#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mzo n GLY 2 N 0.00 2.27 0.23 -0.02 0.00 0.14 -4.72 105.19 103.09 3mzo n GLY 2 Ca 0.00 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 44.14 3mzo n GLY 2 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3mzo h ILE 3 N 0.00 1.05 -0.68 -0.61 1.08 -1.98 -2.07 117.51 114.30 3mzo h ILE 3 Ca 0.00 -0.68 0.10 0.00 -0.39 0.00 0.00 64.86 63.89 3mzo h ILE 3 Cb 0.00 1.38 -0.08 0.00 -3.07 0.00 0.00 36.82 35.05 3mzo h ILE 3 CO 0.00 0.19 0.29 -0.74 -0.69 0.00 0.00 178.15 177.20 3mzo h HIS 4 N 0.00 0.51 -0.41 1.37 -0.00 -1.93 0.49 115.15 115.18 3mzo h HIS 4 Ca -0.00 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.32 3mzo h HIS 4 Cb 0.36 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 3mzo h HIS 4 CO 0.00 0.14 -0.06 1.96 -0.00 0.00 0.00 177.93 179.97 3mzo h GLN 5 N 0.49 0.70 -0.20 5.26 1.08 -1.66 -0.44 115.11 120.33 3mzo h GLN 5 Ca 0.35 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.33 3mzo h GLN 5 Cb 0.43 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 3mzo h GLN 5 CO -0.31 0.75 0.07 -0.92 -0.95 0.00 0.00 178.83 177.47 3mzo h TYR 6 N 0.65 0.32 -0.98 2.96 3.20 -1.10 -1.95 116.97 120.07 3mzo h TYR 6 Ca 0.12 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.00 3mzo h TYR 6 Cb 0.49 -0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.61 3mzo h TYR 6 CO 0.02 0.38 0.64 0.74 -1.64 0.00 0.00 178.16 178.31 3mzo h PHE 7 N 0.16 1.20 -0.81 -3.82 0.04 0.37 -2.05 116.94 112.03 3mzo h PHE 7 Ca 0.07 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.82 3mzo h PHE 7 Cb 0.21 -0.40 -0.04 0.00 2.20 0.00 0.00 35.95 37.92 3mzo h PHE 7 CO -0.00 0.70 0.33 1.96 -0.60 0.00 0.00 178.31 180.70 3mzo h GLN 8 N 1.25 1.21 0.00 1.51 4.20 -0.93 -2.22 115.11 120.13 3mzo h GLN 8 Ca 0.39 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 3mzo h GLN 8 Cb -0.01 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.57 3mzo h GLN 8 CO -0.12 0.97 -0.01 0.66 -0.67 0.00 0.00 178.83 179.66 3mzo h SER 9 N 1.18 0.00 -0.81 1.46 4.64 -0.63 -1.98 113.55 117.41 3mzo h SER 9 Ca 0.27 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.57 3mzo h SER 9 Cb 0.20 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.26 3mzo h SER 9 CO -0.02 0.01 0.40 -0.07 -0.87 0.00 0.00 176.83 176.28 3mzo h LEU 10 N 0.00 1.05 -1.35 5.97 3.38 -1.14 -1.61 115.31 121.61 3mzo h LEU 10 Ca -0.00 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3mzo h LEU 10 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3mzo h LEU 10 CO 0.00 0.88 -0.31 0.28 0.09 0.00 0.00 178.44 179.38 3mzo h SER 11 N 1.15 0.00 -0.26 -0.43 0.02 -1.46 -3.02 113.55 109.55 3mzo h SER 11 Ca 0.28 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.24 3mzo h SER 11 Cb 0.10 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 3mzo h SER 11 CO -0.04 0.31 0.17 0.44 -1.14 0.00 0.00 176.83 176.57 3mzo h ASP 12 N 0.00 0.26 0.38 3.07 3.32 -1.22 -1.67 116.42 120.56 3mzo h ASP 12 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3mzo h ASP 12 Cb 0.63 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3mzo h ASP 12 CO 0.04 0.18 0.00 0.18 -1.72 0.00 0.00 179.24 177.92 3mzo n LEU 13 N -4.50 0.00 0.11 1.55 4.77 -1.14 -1.16 117.00 116.63 3mzo n LEU 13 Ca 0.01 0.37 0.13 0.00 -0.03 0.00 0.00 56.01 56.49 3mzo n LEU 13 Cb 0.11 -0.37 0.42 0.00 -2.33 0.00 0.00 43.42 41.25 3mzo n LEU 13 CO 0.35 -0.18 0.89 -0.62 -1.33 0.00 0.00 177.39 176.49 3mzo n GLU 14 N -1.37 0.25 -0.30 3.23 1.02 -0.63 -1.89 120.64 120.95 3mzo n GLU 14 Ca 0.06 0.24 0.07 0.00 -0.02 0.00 0.00 57.16 57.51 3mzo n GLU 14 Cb 0.14 -1.81 0.20 0.00 -0.02 0.00 0.00 31.44 29.96 3mzo n GLU 14 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3mzo n ASN 15 N -2.24 3.35 -4.23 1.62 3.02 -0.31 -4.80 115.26 111.67 3mzo n ASN 15 Ca 0.05 -2.62 -0.33 0.00 -0.03 0.00 0.00 54.58 51.65 3mzo n ASN 15 Cb 0.40 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 39.02 3mzo n ASN 15 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3mzo s ILE 16 N -2.10 2.53 0.08 2.41 1.01 -1.24 -5.08 121.20 118.81 3mzo s ILE 16 Ca 0.33 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 60.22 3mzo s ILE 16 Cb 0.24 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 3mzo s ILE 16 CO 0.10 0.52 -0.02 -0.31 0.00 0.00 0.00 174.94 175.23 3mzo s TYR 17 N 0.93 2.95 0.49 3.97 2.02 -1.26 -1.01 117.35 125.44 3mzo s TYR 17 Ca -0.03 -0.04 -0.20 0.00 -0.37 0.00 0.00 57.07 56.43 3mzo s TYR 17 Cb -0.15 -1.53 -0.08 0.00 -0.40 0.00 0.00 41.96 39.79 3mzo s TYR 17 CO -0.02 0.47 1.02 1.03 -1.57 0.00 0.00 175.55 176.47 3mzo s ARG 18 N -2.22 3.85 -1.22 -0.62 1.81 -0.07 -3.99 118.95 116.49 3mzo s ARG 18 Ca 0.24 1.28 -0.20 0.00 -1.72 0.00 0.00 55.73 55.33 3mzo s ARG 18 Cb -0.12 -2.11 0.01 0.00 -0.45 0.00 0.00 34.95 32.28 3mzo s ARG 18 CO 0.17 -0.38 0.67 0.00 -0.68 0.00 0.00 175.30 175.08 3mzo s PRO 20 N -6.51 3.33 0.00 0.00 0.04 -1.26 -3.58 135.00 127.03 3mzo s PRO 20 Ca 0.38 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.68 