#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hzi s GLN 5 N 0.00 4.53 -0.19 -4.13 -2.07 -1.26 -5.01 119.66 111.53 3hzi s GLN 5 Ca 0.00 1.74 -0.24 0.00 -1.82 0.00 0.00 55.36 55.03 3hzi s GLN 5 Cb 0.00 -3.31 -0.02 0.00 -1.09 0.00 0.00 33.01 28.60 3hzi s GLN 5 CO 0.00 -0.06 0.79 0.15 -1.32 0.00 0.00 175.29 174.85 3hzi s LYS 6 N 0.20 4.26 0.01 9.60 1.02 -1.26 -5.06 119.74 128.51 3hzi s LYS 6 Ca 0.53 0.92 -0.08 0.00 0.02 0.00 0.00 55.97 57.36 3hzi s LYS 6 Cb -0.29 -3.59 -0.05 0.00 -0.52 0.00 0.00 37.83 33.38 3hzi s LYS 6 CO 0.33 -0.34 0.29 0.42 -0.92 0.00 0.00 175.35 175.13 3hzi s ILE 7 N 2.20 5.26 -0.10 2.17 1.09 -1.26 -5.00 121.20 125.56 3hzi s ILE 7 Ca 0.36 0.26 0.14 0.00 -1.10 0.00 0.00 60.65 60.31 3hzi s ILE 7 Cb -0.16 -3.58 0.30 0.00 -1.06 0.00 0.00 42.46 37.96 3hzi s ILE 7 CO 0.11 0.39 1.14 -1.22 -0.10 0.00 0.00 174.94 175.26 3hzi n TYR 8 N 1.20 0.00 -3.60 3.97 4.02 -1.26 -5.06 117.16 116.43 3hzi n TYR 8 Ca -0.12 -0.85 -0.07 0.00 -0.01 0.00 0.00 57.90 56.85 3hzi n TYR 8 Cb 0.53 -0.16 -0.04 0.00 -0.02 0.00 0.00 39.34 39.65 3hzi n TYR 8 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3hzi s SER 9 N -2.44 -0.24 0.32 7.72 1.04 -1.26 -4.99 113.70 113.85 3hzi s SER 9 Ca 0.28 0.23 0.04 0.00 0.48 0.00 0.00 55.95 56.98 3hzi s SER 9 Cb 0.27 0.21 0.66 0.00 0.10 0.00 0.00 66.02 67.26 3hzi s SER 9 CO -0.04 -0.25 1.88 -0.65 0.98 0.00 0.00 173.24 175.16 3hzi h PRO 10 N 2.31 0.84 -0.56 4.02 0.11 -1.96 0.74 132.00 137.51 3hzi h PRO 10 Ca -0.14 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.81 3hzi h PRO 10 Cb 1.17 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 3hzi h PRO 10 CO 0.27 0.56 -0.06 1.15 -0.21 0.00 0.00 178.00 179.71 3hzi h THR 11 N 0.87 1.27 -0.89 -1.15 2.02 -1.95 0.11 112.91 113.19 3hzi h THR 11 Ca 0.43 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 66.40 3hzi h THR 11 Cb 0.46 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 3hzi h THR 11 CO -0.19 0.43 0.57 -0.61 0.37 0.00 0.00 175.52 176.09 3hzi h GLN 12 N 0.91 1.19 0.30 6.66 4.15 -1.62 -2.56 115.11 124.15 3hzi h GLN 12 Ca 0.15 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 3hzi h GLN 12 Cb 0.62 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.05 3hzi h GLN 12 CO 0.04 0.81 -0.14 1.25 -1.93 0.00 0.00 178.83 178.86 3hzi h LEU 13 N 1.22 -0.34 0.01 -2.39 6.46 0.03 -2.04 115.31 118.25 3hzi h LEU 13 Ca 0.32 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.12 3hzi h LEU 13 Cb -0.10 0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 39.88 3hzi h LEU 13 CO -0.07 -0.23 -0.21 0.00 -0.62 0.00 0.00 178.44 177.31 3hzi h ALA 14 N 0.30 -0.28 -0.41 1.25 0.00 -0.63 -0.67 119.26 118.81 3hzi h ALA 14 Ca -0.04 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.95 3hzi h