VAL 14 CO 0.03 0.18 -0.46 0.58 0.02 0.00 0.00 177.57 177.92 1zza h VAL 15 N 0.99 1.30 -0.35 2.57 2.07 -0.22 -1.41 116.25 121.20 1zza h VAL 15 Ca 0.45 -1.65 0.01 0.00 0.82 0.00 0.00 66.70 66.32 1zza h VAL 15 Cb 0.38 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1zza h VAL 15 CO -0.21 0.53 0.22 0.74 0.02 0.00 0.00 177.57 178.88 1zza h THR 16 N 0.52 1.08 -0.33 2.57 2.02 0.24 -0.27 112.91 118.74 1zza h THR 16 Ca 0.02 -0.16 -0.11 0.00 0.77 0.00 0.00 66.41 66.93 1zza h THR 16 Cb 1.06 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1zza h THR 16 CO 0.10 0.08 -0.21 -0.37 0.37 0.00 0.00 175.52 175.49 1zza h VAL 17 N 0.46 1.29 -0.11 3.16 -1.51 -0.98 -1.25 116.25 117.30 1zza h VAL 17 Ca 0.13 -1.35 -0.06 0.00 -1.23 0.00 0.00 66.70 64.19 1zza h VAL 17 Cb -0.04 1.45 -0.01 0.00 -2.13 0.00 0.00 31.29 30.56 1zza h VAL 17 CO -0.04 0.44 -0.21 0.16 -1.23 0.00 0.00 177.57 176.69 1zza h ILE 18 N 0.49 1.21 -0.04 7.19 3.07 -1.07 0.51 117.51 128.86 1zza h ILE 18 Ca 0.07 -0.95 -0.02 0.00 1.55 0.00 0.00 64.86 65.50 1zza h ILE 18 Cb 0.76 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 38.68 1zza h ILE 18 CO 0.06 0.29 -0.05 0.58 -1.05 0.00 0.00 178.15 177.98 1zza h VAL 19 N 0.17 1.39 -0.07 0.16 2.07 -0.87 0.24 116.25 119.34 1zza h VAL 19 Ca 0.03 -1.23 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 1zza h VAL 19 Cb 0.48 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1zza h VAL 19 CO 0.03 0.33 -0.38 0.16 0.02 0.00 0.00 177.57 177.73 1zza h ILE 20 N -0.36 1.29 0.16 4.57 3.07 -1.00 -0.46 117.51 124.78 1zza h ILE 20 Ca 0.01 -1.41 -0.01 0.00 1.55 0.00 0.00 64.86 65.00 1zza h ILE 20 Cb 0.56 1.67 0.00 0.00 -0.27 0.00 0.00 36.82 38.79 1zza h ILE 20 CO 0.01 0.41 -0.08 -0.07 -1.05 0.00 0.00 178.15 177.38 1zza h LEU 21 N 0.12 -0.18 -0.77 0.16 3.38 0.16 0.32 115.31 118.49 1zza h LEU 21 Ca 0.01 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.75 1zza h LEU 21 Cb 0.74 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1zza h LEU 21 CO 0.06 0.17 0.51 0.16 0.09 0.00 0.00 178.44 179.42 1zza h ILE 22 N -0.55 1.17 -0.30 1.22 3.07 -0.38 0.11 117.51 121.85 1zza h ILE 22 Ca -0.02 -0.35 -0.00 0.00 1.55 0.00 0.00 64.86 66.04 1zza h ILE 22 Cb 0.42 0.06 -0.01 0.00 -0.27 0.00 0.00 36.82 37.02 1zza h ILE 22 CO 0.04 0.19 0.18 0.00 -1.05 0.00 0.00 178.15 177.50 1zza h ALA 23 N 1.30 0.39 -0.44 0.16 0.00 -0.97 0.33 119.26 120.03 1zza h ALA 23 Ca 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1zza h ALA 23 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1zza h ALA 23 CO -0.08 -0.11 0.27 0.82 0.00 0.00 0.00 179.25 180.16 1zza h ILE 24 N 0.38 1.13 -0.56 0.00 1.08 0.29 0.32 117.51 120.15 1zza h ILE 24 Ca 0.11 -0.27 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 1zza h ILE 24 Cb 0.02 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.27 1zza h ILE 24 CO -0.02 0.13 