3mzo s PRO 20 Cb -0.16 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.35 3mzo s PRO 20 CO 0.90 -0.81 0.00 0.41 0.04 0.00 0.00 177.00 177.54 3mzo n GLY 21 N -0.81 0.75 3.21 0.56 0.00 -1.26 -5.05 105.19 102.58 3mzo n GLY 21 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 3mzo n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mzo s LYS 22 N -0.49 1.15 0.22 1.61 -0.14 -1.23 -5.12 119.74 115.74 3mzo s LYS 22 Ca 0.00 -0.89 -0.31 0.00 -1.36 0.00 0.00 55.97 53.41 3mzo s LYS 22 Cb 0.00 -1.23 -0.11 0.00 -1.68 0.00 0.00 37.83 34.81 3mzo s LYS 22 CO 0.00 0.31 1.61 0.12 -0.76 0.00 0.00 175.35 176.63 3mzo s PHE 23 N -0.87 2.92 -0.01 3.18 5.36 -1.26 -5.01 117.98 122.29 3mzo s PHE 23 Ca 0.04 0.61 -0.15 0.00 -0.96 0.00 0.00 56.93 56.48 3mzo s PHE 23 Cb -0.09 -4.03 0.02 0.00 -0.34 0.00 0.00 43.02 38.59 3mzo s PHE 23 CO 0.02 -3.69 0.32 -1.59 -1.46 0.00 0.00 175.22 168.82 3mzo s LYS 24 N 0.56 0.70 0.21 10.12 -2.85 -1.26 -4.97 119.74 122.24 3mzo s LYS 24 Ca 0.69 -0.22 0.04 0.00 -1.00 0.00 0.00 55.97 55.49 3mzo s LYS 24 Cb -0.47 0.31 0.16 0.00 -2.06 0.00 0.00 37.83 35.77 3mzo s LYS 24 CO 0.37 -0.20 1.49 1.88 0.10 0.00 0.00 175.35 179.00 3mzo h TYR 25 N 3.77 0.26 -3.41 1.78 0.05 -1.94 -3.44 116.97 114.03 3mzo h TYR 25 Ca -0.30 -0.12 -0.47 0.00 0.05 0.00 0.00 58.73 57.90 3mzo h TYR 25 Cb 1.18 -0.04 -0.34 0.00 1.01 0.00 0.00 36.73 38.54 3mzo h TYR 25 CO 0.51 0.84 -0.79 -0.65 -1.05 0.00 0.00 178.16 177.02 3mzo s GLN 26 N -3.51 1.26 0.13 4.88 -0.21 -1.26 -5.14 119.66 115.81 3mzo s GLN 26 Ca -0.03 -0.24 -0.03 0.00 0.02 0.00 0.00 55.36 55.07 3mzo s GLN 26 Cb 0.11 -1.15 -0.05 0.00 1.00 0.00 0.00 33.01 32.92 3mzo s GLN 26 CO 0.81 -0.06 0.35 -1.83 -2.12 0.00 0.00 175.29 172.43 3mzo s GLU 27 N 0.91 3.57 -0.07 2.91 -1.05 -1.26 -5.08 118.70 118.64 3mzo s GLU 27 Ca -0.11 -0.19 0.01 0.00 -0.15 0.00 0.00 54.97 54.54 3mzo s GLU 27 Cb -0.15 -2.88 0.02 0.00 -0.44 0.00 0.00 34.13 30.68 3mzo s GLU 27 CO 0.01 0.49 -0.09 -1.01 0.95 0.00 0.00 175.26 175.60 3mzo s HIS 28 N -1.66 1.27 0.71 4.83 3.76 -1.26 -5.05 115.29 117.90 3mzo s HIS 28 Ca 0.40 -0.48 -0.11 0.00 -0.15 0.00 0.00 55.06 54.71 3mzo s HIS 28 Cb -0.12 -0.99 0.02 0.00 1.11 0.00 0.00 32.58 32.60 3mzo s HIS 28 CO 0.26 -0.29 1.10 -1.54 -0.85 0.00 0.00 174.74 173.42 3mzo s SER 29 N 0.91 5.39 0.23 1.40 1.04 -1.26 -0.89 113.70 120.52 3mzo s SER 29 Ca -0.10 1.10 -0.05 0.00 0.48 0.00 0.00 55.95 57.38 3mzo s SER 29 Cb -0.15 -1.88 0.24 0.00 0.10 0.00 0.00 66.02 64.33 3mzo s SER 29 CO 0.01 -1.37 1.75 0.58 0.98 0.00 0.00 173.24 175.18 3mzo h VAL 30 N -0.68 1.25 -0.38 5.02 2.07 -0.94 -0.22 116.25 122.38 3mzo h VAL 30 Ca -0.45 -0.97 0.07 0.00 0.82 0.00 0.00 66.70 66.17 3mzo h VAL 30 Cb 1.26 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 3mzo h VAL 30 CO 0.64 0.36 0.00 0.00 0.02 0.00 0.00 177.57 178.59 3mzo h ALA 31 N 1.19 0.35 -0.46 1.67 0.00 -1.65 0.23 119.26 120.59 3mzo h ALA 31 Ca 0.19 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3mzo h ALA 31 Cb 0.40 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3mzo h ALA 31 CO 0.01 -0.39 0.15 0.93 0.00 0.00 0.00 179.25 179.95 3mzo h GLU 32 N 0.11 0.72 -0.65 0.00 5.08 -1.72 -1.25 114.58 116.87 3mzo h GLU 32 Ca 0.18 -0.15 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3mzo h GLU 32 Cb 0.25 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 3mzo h GLU 32 CO -0.30 0.69 0.36 1.25 -1.00 0.00 0.00 179.01 180.00 3mzo h HIS 33 N 0.61 0.66 -0.55 4.33 2.76 -0.64 -1.51 115.15 120.81 3mzo h HIS 33 Ca 0.15 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.31 3mzo h HIS 33 Cb 0.26 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 3mzo h HIS 33 CO 0.01 0.32 0.22 0.77 -1.30 0.00 0.00 177.93 177.95 3mzo h SER 34 N 0.67 0.76 -0.51 3.26 0.02 -0.60 0.10 113.55 117.24 3mzo h SER 34 Ca 0.29 -0.17 0.06 0.00 -0.84 0.00 0.00 61.79 61.13 3mzo h SER 34 Cb 0.18 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.47 3mzo h SER 34 CO -0.18 0.72 0.22 0.22 -1.14 0.00 0.00 176.83 176.67 3mzo h TYR 35 N 0.75 0.40 -0.09 3.45 3.20 -0.86 -1.46 116.97 122.36 3mzo h TYR 35 Ca 0.18 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 3mzo h TYR 35 Cb 0.20 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.37 3mzo h TYR 35 CO 0.01 0.16 -0.28 0.87 -1.64 0.00 0.00 178.16 177.28 3mzo h LYS 36 N 0.43 0.34 -0.72 1.82 1.57 -0.77 -1.74 116.57 117.51 3mzo h LYS 36 Ca 0.24 -0.25 0.09 0.00 -1.87 0.00 0.00 60.65 58.85 3mzo h LYS 36 Cb 0.21 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.50 3mzo h LYS 36 CO -0.21 0.88 0.38 0.28 -0.57 0.00 0.00 179.45 180.21 3mzo h VAL 37 N -0.12 0.88 -0.68 0.50 2.07 -0.97 0.60 116.25 118.53 3mzo h VAL 37 Ca -0.01 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 3mzo h VAL 37 Cb 0.91 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3mzo h VAL 37 CO 0.06 0.12 0.14 0.74 0.02 0.00 0.00 177.57 178.65 3mzo h THR 38 N 0.65 1.26 -0.38 2.57 2.02 -1.18 0.69 112.91 118.54 3mzo h THR 38 Ca 0.35 -1.00 -0.10 0.00 0.77 0.00 0.00 