ALA 14 Cb 0.31 0.37 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 3hzi h ALA 14 CO 0.07 -0.71 -0.11 -0.91 0.00 0.00 0.00 179.25 177.59 3hzi h ASN 15 N -0.34 -0.39 -0.12 0.00 2.35 -1.44 1.45 115.58 117.09 3hzi h ASN 15 Ca 0.06 0.13 0.05 0.00 -0.55 0.00 0.00 56.30 55.98 3hzi h ASN 15 Cb 0.41 0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.98 3hzi h ASN 15 CO -0.19 -0.14 -0.34 0.00 -1.65 0.00 0.00 177.43 175.11 3hzi h ALA 16 N 1.41 -0.42 -0.13 -0.83 0.00 -0.83 0.91 119.26 119.37 3hzi h ALA 16 Ca 0.20 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3hzi h ALA 16 Cb 0.31 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3hzi h ALA 16 CO -0.43 -0.82 -0.45 0.52 0.00 0.00 0.00 179.25 178.07 3hzi h MET 17 N -0.42 0.32 0.13 0.00 2.86 -0.24 -2.21 114.93 115.38 3hzi h MET 17 Ca 0.09 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3hzi h MET 17 Cb 0.56 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.23 3hzi h MET 17 CO -0.35 0.71 -0.06 -0.22 1.06 0.00 0.00 176.91 178.04 3hzi h LYS 18 N 0.26 -0.17 -0.28 1.72 3.64 0.26 -0.50 116.57 121.50 3hzi h LYS 18 Ca 0.02 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 3hzi h LYS 18 Cb 0.90 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.68 3hzi h LYS 18 CO 0.07 -0.11 -0.43 1.25 -2.27 0.00 0.00 179.45 177.96 3hzi h LEU 19 N -0.19 -1.41 -0.47 5.20 6.46 -0.67 0.19 115.31 124.43 3hzi h LEU 19 Ca -0.02 0.20 0.10 0.00 -0.12 0.00 0.00 57.88 58.04 3hzi h LEU 19 Cb 0.14 0.59 -0.09 0.00 -0.73 0.00 0.00 40.66 40.57 3hzi h LEU 19 CO 0.03 -0.40 -0.14 0.58 -0.62 0.00 0.00 178.44 177.89 3hzi h VAL 20 N -0.41 0.49 0.14 1.05 2.07 -0.84 0.49 116.25 119.24 3hzi h VAL 20 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.63 3hzi h VAL 20 Cb 0.61 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3hzi h VAL 20 CO -0.50 0.00 -0.14 -0.09 0.02 0.00 0.00 177.57 176.86 3hzi h ARG 21 N -0.03 -0.30 -0.98 1.57 2.43 -0.06 -1.19 114.38 115.82 3hzi h ARG 21 Ca 0.23 0.02 0.19 0.00 -0.81 0.00 0.00 59.98 59.61 3hzi h ARG 21 Cb 0.37 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 29.88 3hzi h ARG 21 CO -0.50 -0.20 0.58 1.96 -1.51 0.00 0.00 179.97 180.30 3hzi h GLN 22 N -0.31 0.69 -0.59 0.20 4.20 0.11 -1.84 115.11 117.58 3hzi h GLN 22 Ca 0.01 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 3hzi h GLN 22 Cb 0.30 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 3hzi h GLN 22 CO -0.04 0.46 0.25 1.96 -0.67 0.00 0.00 178.83 180.78 3hzi h GLN 23 N 0.72 0.87 -0.81 1.46 1.08 0.98 -2.32 115.11 117.08 3hzi h GLN 23 Ca 0.57 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 3hzi h GLN 23 Cb 0.90 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 28.19 3hzi h GLN 23 CO -0.40 0.73 0.00 0.09 -0.95 0.00 0.00 178.83 