0.32 0.00 -0.69 0.00 0.00 178.15 177.88 1zza h ALA 25 N 1.14 0.71 -0.47 1.87 0.00 -0.41 0.33 119.26 122.43 1zza h ALA 25 Ca 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1zza h ALA 25 Cb -0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1zza h ALA 25 CO -0.03 0.22 0.21 0.00 0.00 0.00 0.00 179.25 179.65 1zza h ALA 26 N 1.15 0.61 -0.48 0.00 0.00 0.18 0.21 119.26 120.92 1zza h ALA 26 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1zza h ALA 26 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1zza h ALA 26 CO -0.03 0.20 0.25 1.25 0.00 0.00 0.00 179.25 180.91 1zza h LEU 27 N 0.62 0.62 -0.42 0.00 6.46 0.10 0.39 115.31 123.08 1zza h LEU 27 Ca 0.16 -0.11 0.01 0.00 -0.12 0.00 0.00 57.88 57.82 1zza h LEU 27 Cb 0.16 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 1zza h LEU 27 CO -0.02 0.56 0.27 1.23 -0.62 0.00 0.00 178.44 179.86 1zza h GLY 28 N 0.63 0.59 0.97 3.75 0.00 0.09 0.11 103.07 109.21 1zza h GLY 28 Ca 0.17 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1zza h GLY 28 CO -0.02 0.20 0.15 0.00 0.00 0.00 0.00 176.54 176.87 1zza h ALA 29 N 1.16 0.63 -0.86 3.60 0.00 -0.14 0.29 119.26 123.95 1zza h ALA 29 Ca 0.16 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1zza h ALA 29 Cb -0.04 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1zza h ALA 29 CO -0.05 0.28 0.55 -0.07 0.00 0.00 0.00 179.25 179.97 1zza h LEU 30 N 0.64 0.90 -0.06 0.00 3.38 0.28 0.27 115.31 120.71 1zza h LEU 30 Ca 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1zza h LEU 30 Cb 0.27 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1zza h LEU 30 CO -0.01 0.61 -0.07 0.40 0.09 0.00 0.00 178.44 179.46 1zza h ILE 31 N 1.05 1.38 -0.25 1.22 2.04 -0.36 -1.13 117.51 121.47 1zza h ILE 31 Ca 0.35 -1.25 0.03 0.00 1.00 0.00 0.00 64.86 64.99 1zza h ILE 31 Cb 0.05 2.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1zza h ILE 31 CO -0.13 0.35 0.04 0.25 0.00 0.00 0.00 178.15 178.66 1zza h LEU 32 N -0.28 0.00 -0.28 1.44 6.46 0.02 0.34 115.31 123.00 1zza h LEU 32 Ca 0.01 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 1zza h LEU 32 Cb 0.59 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.56 1zza h LEU 32 CO 0.02 0.03 0.14 1.23 -0.62 0.00 0.00 178.44 179.25 1zza h GLY 33 N 0.14 0.43 1.85 3.75 0.00 -0.51 0.49 103.07 109.21 1zza h GLY 33 Ca 0.11 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 1zza h GLY 33 CO -0.15 0.20 -0.12 0.00 0.00 0.00 0.00 176.54 176.47 1zza h TRP 35 N 0.19 0.00 0.00 0.00 4.06 0.18 -3.17 115.95 117.21 1zza h TRP 35 Ca 0.04 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.99 1zza h TRP 35 Cb 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.49 1zza h TRP 35 CO 0.00 0.03 0.00 0.00 -3.56 0.00 0.00 178.44 174.92 1zza n TYR 37 N 0.00 0.00 0.33 0.00 4.19 -1.26 -4.64 117.16 115.78 1zza n TYR 37 Ca 0.00 0.00 0.04 0.00 3.31 0.00 