66.41 66.42 3mzo h THR 38 Cb 0.33 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3mzo h THR 38 CO -0.25 0.38 -0.19 0.28 0.37 0.00 0.00 175.52 176.11 3mzo h SER 39 N 1.04 0.72 -0.13 4.18 0.02 -0.56 0.06 113.55 118.88 3mzo h SER 39 Ca 0.21 -0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 3mzo h SER 39 Cb 0.40 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 3mzo h SER 39 CO 0.01 0.91 -0.09 0.40 -1.14 0.00 0.00 176.83 176.92 3mzo h ILE 40 N 0.64 1.33 -0.78 3.27 2.04 -0.75 -2.60 117.51 120.67 3mzo h ILE 40 Ca 0.10 -1.17 0.05 0.00 1.00 0.00 0.00 64.86 64.84 3mzo h ILE 40 Cb 0.68 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 38.53 3mzo h ILE 40 CO 0.05 0.34 0.47 0.00 0.00 0.00 0.00 178.15 179.01 3mzo h ALA 41 N 0.63 1.05 -0.72 1.87 0.00 -0.72 -0.87 119.26 120.50 3mzo h ALA 41 Ca 0.03 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.02 3mzo h ALA 41 Cb 0.57 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 3mzo h ALA 41 CO 0.02 0.21 0.36 0.37 0.00 0.00 0.00 179.25 180.22 3mzo h GLN 42 N 0.88 0.59 -0.06 0.00 4.15 -0.93 -0.56 115.11 119.18 3mzo h GLN 42 Ca 0.33 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.71 3mzo h GLN 42 Cb 0.13 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 3mzo h GLN 42 CO -0.16 0.39 0.01 0.35 -1.93 0.00 0.00 178.83 177.49 3mzo h PHE 43 N 0.61 0.11 -0.20 3.99 3.57 -0.86 -3.00 116.94 121.15 3mzo h PHE 43 Ca 0.36 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.86 3mzo h PHE 43 Cb 0.38 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 3mzo h PHE 43 CO -0.10 0.33 0.14 0.74 -2.23 0.00 0.00 178.31 177.18 3mzo h PHE 44 N -0.14 0.17 -0.78 0.41 0.04 -0.73 -1.58 116.94 114.33 3mzo h PHE 44 Ca 0.02 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.83 3mzo h PHE 44 Cb 0.28 -0.06 -0.05 0.00 2.20 0.00 0.00 35.95 38.32 3mzo h PHE 44 CO 0.02 0.10 0.49 0.78 -0.60 0.00 0.00 178.31 179.10 3mzo h GLY 45 N 0.18 1.14 1.20 -1.45 0.00 -0.98 0.61 103.07 103.77 3mzo h GLY 45 Ca 0.08 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 3mzo h GLY 45 CO -0.01 0.29 -0.10 0.00 0.00 0.00 0.00 176.54 176.71 3mzo h ALA 46 N 1.35 0.86 -0.65 3.60 0.00 -1.22 -0.23 119.26 122.96 3mzo h ALA 46 Ca 0.32 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3mzo h ALA 46 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3mzo h ALA 46 CO -0.13 0.65 0.34 0.28 0.00 0.00 0.00 179.25 180.39 3mzo h VAL 47 N 0.84 1.21 -0.50 0.00 2.07 -0.72 -1.12 116.25 118.03 3mzo h VAL 47 Ca 0.14 -0.55 -0.12 0.00 0.82 0.00 0.00 66.70 66.98 3mzo h VAL 47 Cb 0.64 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3mzo h VAL 47 CO 0.04 0.23 -0.16 -0.33 0.02 0.00 0.00 177.57 177.38 3mzo h GLU 48 N 0.89 0.99 -0.61 1.57 4.39 -0.66 -2.05 114.58 119.10 3mzo h GLU 48 Ca 0.23 -0.39 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 3mzo h GLU 48 Cb 0.07 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3mzo h GLU 48 CO -0.03 1.07 0.18 0.93 -1.16 0.00 0.00 179.01 179.99 3mzo h GLU 49 N 0.87 0.95 0.00 2.33 5.08 -0.89 -1.13 114.58 121.79 3mzo h GLU 49 Ca 0.12 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 3mzo h GLU 49 Cb 0.73 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 3mzo h GLU 49 CO 0.06 0.85 -0.21 0.22 -1.00 0.00 0.00 179.01 178.93 3mzo h ASP 50 N 0.87 0.00 -0.02 1.42 3.58 -1.07 -0.98 116.42 120.23 3mzo h ASP 50 Ca 0.20 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.65 3mzo h ASP 50 Cb 0.31 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.36 3mzo h ASP 50 CO -0.00 0.21 0.00 0.00 -2.88 0.00 0.00 179.24 176.56 3mzo n ALA 51 N -2.39 2.63 -0.17 -0.78 0.00 -0.78 -4.88 120.51 114.13 3mzo n ALA 51 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 3mzo n ALA 51 Cb 0.29 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.40 3mzo n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mzo n GLY 52 N 0.99 0.59 3.76 0.00 0.00 -0.37 -5.07 105.19 105.09 3mzo n GLY 52 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3mzo n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mzo s ASN 53 N -2.93 7.46 0.04 1.61 0.01 -0.47 -4.99 114.94 115.66 3mzo s ASN 53 Ca 0.00 1.73 -0.30 0.00 -0.71 0.00 0.00 52.86 53.57 3mzo s ASN 53 Cb 0.00 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.07 3mzo s ASN 53 CO 0.00 0.13 1.17 -0.70 -1.51 0.00 0.00 177.10 176.20 3mzo s GLU 54 N -0.87 4.44 -0.14 -0.60 2.12 -1.26 -3.81 118.70 118.58 3mzo s GLU 54 Ca 0.39 1.71 -0.01 0.00 0.36 0.00 0.00 54.97 57.42 3mzo s GLU 54 Cb -0.24 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.74 3mzo s GLU 54 CO 0.28 -0.26 -0.10 0.08 -0.54 0.00 0.00 175.26 174.72 3mzo s VAL 55 N 1.23 3.33 -0.74 3.70 1.01 -1.26 -5.00 120.40 122.66 3mzo s VAL 55 Ca 0.57 -0.56 -0.22 0.00 0.00 0.00 0.00 61.98 61.77 3mzo s VAL 55 Cb -0.28 -2.42 0.08 0.00 0.00 0.00 0.00 36.38 33.76 3mzo s VAL 55 CO 0.28 0.51 1.05 0.21 0.00 0.00 0.00 175.10 177.15 3mzo s ASN 56 N 0.39 6.28 0.25 3.32 3.84 -1.26 -4.92 114.94 122.84 3mzo s ASN 56 Ca -0.08 -1.20 -0.03 0.00 0.21 0.00 0.00 52.86 51.76 3mzo s ASN 56 Cb -0.15 -2.43 0.30 0.00 -0.55 0.00 0.00 41.25 38.41 3mzo s ASN 56 CO 0.05 -1.39 1.74 -0.50 -2.79 0.00 0.00 177.10 174.20 3mzo h TRP 57 N 9.46 0.88 -0.83 0.43 4.06 -1.99 -1.23 115.95 126.73 3mzo h TRP 57 Ca -0.17 -0.13 0.07 0.00 2.06 0.00 0.00 58.89 60.72 3mzo h TRP 57 Cb 1.06 -0.24 -0.06 0.00 -1.00 0.00 0.00 29.16 28.91 3mzo h TRP 57 CO 1.04 0.81 0.51 -0.09 -3.56 0.00 0.00 178.44 177.15 3mzo h ARG 58 N 0.77 0.89 -0.37 0.49 2.43 -1.99 -0.73 114.38 115.86 3mzo h ARG 58 Ca 0.15 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 3mzo h ARG 58 Cb 0.48 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 3mzo h ARG 58 CO 0.02 0.59 -0.27 0.00 -1.51 0.00 0.00 179.97 178.80 3mzo h ALA 59 N 1.40 0.53 0.17 2.80 0.00 -1.78 -0.87 119.26 121.51 3mzo h ALA 59 Ca 0.37 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3mzo h ALA 59 Cb 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3mzo h ALA 59 CO -0.18 0.54 -0.08 1.25 0.00 0.00 0.00 179.25 180.78 3mzo h LEU 60 N 0.63 -0.19 -0.32 0.00 6.46 -0.83 -1.29 115.31 119.77 3mzo h LEU 60 Ca 0.07 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.71 3mzo h LEU 60 Cb 0.84 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.81 3mzo h LEU 60 CO 0.07 -0.07 -0.07 1.88 -0.62 0.00 0.00 178.44 179.64 3mzo h TYR 61 N -0.30 0.68 -0.24 1.25 0.05 -1.17 -2.48 116.97 114.77 3mzo h TYR 61 Ca -0.02 -0.14 -0.09 0.00 0.05 0.00 0.00 58.73 58.52 3mzo h TYR 61 Cb 0.23 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 3mzo h TYR 61 CO -0.04 0.78 -0.26 1.05 -1.05 0.00 0.00 178.16 178.64 3mzo h GLU 62 N 0.39 0.46 -0.27 4.88 4.11 -1.13 0.68 114.58 123.70 3mzo h GLU 62 Ca 0.08 -0.17 -0.03 0.00 0.07 0.00 0.00 59.36 59.31 3mzo h GLU 62 Cb 0.55 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3mzo h GLU 62 CO 0.03 0.68 0.05 0.87 0.07 0.00 0.00 179.01 180.71 3mzo h LYS 63 N 0.41 0.44 -0.15 1.06 1.57 -1.20 -2.91 116.57 115.78 3mzo h LYS 63 Ca 0.06 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 3mzo h LYS 63 Cb 0.67 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.92 3mzo h LYS 63 CO 0.05 0.55 -0.31 0.00 -0.57 0.00 0.00 179.45 179.17 3mzo h ALA 64 N 0.87 0.24 -0.60 3.86 0.00 -1.20 -2.74 119.26 119.69 3mzo h ALA 64 Ca 0.08 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 3mzo h ALA 64 Cb 0.32 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3mzo h ALA 64 CO 0.00 0.27 0.30 1.25 0.00 0.00 0.00 179.25 181.07 3mzo h LEU 65 N 0.10 0.78 -1.26 0.00 5.85 -0.94 -3.22 115.31 116.62 3mzo h LEU 65 Ca 0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.60 3mzo h LEU 65 Cb 0.90 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.73 3mzo h LEU 65 CO 0.07 0.69 -0.22 0.59 -0.34 0.00 0.00 178.44 179.23 3mzo n ASN 66 N -4.53 2.17 0.19 1.25 3.02 -1.10 -4.60 115.26 111.66 3mzo n ASN 66 Ca 0.04 -1.60 0.05 0.00 -0.03 0.00 0.00 54.58 53.03 3mzo n ASN 66 Cb 0.12 0.20 0.49 0.00 -0.61 0.00 0.00 39.78 39.98 3mzo n ASN 66 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 3mzo h HIS 67 N 3.07 0.11 -0.31 3.10 2.07 -1.49 -2.52 115.15 119.17 3mzo h HIS 67 Ca 0.00 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 3mzo h HIS 67 Cb 0.78 -0.03 0.00 0.00 2.57 0.00 0.00 27.41 30.72 3mzo h HIS 67 CO 0.00 0.21 0.00 -0.25 -3.07 0.00 0.00 177.93 174.82 3mzo n ASP 68 N -4.36 3.38 -0.32 3.10 8.00 -1.26 -4.58 116.55 120.51 3mzo n ASP 68 Ca -0.02 -2.45 0.10 0.00 0.71 0.00 0.00 54.79 53.13 3mzo n ASP 68 Cb 0.21 -0.37 0.32 0.00 -0.02 0.00 0.00 41.12 41.25 3mzo n ASP 68 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3mzo h TYR 69 N 1.96 0.98 0.00 1.24 3.20 -1.74 -1.37 116.97 121.23 3mzo h TYR 69 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3mzo h TYR 69 Cb 1.06 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.02 3mzo h TYR 69 CO 0.36 0.35 0.00 -1.13 -1.64 0.00 0.00 178.16 176.10 3mzo n SER 70 N -4.61 0.00 0.33 -2.11 3.41 -1.26 -2.16 113.62 107.21 3mzo n SER 70 Ca 0.19 0.17 0.21 0.00 -0.26 0.00 0.00 58.87 59.18 3mzo n SER 70 Cb 0.44 -0.31 1.11 0.00 -0.26 0.00 0.00 64.21 65.19 3mzo n SER 70 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3mzo h GLU 71 N 0.00 0.00 -0.36 4.33 4.39 -1.49 -1.08 114.58 120.37 3mzo h GLU 71 Ca 0.00 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.81 3mzo h GLU 71 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3mzo h GLU 71 CO 0.00 0.00 0.31 -0.07 -1.16 0.00 0.00 179.01 178.09 3mzo h LEU 72 N 0.00 0.00 0.01 1.33 3.38 -1.65 -3.27 115.31 115.11 3mzo h LEU 72 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 3mzo h LEU 72 Cb 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3mzo h LEU 72 CO 0.00 0.00 -2.08 0.49 0.09 0.00 0.00 178.44 176.94 3mzo n PHE 73 N -4.10 0.46 0.00 1.13 0.99 -0.41 -5.14 117.46 110.39 3mzo n PHE 73 Ca 0.06 0.17 0.00 0.00 -0.00 0.00 0.00 57.45 57.68 3mzo n PHE 73 Cb 0.48 -1.05 0.00 0.00 -1.00 0.00 0.00 39.48 37.91 3mzo n PHE 73 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 