178.31 3hzi n ASN 24 N -4.49 2.59 -3.52 1.46 4.13 -0.56 -4.90 115.26 109.97 3hzi n ASN 24 Ca 0.03 -2.31 -0.26 0.00 1.68 0.00 0.00 54.58 53.73 3hzi n ASN 24 Cb 0.15 -0.54 0.01 0.00 -1.54 0.00 0.00 39.78 37.87 3hzi n ASN 24 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hzi n GLY 25 N 0.28 -0.50 3.94 7.41 0.00 -0.87 -4.96 105.19 110.49 3hzi n GLY 25 Ca 0.10 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 3hzi n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hzi s TRP 26 N -3.11 3.48 0.06 1.61 0.51 -0.97 -5.05 118.94 115.48 3hzi s TRP 26 Ca 0.49 0.23 0.05 0.00 -2.12 0.00 0.00 56.10 54.75 3hzi s TRP 26 Cb -0.25 -1.77 -0.04 0.00 -0.81 0.00 0.00 33.47 30.61 3hzi s TRP 26 CO 0.60 0.41 -0.06 0.95 -0.51 0.00 0.00 176.95 178.34 3hzi s THR 27 N -1.88 3.67 0.42 2.01 -4.23 -1.26 -4.61 115.64 109.76 3hzi s THR 27 Ca 0.37 -0.99 0.17 0.00 -1.18 0.00 0.00 61.69 60.06 3hzi s THR 27 Cb -0.11 -2.68 0.37 0.00 1.34 0.00 0.00 72.50 71.42 3hzi s THR 27 CO 0.29 0.22 1.87 1.56 -0.54 0.00 0.00 174.62 178.03 3hzi h GLN 28 N 3.92 0.41 -0.48 3.99 4.20 -1.99 0.94 115.11 126.10 3hzi h GLN 28 Ca -0.48 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.12 3hzi h GLN 28 Cb 1.17 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.84 3hzi h GLN 28 CO 0.55 0.27 -0.02 0.77 -0.67 0.00 0.00 178.83 179.73 3hzi h SER 29 N 0.42 0.84 0.00 1.46 0.02 -1.94 -2.35 113.55 112.01 3hzi h SER 29 Ca 0.45 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3hzi h SER 29 Cb 1.09 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.40 3hzi h SER 29 CO -0.17 0.96 0.00 -0.62 -1.14 0.00 0.00 176.83 175.86 3hzi n GLU 30 N -4.33 0.00 -0.33 3.45 1.02 0.31 -2.34 120.64 118.43 3hzi n GLU 30 Ca 0.00 0.44 0.12 0.00 -0.02 0.00 0.00 57.16 57.70 3hzi n GLU 30 Cb 0.32 -1.36 0.25 0.00 -0.02 0.00 0.00 31.44 30.63 3hzi n GLU 30 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hzi h LEU 31 N 0.00 -0.48 -0.49 -4.62 3.38 -1.62 0.41 115.31 111.89 3hzi h LEU 31 Ca 0.00 0.26 0.07 0.00 0.09 0.00 0.00 57.88 58.30 3hzi h LEU 31 Cb 0.00 0.46 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 3hzi h LEU 31 CO 0.00 -0.31 0.16 0.00 0.09 0.00 0.00 178.44 178.38 3hzi h ALA 32 N 1.92 0.58 -0.22 1.53 0.00 -1.38 -2.03 119.26 119.67 3hzi h ALA 32 Ca 0.55 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.48 3hzi h ALA 32 Cb 1.08 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3hzi h ALA 32 CO -0.87 -0.24 -0.06 0.87 0.00 0.00 0.00 179.25 178.95 3hzi h LYS 33 N 0.32 0.34 -0.06 0.00 1.57 -0.52 -2.01 116.57 116.22 3hzi h LYS 33 Ca 0.23 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 3hzi h LYS 33 Cb 0.26 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3hzi h LYS 33 CO -0.25 0.42 -0.62 0.87 -0.57 0.00 0.00 