0.00 57.90 61.25 1zza n TYR 37 Cb 0.00 0.00 -0.05 0.00 0.49 0.00 0.00 39.34 39.78 1zza n TYR 37 CO 0.00 0.00 0.00 1.47 0.91 0.00 0.00 176.86 179.24 1zza n LEU 38 N -0.03 0.33 -4.00 2.98 -0.00 0.18 -5.01 117.00 111.46 1zza n LEU 38 Ca 0.02 -0.41 -0.29 0.00 -0.00 0.00 0.00 56.01 55.32 1zza n LEU 38 Cb 0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.48 1zza n LEU 38 CO 0.02 0.08 -0.08 -1.14 -0.00 0.00 0.00 177.39 176.28 1zza n ARG 39 N -1.31 -3.94 -4.21 1.47 0.63 0.13 -0.91 116.66 108.52 1zza n ARG 39 Ca 0.01 0.46 -0.36 0.00 -0.92 0.00 0.00 57.85 57.04 1zza n ARG 39 Cb 0.15 -4.99 -0.04 0.00 0.45 0.00 0.00 32.46 28.03 1zza n ARG 39 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1zza n LEU 40 N -4.45 -1.38 -1.44 6.15 0.00 -1.20 -4.79 117.00 109.89 1zza n LEU 40 Ca -0.11 -0.99 -0.02 0.00 0.00 0.00 0.00 56.01 54.88 1zza n LEU 40 Cb 0.59 -1.91 0.01 0.00 0.00 0.00 0.00 43.42 42.11 1zza n LEU 40 CO 0.78 0.21 0.92 0.00 0.00 0.00 0.00 177.39 179.30 1zza n GLN 41 N -4.18 1.12 -0.05 1.96 10.64 -0.09 -4.24 117.38 122.54 1zza n GLN 41 Ca 0.08 -0.24 -0.03 0.00 -1.83 0.00 0.00 57.00 54.98 1zza n GLN 41 Cb 0.48 -1.09 -0.01 0.00 -0.86 0.00 0.00 30.24 28.75 1zza n GLN 41 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 1zza n ARG 42 N 1.08 0.30 -0.10 2.61 0.63 -1.26 -4.37 116.66 115.56 1zza n ARG 42 Ca 0.05 0.39 0.04 0.00 -0.92 0.00 0.00 57.85 57.41 1zza n ARG 42 Cb 0.53 -1.33 0.37 0.00 0.45 0.00 0.00 32.46 32.48 1zza n ARG 42 CO 0.00 0.00 0.00 -0.84 -2.51 0.00 0.00 177.63 174.28 1zza h ILE 43 N -0.66 1.10 -4.43 5.15 3.07 -2.00 -3.47 117.51 116.28 1zza h ILE 43 Ca 0.00 -0.24 -0.08 0.00 1.55 0.00 0.00 64.86 66.09 1zza h ILE 43 Cb 0.38 0.33 0.07 0.00 -0.27 0.00 0.00 36.82 37.33 1zza h ILE 43 CO 0.00 0.13 -0.29 -0.24 -1.05 0.00 0.00 178.15 176.70 1zza n SER 44 N -4.46 -5.05 0.29 2.16 2.88 -1.26 -4.93 113.62 103.25 1zza n SER 44 Ca 0.06 -0.25 0.18 0.00 -1.33 0.00 0.00 58.87 57.53 1zza n SER 44 Cb 0.10 -3.40 0.77 0.00 -0.75 0.00 0.00 64.21 60.93 1zza n SER 44 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 1zza h GLN 45 N -0.24 0.00 -6.04 -1.46 -0.00 -1.91 -3.47 115.11 101.99 1zza h GLN 45 Ca -0.20 0.00 -0.40 0.00 -0.00 0.00 0.00 58.65 58.05 1zza h GLN 45 Cb 1.10 0.00 0.08 0.00 -0.00 0.00 0.00 27.48 28.66 1zza h GLN 45 CO 0.22 0.00 -0.85 0.45 -0.00 0.00 0.00 178.83 178.66 1zza n SER 46 N -3.08 -2.22 -4.77 0.06 2.88 -1.26 -4.97 113.62 100.26 1zza n SER 46 Ca 0.00 -0.83 -0.29 0.00 -1.33 0.00 0.00 58.87 56.42 1zza n SER 46 Cb 0.27 -4.10 0.14 0.00 -0.75 0.00 0.00 64.21 59.77 1zza n SER 46 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1zza s GLU 47 N -5.82 1.08 -0.09 -1.46 1.03 -1.26 -5.03 118.70 107.15 1zza s GLU 47 Ca 0.11 0.34 -0.01 0.00 0.03 0.00 0.00 54.97 55.44 1zza s GLU 47 Cb -0.03 -1.83 -0.06 0.00 -0.80 0.00 0.00 34.13 31.42 1zza s GLU 47 CO 0.81 -2.25 -0.09 -0.25 -1.33 0.00 0.00 175.26 172.15 1zza n ASP 48 N -3.81 2.61 -4.81 0.83 8.00 -1.26 -5.04 116.55 113.07 1zza n ASP 48 Ca 0.06 -0.01 -0.31 0.00 0.71 0.00 0.00 54.79 55.25 1zza n ASP 48 Cb 0.59 -0.18 0.06 0.00 -0.02 0.00 0.00 41.12 41.57 1zza n ASP 48 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1zza s GLU 49 N -2.18 2.62 -0.07 -1.24 -6.30 -1.26 -5.08 118.70 105.19 1zza s GLU 49 Ca -0.13 0.84 -0.20 0.00 -2.50 0.00 0.00 54.97 52.98 1zza s GLU 49 Cb 0.04 -1.96 0.04 0.00 0.00 0.00 0.00 34.13 32.25 1zza s GLU 49 CO 0.20 -1.29 0.47 -2.00 0.02 0.00 0.00 175.26 172.66 1zza s GLU 50 N -5.09 0.76 0.00 4.30 -6.30 -1.26 -5.06 118.70 106.06 1zza s GLU 50 Ca 0.59 0.18 0.00 0.00 -2.50 0.00 0.00 54.97 53.24 1zza s GLU 50 Cb -0.14 0.35 0.00 0.00 0.00 0.00 0.00 34.13 34.34 1zza s GLU 50 CO 0.55 -0.20 0.51 0.43 0.02 0.00 0.00 175.26 176.57 1zza n SER 51 N 1.57 -0.12 0.00 -1.70 7.64 -1.26 -4.89 113.62 114.85 1zza n SER 51 Ca -0.19 -1.02 0.00 0.00 1.01 0.00 0.00 58.87 58.68 1zza n SER 51 Cb 0.56 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 1zza n SER 51 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1zza n ILE 52 N 0.00 0.00 -0.04 0.44 5.41 -1.26 -4.88 119.36 119.03 1zza n ILE 52 Ca -0.03 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.70 1zza n ILE 52 Cb 0.47 -0.84 -0.01 0.00 -0.71 0.00 0.00 39.64 38.56 1zza n ILE 52 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1zza h VAL 53 N 0.00 0.00 0.00 1.39 2.07 -2.02 -3.48 116.25 114.22 1zza h VAL 53 Ca 0.00 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1zza h VAL 53 Cb 0.95 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1zza h VAL 53 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 1zza n GLY 54 N 1.73 2.22 7.00 2.17 0.00 -1.26 -4.99 105.19 112.06 1zza n GLY 54 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1zza n GLY 54 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zza n ASP 55 N 2.76 -1.47 0.00 1.61 -0.08 -1.26 -4.98 116.55 113.14 1zza n ASP 55 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1zza n ASP 55 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1zza n ASP 55 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1zza n GLY 56 N 0.00 2.55 0.05 0.27 0.00 -1.26 -4.96 105.19 101.84 1zza n GLY 56 Ca 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 46.02 45.67 1zza n GLY 56 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zza n GLU 57 N 0.00 0.38 -0.35 1.61 -0.58 -1.26 -4.63 120.64 115.81 1zza n GLU 57 Ca 0.00 0.05 0.01 0.00 -0.42 0.00 0.00 57.16 56.81 1zza n GLU 57 Cb 0.00 -1.20 0.15 0.00 -0.57 0.00 0.00 31.44 29.83 1zza n GLU 57 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1zza h THR 58 N 0.00 1.09 -3.03 2.62 2.02 -1.99 -3.48 112.91 110.13 1zza h THR 58 Ca -0.22 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1zza h