3mzo n ILE 74 N -4.07 0.00 -0.31 4.37 -0.00 -1.20 -5.03 119.36 113.12 3mzo n ILE 74 Ca -0.44 0.00 -0.04 0.00 -0.00 0.00 0.00 62.75 62.27 3mzo n ILE 74 Cb 0.86 0.00 -0.05 0.00 -0.00 0.00 0.00 39.64 40.45 3mzo n ILE 74 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 3mzo n GLU 90 N 0.00 0.63 0.00 0.38 2.13 -1.26 -4.57 120.64 117.95 3mzo n GLU 90 Ca 0.00 -0.33 0.00 0.00 0.66 0.00 0.00 57.16 57.49 3mzo n GLU 90 Cb 0.00 -1.67 0.00 0.00 0.27 0.00 0.00 31.44 30.04 3mzo n GLU 90 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3mzo n LEU 92 N 2.89 0.00 0.10 4.31 -0.00 -1.26 -2.79 117.00 120.25 3mzo n LEU 92 Ca 0.14 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.14 3mzo n LEU 92 Cb 0.28 0.00 0.26 0.00 -0.00 0.00 0.00 43.42 43.96 3mzo n LEU 92 CO 0.22 0.00 0.69 0.77 -0.00 0.00 0.00 177.39 179.07 3mzo h SER 93 N 0.00 0.23 -0.27 1.96 4.64 -2.00 -3.11 113.55 114.99 3mzo h SER 93 Ca 0.00 -0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.13 3mzo h SER 93 Cb 0.00 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3mzo h SER 93 CO 0.00 0.58 -0.25 -0.33 -0.87 0.00 0.00 176.83 175.96 3mzo h GLU 94 N 0.20 0.65 -0.08 4.77 4.39 -1.96 -2.68 114.58 119.87 3mzo h GLU 94 Ca 0.02 -0.34 -0.20 0.00 0.34 0.00 0.00 59.36 59.19 3mzo h GLU 94 Cb 0.73 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 3mzo h GLU 94 CO 0.06 0.94 -0.78 0.28 -1.16 0.00 0.00 179.01 178.34 3mzo h VAL 95 N 0.38 1.36 0.52 3.13 2.07 -1.90 -1.18 116.25 120.63 3mzo h VAL 95 Ca 0.05 -2.16 -0.02 0.00 0.82 0.00 0.00 66.70 65.39 3mzo h VAL 95 Cb 0.81 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 3mzo h VAL 95 CO 0.06 0.66 -0.34 -0.08 0.02 0.00 0.00 177.57 177.89 3mzo h GLU 96 N 0.32 -0.79 0.02 1.57 4.81 -1.62 -3.14 114.58 115.75 3mzo h GLU 96 Ca -0.05 0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 3mzo h GLU 96 Cb 1.38 0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.89 3mzo h GLU 96 CO 0.14 -0.53 -0.40 0.93 -0.73 0.00 0.00 179.01 178.42 3mzo h GLU 97 N -0.82 -0.55 -0.24 1.92 5.08 -1.46 -0.56 114.58 117.95 3mzo h GLU 97 Ca -0.06 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3mzo h GLU 97 Cb 0.68 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3mzo h GLU 97 CO 0.04 -0.36 0.00 0.45 -1.00 0.00 0.00 179.01 178.14 3mzo n SER 98 N -5.45 0.00 0.00 1.42 2.88 -0.45 -1.33 113.62 110.69 3mzo n SER 98 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 3mzo n SER 98 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 3mzo n SER 98 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3mzo n THR 100 N 0.36 0.00 -0.24 2.46 -1.04 -0.22 -1.76 114.28 113.84 3mzo n THR 100 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 3mzo n THR 100 Cb 0.00 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 68.61 3mzo n THR 100 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 3mzo h LYS 101 N 0.00 0.71 -0.32 -2.82 3.64 -1.46 -0.89 116.57 115.43 3mzo h LYS 101 Ca 0.00 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.17 3mzo h LYS 101 Cb 0.00 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 3mzo h LYS 101 CO 0.00 0.47 -0.44 -0.91 -2.27 0.00 0.00 179.45 176.30 3mzo h ASN 102 N 0.73 0.94 -0.55 4.20 4.21 -1.61 -2.41 115.58 121.09 3mzo h ASN 102 Ca 0.30 -0.50 0.06 0.00 1.21 0.00 0.00 56.30 57.37 3mzo h ASN 102 Cb 0.16 -0.27 -0.05 0.00 -1.12 0.00 0.00 38.32 37.04 3mzo h ASN 102 CO -0.17 1.26 0.25 0.15 -1.29 0.00 0.00 177.43 177.63 3mzo h PHE 103 N 0.64 0.45 -0.09 1.19 3.57 -1.78 -2.20 116.94 118.73 3mzo h PHE 103 Ca 0.03 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 3mzo h PHE 103 Cb 1.04 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.66 3mzo h PHE 103 CO 0.07 0.19 0.02 0.82 -2.23 0.00 0.00 178.31 177.19 3mzo h ILE 104 N 0.48 1.18 -0.08 1.41 2.04 -1.05 0.44 117.51 121.93 3mzo h ILE 104 Ca 0.26 -0.55 0.02 0.00 1.00 0.00 0.00 64.86 65.58 3mzo h ILE 104 Cb 0.22 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.68 3mzo h ILE 104 CO -0.21 0.16 0.06 0.28 0.00 0.00 0.00 178.15 178.44 3mzo h SER 105 N -0.06 0.03 0.08 1.72 0.02 -1.36 -2.07 113.55 111.91 3mzo h SER 105 Ca 0.03 -0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.64 3mzo h SER 105 Cb 0.23 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 3mzo h SER 105 CO -0.00 0.02 -1.83 -1.14 -1.14 0.00 0.00 176.83 172.74 3mzo n ARG 106 N -4.52 0.70 -0.05 3.45 0.63 -0.84 -4.69 116.66 111.35 3mzo n ARG 106 Ca -0.01 0.34 -0.02 0.00 -0.92 0.00 0.00 57.85 57.24 3mzo n ARG 106 Cb 0.15 -1.71 -0.11 0.00 0.45 0.00 0.00 32.46 31.25 3mzo n ARG 106 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3mzo n GLU 107 N -3.76 1.36 -3.36 -0.14 -0.58 0.12 -4.61 120.64 109.67 3mzo n GLU 107 Ca -0.33 -0.05 -0.38 0.00 -0.42 0.00 0.00 57.16 55.98 3mzo n GLU 107 Cb 0.94 -1.34 -0.07 0.00 -0.57 0.00 0.00 31.44 30.40 3mzo n GLU 107 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3mzo s ILE 108 N -2.55 5.19 0.39 -3.67 -1.09 -0.78 0.23 121.20 118.92 3mzo s ILE 108 