179.45 179.29 3hzi h LYS 34 N 0.33 0.21 -0.20 3.15 1.57 -1.13 -3.30 116.57 117.18 3hzi h LYS 34 Ca 0.07 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3hzi h LYS 34 Cb 0.32 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3hzi h LYS 34 CO 0.01 0.76 0.00 0.44 -0.57 0.00 0.00 179.45 180.10 3hzi n ILE 35 N -3.85 2.15 -3.62 1.86 -5.35 -0.93 -5.02 119.36 104.60 3hzi n ILE 35 Ca -0.02 -1.93 -0.23 0.00 -0.27 0.00 0.00 62.75 60.30 3hzi n ILE 35 Cb 0.63 -0.22 0.07 0.00 -1.74 0.00 0.00 39.64 38.37 3hzi n ILE 35 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hzi n GLY 36 N -0.68 -0.45 3.18 3.28 0.00 -0.78 -4.99 105.19 104.74 3hzi n GLY 36 Ca 0.20 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.28 3hzi n GLY 36 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hzi s ILE 37 N -3.38 0.80 0.44 -0.61 -4.36 -1.03 -5.07 121.20 107.99 3hzi s ILE 37 Ca 0.34 -1.85 -0.24 0.00 -0.26 0.00 0.00 60.65 58.65 3hzi s ILE 37 Cb -0.16 -1.58 -0.08 0.00 1.25 0.00 0.00 42.46 41.89 3hzi s ILE 37 CO 0.76 -0.77 1.17 -0.54 0.24 0.00 0.00 174.94 175.80 3hzi s LYS 38 N -3.49 3.88 0.39 0.37 1.02 -1.26 -4.39 119.74 116.26 3hzi s LYS 38 Ca 0.10 1.80 0.28 0.00 0.02 0.00 0.00 55.97 58.17 3hzi s LYS 38 Cb 0.02 -2.51 1.18 0.00 -0.52 0.00 0.00 37.83 36.00 3hzi s LYS 38 CO -0.03 -0.46 1.84 0.37 -0.92 0.00 0.00 175.35 176.15 3hzi h GLN 39 N 2.28 0.00 -0.10 1.68 -0.00 -1.92 0.56 115.11 117.60 3hzi h GLN 39 Ca -0.49 0.00 -0.19 0.00 -0.00 0.00 0.00 58.65 57.97 3hzi h GLN 39 Cb 1.24 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 28.72 3hzi h GLN 39 CO 0.61 0.00 -0.73 0.00 0.00 0.00 0.00 178.83 178.71 3hzi h ALA 40 N 2.14 0.52 -0.87 3.38 0.00 -1.94 -2.22 119.26 120.27 3hzi h ALA 40 Ca 0.00 -0.60 0.03 0.00 0.00 0.00 0.00 54.91 54.34 3hzi h ALA 40 Cb 0.41 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 3hzi h ALA 40 CO 0.00 0.74 0.58 1.15 0.00 0.00 0.00 179.25 181.71 3hzi h THR 41 N 0.36 1.17 -0.18 0.00 2.02 -1.26 0.34 112.91 115.36 3hzi h THR 41 Ca -0.03 -0.38 -0.20 0.00 0.77 0.00 0.00 66.41 66.56 3hzi h THR 41 Cb 1.32 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3hzi h THR 41 CO 0.13 0.20 -0.67 0.40 0.37 0.00 0.00 175.52 175.95 3hzi h ILE 42 N 1.12 1.30 -0.57 3.11 2.04 -1.38 -1.38 117.51 121.75 3hzi h ILE 42 Ca 0.34 -1.91 -0.06 0.00 1.00 0.00 0.00 64.86 64.23 3hzi h ILE 42 Cb -0.02 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 3hzi h ILE 42 CO -0.09 0.60 0.12 -1.28 0.00 0.00 0.00 178.15 177.50 3hzi h SER 43 N 0.51 0.83 0.01 1.72 0.87 -0.67 -2.26 113.55 114.56 3hzi h SER 43 Ca -0.02 -0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.38 3hzi h SER 43 Cb 1.28 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 3hzi h SER 43 CO 0.14 0.82 -0.01 -1.13 -0.53 0.00 