THR 58 Cb 1.35 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1zza h THR 58 CO -0.03 0.20 -0.59 0.29 0.37 0.00 0.00 175.52 175.76 1zza n LYS 59 N -4.53 -3.46 -3.87 6.66 5.02 -1.26 -4.71 118.16 112.02 1zza n LYS 59 Ca 0.14 2.63 -0.35 0.00 -2.02 0.00 0.00 58.31 58.71 1zza n LYS 59 Cb 0.16 -2.64 0.02 0.00 -0.02 0.00 0.00 35.03 32.56 1zza n LYS 59 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1zza n GLU 60 N 1.11 -1.29 0.21 1.97 4.71 -1.26 -4.85 120.64 121.24 1zza n GLU 60 Ca 0.00 0.32 0.04 0.00 -0.01 0.00 0.00 57.16 57.52 1zza n GLU 60 Cb 0.00 -3.72 0.44 0.00 -1.01 0.00 0.00 31.44 27.14 1zza n GLU 60 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 1zza h PRO 61 N -2.09 0.00 0.35 3.49 0.13 -1.99 -2.06 132.00 129.83 1zza h PRO 61 Ca -0.67 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.44 1zza h PRO 61 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1zza h PRO 61 CO 0.53 0.28 -0.17 0.74 -0.23 0.00 0.00 178.00 179.15 1zza h PHE 62 N 0.00 -0.44 0.00 1.56 -1.00 -2.00 -2.45 116.94 112.62 1zza h PHE 62 Ca -0.00 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 1zza h PHE 62 Cb 0.51 0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.21 1zza h PHE 62 CO 0.00 -0.27 -0.22 1.37 -1.61 0.00 0.00 178.31 177.58 1zza h LEU 63 N -0.49 0.00 0.56 1.54 8.10 -1.96 -0.88 115.31 122.19 1zza h LEU 63 Ca -0.05 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.92 1zza h LEU 63 Cb 0.36 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.57 1zza h LEU 63 CO 0.08 0.22 -0.36 0.25 -4.11 0.00 0.00 178.44 174.52 1zza h LEU 64 N 0.00 -0.92 -0.66 0.17 6.46 -1.31 0.22 115.31 119.26 1zza h LEU 64 Ca -0.00 0.06 -0.14 0.00 -0.12 0.00 0.00 57.88 57.68 1zza h LEU 64 Cb 0.45 0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.63 1zza h LEU 64 CO 0.03 -0.56 -0.64 1.62 -0.62 0.00 0.00 178.44 178.27 1zza h VAL 65 N -0.88 1.42 -0.05 1.05 3.04 -1.37 0.16 116.25 119.61 1zza h VAL 65 Ca -0.07 -2.24 0.01 0.00 -1.01 0.00 0.00 66.70 63.39 1zza h VAL 65 Cb 0.72 2.22 -0.01 0.00 -2.01 0.00 0.00 31.29 32.22 1zza h VAL 65 CO 0.06 0.63 0.01 1.56 -1.01 0.00 0.00 177.57 178.81 1zza h GLN 66 N 0.00 0.03 -0.09 4.17 1.08 -0.84 0.50 115.11 119.96 1zza h GLN 66 Ca -0.01 -0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1zza h GLN 66 Cb 1.17 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 1zza h GLN 66 CO 0.08 0.02 -0.17 1.88 -0.95 0.00 0.00 178.83 179.69 1zza h TYR 67 N 0.03 0.33 -0.51 2.96 0.05 -0.50 -1.21 116.97 118.11 1zza h TYR 67 Ca 0.02 -0.12 0.08 0.00 0.05 0.00 0.00 58.73 58.76 1zza h TYR 67 Cb 0.02 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 37.64 1zza h TYR 67 CO -0.10 0.77 0.16 0.77 -1.05 0.00 0.00 178.16 178.70 1zza h SER 68 N -0.20 0.13 0.29 3.88 0.02 -0.50 -0.24 113.55 116.93 1zza h SER 68 Ca 0.00 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1zza