Ca -0.06 0.78 -0.27 0.00 -2.23 0.00 0.00 60.65 58.87 3mzo s ILE 108 Cb 0.06 -3.76 -0.11 0.00 -1.58 0.00 0.00 42.46 37.07 3mzo s ILE 108 CO 0.56 0.27 1.36 -2.65 -1.23 0.00 0.00 174.94 173.25 3mzo n PRO 109 N 4.27 2.25 -0.29 2.79 -0.02 -1.26 -4.70 135.00 138.03 3mzo n PRO 109 Ca -0.08 0.79 0.02 0.00 -2.02 0.00 0.00 63.50 62.21 3mzo n PRO 109 Cb 0.51 -2.48 0.07 0.00 -0.02 0.00 0.00 33.50 31.59 3mzo n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mzo n ALA 110 N 0.16 0.05 0.32 3.55 0.00 -1.26 -0.57 120.51 122.76 3mzo n ALA 110 Ca 0.04 0.82 0.19 0.00 0.00 0.00 0.00 53.44 54.50 3mzo n ALA 110 Cb 0.38 -0.43 1.08 0.00 0.00 0.00 0.00 19.45 20.48 3mzo n ALA 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mzo h THR 111 N 0.00 0.23 -0.04 0.00 1.03 -2.03 -2.10 112.91 109.99 3mzo h THR 111 Ca 0.32 -0.03 0.00 0.00 -0.01 0.00 0.00 66.41 66.70 3mzo h THR 111 Cb 0.52 1.02 0.00 0.00 -1.07 0.00 0.00 68.15 68.62 3mzo h THR 111 CO -0.79 0.00 0.00 0.49 -0.01 0.00 0.00 175.52 175.22 3mzo n PHE 112 N -3.40 0.03 -0.20 0.00 3.72 0.26 -4.68 117.46 113.20 3mzo n PHE 112 Ca -0.03 -0.03 -0.06 0.00 -0.05 0.00 0.00 57.45 57.28 3mzo n PHE 112 Cb 0.08 -0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.66 3mzo n PHE 112 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3mzo h GLN 113 N 3.00 0.78 -0.73 -1.08 4.20 -1.08 -1.18 115.11 119.03 3mzo h GLN 113 Ca 0.00 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 3mzo h GLN 113 Cb 0.65 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 3mzo h GLN 113 CO 0.00 0.54 0.21 -1.35 -0.67 0.00 0.00 178.83 177.56 3mzo h PRO 114 N 0.79 1.14 -0.39 1.46 0.11 -1.83 0.56 132.00 133.83 3mzo h PRO 114 Ca 0.21 -0.25 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 3mzo h PRO 114 Cb -0.06 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 3mzo h PRO 114 CO -0.04 0.98 0.18 0.82 -0.21 0.00 0.00 178.00 179.73 3mzo h ILE 115 N 1.09 1.18 -0.07 4.15 2.04 -1.85 -2.24 117.51 121.81 3mzo h ILE 115 Ca 0.23 -0.52 -0.14 0.00 1.00 0.00 0.00 64.86 65.43 3mzo h ILE 115 Cb 0.33 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 3mzo h ILE 115 CO -0.00 0.19 -0.59 1.88 0.00 0.00 0.00 178.15 179.63 3mzo h TYR 116 N 0.50 0.29 -0.91 1.37 -1.99 -0.71 0.79 116.97 116.31 3mzo h TYR 116 Ca 0.13 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.75 3mzo h TYR 116 Cb 0.14 -0.05 -0.04 0.00 2.00 0.00 0.00 36.73 38.77 3mzo h TYR 116 CO -0.01 0.76 0.53 0.00 -0.00 0.00 0.00 178.16 179.44 3mzo h ARG 117 N 0.17 1.24 -0.24 4.88 3.08 -0.86 -1.06 114.38 121.58 3mzo h ARG 117 Ca -0.00 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 3mzo h ARG 117 Cb 1.08 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 3mzo h ARG 117 CO 0.09 0.88 -0.01 1.25 -1.07 0.00 0.00 179.97 181.11 3mzo h HIS 118 N 1.25 0.48 -0.07 3.04 2.76 -0.88 -2.67 115.15 119.05 3mzo h HIS 118 Ca 0.32 -0.09 -0.06 0.00 -2.20 0.00 0.00 60.37 58.35 3mzo h HIS 118 Cb -0.03 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 3mzo h HIS 118 CO 0.01 0.61 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.95 3mzo h LEU 119 N 0.20 0.12 -1.54 0.26 3.38 -0.63 -3.15 115.31 113.95 3mzo h LEU 119 Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3mzo h LEU 119 Cb 0.43 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3mzo h LEU 119 CO 0.01 0.36 -0.20 0.18 0.09 0.00 0.00 178.44 178.88 3mzo n LEU 120 N -4.21 2.59 -4.83 1.67 4.77 -0.42 -4.75 117.00 111.82 3mzo n LEU 120 Ca -0.02 -0.90 -0.29 0.00 -0.03 0.00 0.00 56.01 54.78 3mzo n LEU 120 Cb 0.32 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.53 3mzo n LEU 120 CO 0.38 0.45 0.75 -1.59 -1.33 0.00 0.00 177.39 176.05 3mzo s LYS 121 N -2.20 1.39 0.06 3.23 -2.85 -1.01 -4.90 119.74 113.45 3mzo s LYS 121 Ca 0.24 0.18 -0.30 0.00 -1.00 0.00 0.00 55.97 55.09 3mzo s LYS 121 Cb 0.19 -1.88 -0.09 0.00 -2.06 0.00 0.00 37.83 33.99 3mzo s LYS 121 CO 0.42 -2.00 1.87 -2.00 0.10 0.00 0.00 175.35 173.73 3mzo s GLU 122 N -5.42 4.15 0.00 1.78 2.56 -1.26 -4.90 118.70 115.61 3mzo s GLU 122 Ca 0.64 2.54 0.22 0.00 0.00 0.00 0.00 54.97 58.37 3mzo s GLU 122 Cb -0.13 -3.93 -0.11 0.00 2.00 0.00 0.00 34.13 31.96 3mzo s GLU 122 CO 0.52 -0.89 0.94 0.41 -0.56 0.00 0.00 175.26 175.67 3mzo n GLY 123 N 4.36 -1.06 3.50 -1.50 0.00 -1.26 -4.80 105.19 104.44 3mzo n GLY 123 Ca 0.19 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3mzo n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mzo s LYS 124 N -3.08 3.51 0.00 1.61 1.02 -1.26 -4.35 119.74 117.19 3mzo s LYS 124 Ca 0.06 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 54.77 3mzo s LYS 124 Cb 0.16 -4.97 0.00 0.00 -0.52 0.00 0.00 37.83 32.49 3mzo s LYS 124 CO 0.84 -1.99 0.00 -0.40 -0.92 0.00 0.00 175.35 172.89 3mzo n ASP 125 N 7.86 1.92 -0.80 2.83 5.68 -1.26 -5.02 116.55 127.76 3mzo n ASP 125 Ca 0.23 -0.72 0.11 0.00 -0.50 0.00 0.00 54.79 53.91 3mzo n ASP 125 Cb 0.49 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.78 3mzo n ASP 125 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3mzo