0.00 176.83 176.12 3hzi h ASN 44 N 0.85 -0.01 -0.22 6.23 -1.24 -0.27 -2.65 115.58 118.26 3hzi h ASN 44 Ca 0.18 -0.12 0.06 0.00 0.71 0.00 0.00 56.30 57.14 3hzi h ASN 44 Cb 0.33 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.37 3hzi h ASN 44 CO 0.00 0.11 0.21 0.15 -1.29 0.00 0.00 177.43 176.61 3hzi h PHE 45 N -0.14 0.00 -0.02 0.67 3.57 -0.92 0.13 116.94 120.23 3hzi h PHE 45 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3hzi h PHE 45 Cb 0.13 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.87 3hzi h PHE 45 CO -0.04 0.00 -0.08 0.39 -2.23 0.00 0.00 178.31 176.36 3hzi n GLU 46 N -4.00 1.54 0.00 1.11 1.02 -0.88 -3.51 120.64 115.93 3hzi n GLU 46 Ca 0.03 -0.98 0.00 0.00 -0.02 0.00 0.00 57.16 56.18 3hzi n GLU 46 Cb 0.35 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 3hzi n GLU 46 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3hzi n ASN 47 N 0.13 3.30 -2.69 1.62 3.02 -0.63 -4.84 115.26 115.18 3hzi n ASN 47 Ca 0.16 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.56 3hzi n ASN 47 Cb 0.39 0.48 0.01 0.00 -0.61 0.00 0.00 39.78 40.06 3hzi n ASN 47 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3hzi n ASN 48 N -1.26 2.29 0.00 6.41 4.13 0.34 -4.91 115.26 122.27 3hzi n ASN 48 Ca 0.00 -3.03 0.02 0.00 1.68 0.00 0.00 54.58 53.25 3hzi n ASN 48 Cb 0.18 -0.52 0.09 0.00 -1.54 0.00 0.00 39.78 37.98 3hzi n ASN 48 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3hzi n PRO 49 N -0.13 0.03 -0.10 3.52 -0.04 -1.23 -3.20 135.00 133.84 3hzi n PRO 49 Ca 0.19 0.35 -0.07 0.00 -0.04 0.00 0.00 63.50 63.93 3hzi n PRO 49 Cb 0.74 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.71 3hzi n PRO 49 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3hzi h ASP 50 N 0.00 0.18 -3.86 3.54 3.32 -1.90 -3.30 116.42 114.40 3hzi h ASP 50 Ca 0.00 0.03 -0.73 0.00 0.02 0.00 0.00 57.03 56.35 3hzi h ASP 50 Cb 0.05 -0.00 -0.31 0.00 0.22 0.00 0.00 39.33 39.29 3hzi h ASP 50 CO 0.00 0.14 -0.23 0.20 -1.72 0.00 0.00 179.24 177.63 3hzi s ASN 51 N -5.38 5.79 -0.22 6.45 0.01 -1.20 -5.00 114.94 115.39 3hzi s ASN 51 Ca -0.13 -2.60 -0.04 0.00 -0.71 0.00 0.00 52.86 49.38 3hzi s ASN 51 Cb 0.11 -1.99 0.12 0.00 0.41 0.00 0.00 41.25 39.90 3hzi s ASN 51 CO 0.71 -0.50 0.37 -0.89 -1.51 0.00 0.00 177.10 175.28 3hzi s THR 52 N 0.31 -0.58 0.19 1.60 2.01 -1.24 -5.05 115.64 112.88 3hzi s THR 52 Ca 0.15 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.99 3hzi s THR 52 Cb -0.18 -0.74 -0.11 0.00 0.01 0.00 0.00 72.50 71.48 3hzi s THR 52 CO -0.04 -0.07 0.23 0.41 -0.69 0.00 0.00 174.62 174.46 3hzi n THR 53 N 5.37 0.95 -0.24 -0.82 -1.04 -1.26 -4.73 114.28 112.51 3hzi n THR 53 Ca -0.05 -0.33 -0.07 0.00 -2.04 0.00 0.00 64.05 61.56 3hzi n THR 53 Cb 0.50 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.05 