h SER 68 Cb 0.75 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1zza h SER 68 CO 0.04 0.10 -0.14 0.00 -1.14 0.00 0.00 176.83 175.68 1zza h ALA 69 N 1.36 -0.39 0.27 3.77 0.00 -0.02 -3.36 119.26 120.88 1zza h ALA 69 Ca 0.25 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1zza h ALA 69 Cb 0.29 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1zza h ALA 69 CO -0.28 -0.41 -0.50 0.87 0.00 0.00 0.00 179.25 178.93 1zza h LYS 70 N -1.01 -0.80 -0.15 0.00 6.56 -1.15 -0.95 116.57 119.07 1zza h LYS 70 Ca -0.04 0.05 0.01 0.00 -1.06 0.00 0.00 60.65 59.62 1zza h LYS 70 Cb 0.45 0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 32.28 1zza h LYS 70 CO 0.07 -0.53 -0.09 0.41 -2.06 0.00 0.00 179.45 177.25 1zza n GLY 71 N -1.50 -1.76 0.28 3.86 0.00 -0.11 0.20 105.19 106.16 1zza n GLY 71 Ca -0.10 0.44 -0.10 0.00 0.00 0.00 0.00 46.02 46.27 1zza n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zza h PRO 72 N 0.00 0.98 -0.73 1.61 0.13 -1.69 0.32 132.00 132.62 1zza h PRO 72 Ca 0.02 -0.32 0.03 0.00 -0.87 0.00 0.00 66.00 64.86 1zza h PRO 72 Cb 0.06 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.06 1zza h PRO 72 CO -0.14 0.99 0.46 0.00 -0.23 0.00 0.00 178.00 179.08 1zza h VAL 74 N 0.91 1.37 -0.82 0.00 2.07 0.24 -0.59 116.25 119.43 1zza h VAL 74 Ca 0.29 -1.57 0.06 0.00 0.82 0.00 0.00 66.70 66.30 1zza h VAL 74 Cb -0.01 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 31.75 1zza h VAL 74 CO -0.10 0.47 0.50 -0.08 0.02 0.00 0.00 177.57 178.38 1zza h GLU 75 N 0.03 0.89 0.01 1.57 4.22 0.08 0.45 114.58 121.82 1zza h GLU 75 Ca 0.00 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.39 1zza h GLU 75 Cb 0.89 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1zza h GLU 75 CO 0.06 0.59 -0.00 0.00 -2.18 0.00 0.00 179.01 177.48 1zza h ARG 76 N 0.91 -0.01 -0.86 1.92 -0.00 -0.22 0.15 114.38 116.27 1zza h ARG 76 Ca 0.36 0.00 0.04 0.00 -0.50 0.00 0.00 59.98 59.88 1zza h ARG 76 Cb 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 30.09 1zza h ARG 76 CO -0.17 0.34 0.55 0.87 0.00 0.00 0.00 179.97 181.55 1zza h LYS 77 N -0.36 1.02 -0.06 0.04 1.79 -0.62 0.34 116.57 118.72 1zza h LYS 77 Ca -0.00 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1zza h LYS 77 Cb 0.35 -0.23 -0.00 0.00 -1.58 0.00 0.00 32.23 30.77 1zza h LYS 77 CO 0.00 0.68 0.00 0.00 -1.08 0.00 0.00 179.45 179.05 1zza h ALA 78 N 1.37 0.08 -0.07 3.86 0.00 -0.00 -0.20 119.26 124.29 1zza h ALA 78 Ca 0.35 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1zza h ALA 78 Cb 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1zza h ALA 78 CO -0.13 -0.25 0.03 0.87 0.00 0.00 0.00 179.25 179.77 1zza h LYS 79 N -0.17 0.09 -0.83 0.00 1.79 -0.29 0.83 116.57 118.00 1zza h LYS 79 Ca 0.02 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.50 1zza h LYS 79 Cb 0.32 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.91 