3hzi n THR 53 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3hzi h LEU 54 N 0.48 0.88 -0.30 -4.42 3.38 -2.00 -2.36 115.31 110.96 3hzi h LEU 54 Ca -0.21 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 57.69 3hzi h LEU 54 Cb 0.95 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 41.41 3hzi h LEU 54 CO 0.35 0.77 -0.15 0.74 0.09 0.00 0.00 178.44 180.25 3hzi h THR 55 N 0.92 0.55 -0.92 0.22 2.02 -2.00 0.22 112.91 113.93 3hzi h THR 55 Ca 0.23 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.52 3hzi h THR 55 Cb 0.14 0.55 -0.08 0.00 -1.74 0.00 0.00 68.15 67.02 3hzi h THR 55 CO -0.03 0.00 0.55 0.74 0.37 0.00 0.00 175.52 177.15 3hzi h THR 56 N -0.10 0.91 0.46 3.16 2.02 -1.87 -0.02 112.91 117.46 3hzi h THR 56 Ca 0.16 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 3hzi h THR 56 Cb 0.34 -0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 3hzi h THR 56 CO -0.37 0.16 -0.51 0.15 0.37 0.00 0.00 175.52 175.33 3hzi h PHE 57 N 0.89 -1.42 -0.74 3.16 3.57 -0.10 -1.65 116.94 120.64 3hzi h PHE 57 Ca 0.45 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.92 3hzi h PHE 57 Cb 0.44 0.56 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 3hzi h PHE 57 CO -0.03 -0.67 0.28 0.74 -2.23 0.00 0.00 178.31 176.40 3hzi h PHE 58 N -0.98 1.14 0.59 0.41 -1.00 -0.33 0.03 116.94 116.80 3hzi h PHE 58 Ca -0.06 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.61 3hzi h PHE 58 Cb 0.86 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 40.07 3hzi h PHE 58 CO -0.28 0.88 -0.47 0.87 -1.61 0.00 0.00 178.31 177.70 3hzi h LYS 59 N 1.09 -0.99 -0.71 1.51 1.57 -0.89 0.94 116.57 119.08 3hzi h LYS 59 Ca 0.25 0.07 0.13 0.00 -1.87 0.00 0.00 60.65 59.23 3hzi h LYS 59 Cb 0.23 0.23 -0.13 0.00 0.08 0.00 0.00 32.23 32.64 3hzi h LYS 59 CO -0.02 -0.66 -0.25 0.82 -0.57 0.00 0.00 179.45 178.77 3hzi h ILE 60 N -1.03 0.20 -0.99 1.86 2.04 -1.24 0.31 117.51 118.67 3hzi h ILE 60 Ca -0.08 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.96 3hzi h ILE 60 Cb 0.86 0.20 -0.10 0.00 -0.74 0.00 0.00 36.82 37.05 3hzi h ILE 60 CO 0.01 0.00 0.62 0.25 0.00 0.00 0.00 178.15 179.03 3hzi h LEU 61 N -0.06 0.78 -0.12 1.44 6.46 0.04 -1.59 115.31 122.26 3hzi h LEU 61 Ca 0.31 0.08 -0.12 0.00 -0.12 0.00 0.00 57.88 58.03 3hzi h LEU 61 Cb 0.55 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 3hzi h LEU 61 CO -0.75 0.32 -0.41 1.56 -0.62 0.00 0.00 178.44 178.54 3hzi h GLN 62 N 0.78 0.50 -0.02 1.25 1.08 0.44 -2.69 115.11 116.45 3hzi h GLN 62 Ca 0.54 -0.37 0.01 0.00 -1.45 0.00 0.00 58.65 57.38 3hzi h GLN 62 Cb 0.82 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 28.32 3hzi h GLN 62 CO -0.32 0.99 0.04 0.66 -0.95 0.00 0.00 178.83 179.24 3hzi h SER 63 N 0.10 0.00 0.22 1.46 4.64 0.04 0.53 113.55 120.54 3hzi h SER 63 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3hzi h SER 63 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3hzi h SER 63 CO 0.09 0.00 -0.24 0.18 -0.87 0.00 0.00 176.83 175.98 3hzi n LEU 64 N -3.44 1.05 -2.52 5.97 4.77 -0.83 -4.94 117.00 117.06 3hzi n LEU 64 Ca -0.02 -0.27 -0.18 0.00 -0.03 0.00 0.00 56.01 55.50 3hzi n LEU 64 Cb 0.12 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 3hzi n LEU 64 CO 0.23 0.20 0.03 -0.62 -1.33 0.00 0.00 177.39 175.90 3hzi n GLU 65 N -0.61 -4.33 -4.53 3.23 1.02 0.19 -5.01 120.64 110.60 3hzi n GLU 65 Ca 0.12 0.71 -0.27 0.00 -0.02 0.00 0.00 57.16 57.71 3hzi n GLU 65 Cb 0.35 -5.19 -0.10 0.00 -0.02 0.00 0.00 31.44 26.48 3hzi n GLU 65 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hzi s LEU 66 N -5.48 2.88 0.00 -4.62 1.02 -1.03 -5.06 118.68 106.38 3hzi s LEU 66 Ca 0.28 -1.27 0.00 0.00 0.02 0.00 0.00 54.13 53.16 3hzi s LEU 66 Cb -0.12 -1.01 0.00 0.00 0.02 0.00 0.00 46.19 45.08 3hzi s LEU 66 CO 0.35 -0.39 0.00 -1.54 0.02 0.00 0.00 176.35 174.79 3hzi n SER 67 N -0.96 0.86 -3.60 2.29 3.41 -1.26 -4.48 113.62 109.88 3hzi n SER 67 Ca -0.05 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.43 3hzi n SER 67 Cb 0.66 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.54 3hzi n SER 67 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3hzi s MET 68 N 1.55 0.81 0.16 4.33 1.75 -1.26 -5.06 119.30 121.58 3hzi s MET 68 Ca 0.00 0.63 -0.02 0.00 -1.25 0.00 0.00 55.69 55.04 3hzi s MET 68 Cb 0.00 0.39 -0.03 0.00 2.84 0.00 0.00 34.83 38.02 3hzi s MET 68 CO 0.00 -0.16 0.13 -0.08 -0.65 0.00 0.00 175.02 174.25 3hzi s THR 69 N -0.24 0.06 -0.18 10.11 -1.32 -1.26 -5.14 115.64 117.66 3hzi s THR 69 Ca -0.03 -1.86 -0.02 0.00 -1.21 0.00 0.00 61.69 58.58 3hzi s THR 69 Cb -0.03 -2.18 -0.01 0.00 -1.51 0.00 0.00 72.50 68.77 3hzi s THR 69 CO 0.02 -0.27 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.32 3hzi s LEU 70 N -3.08 2.77 0.32 9.08 1.43 -1.26 -5.11 118.68 122.83 3hzi s LEU 70 Ca 0.28 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3hzi s LEU 70 Cb 0.06 -1.67 -0.06 0.00 0.03 0.00 0.00 46.19 44.55 3hzi s LEU 70 CO 0.05 0.05 0.06 0.00 0.23 0.00 0.00 176.35 176.74 3hzi s ASP 72 N -3.48 7.49 0.00 0.00 1.01 -1.26 -4.92 116.67 115.51 3hzi s ASP 72 Ca 0.36 2.07 0.00 0.00 0.71 0.00 0.00 52.55 55.69 3hzi s ASP 72 Cb 0.09 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.40 3hzi s ASP 72 CO 0.15 0.04 0.76 0.00 0.21 0.00 0.00 175.17 176.33 3hzi n ALA 73 N 1.34 2.27 -0.01 5.23 0.00 -1.26 -5.12 120.51 122.96 3hzi n ALA 73 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3hzi n ALA 73 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3hzi n ALA 73 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13