1zza h LYS 79 CO 0.00 0.16 0.54 1.25 -1.08 0.00 0.00 179.45 180.33 1zza h LEU 80 N -0.00 0.91 0.00 2.94 5.85 -0.31 -2.48 115.31 122.22 1zza h LEU 80 Ca 0.02 -0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.55 1zza h LEU 80 Cb 0.10 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1zza h LEU 80 CO -0.00 0.64 -0.94 -0.03 -0.34 0.00 0.00 178.44 177.77 1zza h MET 81 N 1.07 0.00 -5.45 1.25 4.05 -0.87 -3.49 114.93 111.49 1zza h MET 81 Ca 0.32 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.69 1zza h MET 81 Cb -0.05 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1zza h MET 81 CO -0.09 0.75 -0.57 2.41 0.23 0.00 0.00 176.91 179.64 1zza n THR 82 N -3.25-10.18 0.79 -0.77 -1.04 0.29 -4.84 114.28 95.28 1zza n THR 82 Ca -0.02 0.75 0.07 0.00 -2.04 0.00 0.00 64.05 62.81 1zza n THR 82 Cb 0.88 -6.82 0.38 0.00 -1.82 0.00 0.00 70.33 62.95 1zza n THR 82 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1zza n PRO 83 N -0.36 0.37 -1.82 -2.82 -0.04 -1.24 -4.83 135.00 124.25 1zza n PRO 83 Ca 0.09 0.04 -0.18 0.00 -0.04 0.00 0.00 63.50 63.40 1zza n PRO 83 Cb 0.49 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.39 1zza n PRO 83 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1zza n ASN 84 N -1.07 -4.99 0.00 3.54 3.02 -1.26 -4.89 115.26 109.61 1zza n ASN 84 Ca 0.09 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.96 1zza n ASN 84 Cb 0.06 -4.37 0.00 0.00 -0.61 0.00 0.00 39.78 34.86 1zza n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zza n GLY 85 N -0.54 0.55 0.20 7.41 0.00 -1.26 -4.47 105.19 107.07 1zza n GLY 85 Ca -0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.89 1zza n GLY 85 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zza h PRO 86 N 0.00 0.00 -0.93 1.61 0.13 -1.95 -1.69 132.00 129.16 1zza h PRO 86 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.25 1zza h PRO 86 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 1zza h PRO 86 CO 0.00 0.33 0.60 0.93 -0.23 0.00 0.00 178.00 179.63 1zza h GLU 87 N 0.00 0.84 0.00 0.86 3.07 -1.95 0.48 114.58 117.88 1zza h GLU 87 Ca -0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1zza h GLU 87 Cb 0.86 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 1zza h GLU 87 CO 0.04 0.56 -1.34 1.55 -1.40 0.00 0.00 179.01 178.42 1zza n VAL 88 N -4.57 0.00 -0.05 3.13 3.14 -1.18 -4.57 118.33 114.23 1zza n VAL 88 Ca 0.17 -0.27 -0.15 0.00 -2.96 0.00 0.00 64.34 61.13 1zza n VAL 88 Cb 0.38 0.48 -0.14 0.00 -1.06 0.00 0.00 33.84 33.50 1zza n VAL 88 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1zza n HIS 89 N -1.78 0.68 0.00 1.45 8.25 -0.64 -5.09 115.22 118.09 1zza n HIS 89 Ca -0.01 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.64 1zza n HIS 89 Cb 0.35 -1.10 0.00 0.00 1.12 0.00 0.00 29.99 30.36 1zza n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39