n SER 126 N -0.78 2.42 -4.69 -1.12 3.41 -1.26 -3.53 113.62 108.07 3mzo n SER 126 Ca 0.00 -1.83 -0.31 0.00 -0.26 0.00 0.00 58.87 56.47 3mzo n SER 126 Cb 0.00 -0.14 0.15 0.00 -0.26 0.00 0.00 64.21 63.95 3mzo n SER 126 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3mzo s THR 127 N -1.71 2.46 0.26 6.66 -4.23 -1.26 -4.78 115.64 113.04 3mzo s THR 127 Ca 0.34 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.96 3mzo s THR 127 Cb 0.20 -2.34 0.26 0.00 1.34 0.00 0.00 72.50 71.96 3mzo s THR 127 CO 0.29 -0.20 1.92 0.25 -0.54 0.00 0.00 174.62 176.34 3mzo h LEU 128 N -1.69 1.11 -0.55 4.79 5.85 -1.96 -0.51 115.31 122.34 3mzo h LEU 128 Ca -0.45 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.11 3mzo h LEU 128 Cb 1.26 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 3mzo h LEU 128 CO 0.46 0.78 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.67 3mzo h GLU 129 N 1.30 0.79 -0.45 1.25 3.07 -1.93 0.41 114.58 119.03 3mzo h GLU 129 Ca 0.38 -0.39 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 3mzo h GLU 129 Cb -0.07 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 3mzo h GLU 129 CO -0.10 1.01 0.15 0.78 -1.40 0.00 0.00 179.01 179.45 3mzo h GLY 130 N 0.92 0.70 1.23 -3.84 0.00 -1.66 -1.36 103.07 99.05 3mzo h GLY 130 Ca 0.07 -0.35 -0.19 0.00 0.00 0.00 0.00 47.33 46.86 3mzo h GLY 130 CO 0.08 0.34 -0.58 0.50 0.00 0.00 0.00 176.54 176.88 3mzo h LYS 131 N 0.64 0.81 -0.66 4.80 1.57 -0.67 -2.06 116.57 121.01 3mzo h LYS 131 Ca 0.15 -0.53 -0.02 0.00 -1.87 0.00 0.00 60.65 58.38 3mzo h LYS 131 Cb 0.18 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 3mzo h LYS 131 CO -0.01 1.16 0.32 0.82 -0.57 0.00 0.00 179.45 181.16 3mzo h ILE 132 N 0.61 1.21 -0.43 1.86 2.04 -0.65 -1.51 117.51 120.64 3mzo h ILE 132 Ca 0.00 -0.59 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 3mzo h ILE 132 Cb 1.18 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 3mzo h ILE 132 CO 0.12 0.25 0.04 0.25 0.00 0.00 0.00 178.15 178.81 3mzo h LEU 133 N 0.93 0.70 -0.60 1.44 5.85 -1.14 -0.68 115.31 121.81 3mzo h LEU 133 Ca 0.23 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3mzo h LEU 133 Cb 0.09 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3mzo h LEU 133 CO -0.03 0.81 0.38 0.00 -0.34 0.00 0.00 178.44 179.26 3mzo h ALA 134 N 0.92 0.76 -0.03 1.25 0.00 -0.85 -1.35 119.26 119.96 3mzo h ALA 134 Ca 0.13 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 3mzo h ALA 134 Cb 0.43 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.99 3mzo h ALA 134 CO 0.01 0.22 -0.98 -0.84 0.00 0.00 0.00 179.25 177.66 3mzo h ILE 135 N 0.81 1.30 -0.68 0.00 3.07 -1.22 -3.02 117.51 117.78 3mzo h ILE 135 Ca 0.22 -2.24 -0.00 0.00 1.55 0.00 0.00 64.86 64.39 3mzo h ILE 135 Cb -0.06 2.32 -0.03 0.00 -0.27 0.00 0.00 36.82 38.77 3mzo h ILE 135 CO -0.04 0.69 0.43 0.28 -1.05 0.00 0.00 178.15 178.45 3mzo h SER 136 N 0.39 0.81 -0.49 2.16 0.02 -0.88 0.30 113.55 115.85 3mzo h SER 136 Ca -0.11 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.83 3mzo h SER 136 Cb 1.62 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.92 3mzo h SER 136 CO 0.19 0.62 0.27 -0.78 -1.14 0.00 0.00 176.83 175.98 3mzo h ASP 137 N 0.93 0.40 0.37 3.07 3.58 -1.31 -1.35 116.42 122.11 3mzo h ASP 137 Ca 0.25 0.02 -0.14 0.00 0.42 0.00 0.00 57.03 57.57 3mzo h ASP 137 Cb -0.06 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 3mzo h ASP 137 CO -0.05 0.28 -0.59 0.11 -2.88 0.00 0.00 179.24 176.11 3mzo h LYS 138 N 0.53 0.22 -0.56 0.28 1.79 -1.29 -2.18 116.57 115.36 3mzo h LYS 138 Ca 0.21 -0.15 -0.06 0.00 -2.18 0.00 0.00 60.65 58.47 3mzo h LYS 138 Cb 0.08 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 3mzo h LYS 138 CO -0.13 0.75 0.13 0.28 -1.08 0.00 0.00 179.45 179.41 3mzo h VAL 139 N 0.17 1.25 -0.42 0.50 2.07 -0.17 0.43 116.25 120.07 3mzo h VAL 139 Ca -0.00 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.64 3mzo h VAL 139 Cb 1.09 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3mzo h VAL 139 CO 0.09 0.33 0.27 -0.78 0.02 0.00 0.00 177.57 177.50 3mzo h ASP 140 N 0.80 0.45 -0.88 0.57 3.58 -1.10 -0.92 116.42 118.92 3mzo h ASP 140 Ca 0.17 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.66 3mzo h ASP 140 Cb 0.35 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 41.24 3mzo h ASP 140 CO 0.00 0.33 0.56 0.25 -2.88 0.00 0.00 179.24 177.50 3mzo h LEU 141 N 0.54 0.93 -0.61 2.28 5.85 -1.13 -0.22 115.31 122.96 3mzo h LEU 141 Ca 0.16 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 3mzo h LEU 141 Cb -0.03 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 3mzo h LEU 141 CO -0.05 0.63 0.14 0.25 -0.34 0.00 0.00 178.44 179.07 3mzo h LEU 142 N 1.08 0.92 -0.61 2.25 5.85 -0.37 -1.99 115.31 122.44 3mzo h LEU 142 Ca 0.35 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3mzo h LEU 142 Cb 0.03 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 3mzo h LEU 142 CO -0.13 0.92 0.13 1.88 -0.34 0.00 0.00 178.44 180.90 3mzo h TYR 143 N 0.88 1.04 -0.34 1.25 -1.99 -0.67 -0.05 116.97 117.09 3mzo h TYR 143 Ca 0.19 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.78 3mzo h TYR 143 Cb 0.36 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 38.78 3mzo h TYR 143 CO 0.03 0.89 0.17 0.93 -0.00 0.00 0.00 178.16 180.18 3mzo h GLU 144 N 0.90 0.49 -0.16 4.88 5.08 -0.88 0.13 114.58 125.01 3mzo h GLU 144 Ca 0.19 -0.07 -0.22 0.00 -1.00 0.00 0.00 59.36 58.26 3mzo h GLU 144 Cb 0.38 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.55 3mzo h GLU 144 CO 0.01 0.43 -0.75 0.66 -1.00 0.00 0.00 179.01 178.35 3mzo h SER 145 N 0.42 0.94 -0.56 1.42 4.64 -1.35 -2.66 113.55 116.41 3mzo h SER 145 Ca 0.12 -0.62 0.07 0.00 -0.47 0.00 0.00 61.79 60.89 3mzo h SER 145 Cb 0.09 -0.28 -0.06 0.00 -0.31 0.00 0.00 62.40 61.85 3mzo h SER 145 CO -0.02 1.41 0.24 0.15 -0.87 0.00 0.00 176.83 177.74 3mzo h PHE 146 N 0.54 0.42 -0.55 4.77 3.57 -0.88 -1.40 116.94 123.40 3mzo h PHE 146 Ca -0.05 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.53 3mzo h PHE 146 Cb 1.38 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.96 3mzo h PHE 146 CO 0.09 0.16 0.27 0.78 -2.23 0.00 0.00 178.31 177.37 3mzo h GLY 147 N 0.44 0.78 0.92 2.40 0.00 -0.55 0.13 103.07 107.19 3mzo h GLY 147 Ca 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 3mzo h GLY 147 CO -0.24 0.09 0.10 0.83 0.00 0.00 0.00 176.54 177.32 3mzo h GLU 148 N 0.51 0.57 -0.53 4.80 4.39 -1.13 -1.39 114.58 121.81 3mzo h GLU 148 Ca 0.25 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.82 3mzo h GLU 148 Cb 0.19 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 3mzo h GLU 148 CO -0.19 0.61 0.34 0.82 -1.16 0.00 0.00 179.01 179.42 3mzo h ILE 149 N 0.44 1.15 -0.20 3.13 2.04 -0.93 -0.23 117.51 122.90 3mzo h ILE 149 Ca 0.11 -0.29 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 3mzo h ILE 149 Cb 0.28 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 3mzo h ILE 149 CO -0.00 0.14 -0.08 -0.61 0.00 0.00 0.00 178.15 177.60 3mzo h GLN 150 N 0.71 0.31 -0.07 2.37 4.15 -0.77 -1.78 115.11 120.03 3mzo h GLN 150 Ca 0.19 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.55 3mzo h GLN 150 Cb -0.05 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.59 3mzo h GLN 150 CO -0.04 0.41 0.00 1.63 -1.93 0.00 0.00 178.83 178.90 3mzo n LYS 151 N -4.29 1.19 -0.87 1.69 5.02 -0.54 -4.90 118.16 115.46 3mzo n LYS 151 Ca -0.00 -0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 3mzo n LYS 151 Cb 0.25 -1.12 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 3mzo n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mzo n GLY 152 N 0.69 0.50 3.68 0.72 0.00 -0.67 -5.00 105.19 105.10 3mzo n GLY 152 Ca 0.05 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 3mzo n GLY 152 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3mzo s ASN 153 N -2.55 6.51 0.34 1.61 3.84 -0.14 -4.87 114.94 119.69 3mzo s ASN 153 Ca 0.00 2.59 0.23 0.00 0.21 0.00 0.00 52.86 55.89 3mzo s ASN 153 Cb 0.00 -2.55 0.22 0.00 -0.55 0.00 0.00 41.25 38.37 3mzo s ASN 153 CO 0.00 -0.97 1.39 1.55 -2.79 0.00 0.00 177.10 176.28 3mzo h PRO 154 N 9.19 0.00 -6.02 0.43 0.13 -1.95 -3.43 132.00 130.35 3mzo h PRO 154 Ca -0.45 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 3mzo h PRO 154 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3mzo h PRO 154 CO 0.94 0.00 1.36 0.39 -0.23 0.00 0.00 178.00 180.46 3mzo n GLU 155 N -2.91 1.19 0.27 0.86 -0.58 -1.26 -4.85 120.64 113.37 3mzo n GLU 155 Ca 0.02 0.35 0.15 0.00 -0.42 0.00 0.00 57.16 57.26 3mzo n GLU 155 Cb 0.53 -2.47 0.86 0.00 -0.57 0.00 0.00 31.44 29.79 3mzo n GLU 155 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 3mzo h ASN 156 N 11.84 0.00 -1.17 1.62 -1.24 -2.03 -2.58 115.58 122.03 3mzo h ASN 156 Ca -0.31 0.00 0.38 0.00 0.71 0.00 0.00 56.30 57.08 3mzo h ASN 156 Cb 1.31 0.00 -0.13 0.00 0.73 0.00 0.00 38.32 40.23 3mzo h ASN 156 CO 1.01 0.00 0.73 -0.29 -1.29 0.00 0.00 177.43 177.58 3mzo h ILE 157 N 0.00 0.22 -0.16 2.57 6.09 -1.99 0.43 117.51 124.68 3mzo h ILE 157 Ca 0.02 -0.06 -0.11 0.00 -1.37 0.00 0.00 64.86 63.33 3mzo h ILE 157 Cb 0.09 0.02 -0.01 0.00 0.47 0.00 0.00 36.82 37.39 3mzo h ILE 157 CO -0.00 0.03 -0.39 -0.26 -3.07 0.00 0.00 178.15 174.47 3mzo h PHE 158 N 0.19 0.41 -0.41 2.19 0.04 -1.83 0.55 116.94 118.07 3mzo h PHE 158 Ca 0.76 -0.11 -0.14 0.00 2.80 0.00 0.00 57.97 61.28 3mzo h PHE 158 Cb 2.15 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 40.20 3mzo h PHE 158 CO -0.01 0.69 -0.30 0.28 -0.60 0.00 0.00 178.31 178.37 3mzo h VAL 159 N 0.29 1.27 -0.67 -0.55 2.07 -1.12 -0.44 116.25 117.10 3mzo h VAL 159 Ca 0.03 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 3mzo h VAL 159 Cb 0.82 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 3mzo h VAL 159 CO 0.07 0.49 0.17 -0.33 0.02 0.00 0.00 177.57 177.99 3mzo h GLU 160 N 0.77 1.08 -0.27 1.57 5.08 -0.95 -1.36 114.58 120.49 3mzo h GLU 160 Ca 0.08 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.14 3mzo h GLU 160 Cb 0.87 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3mzo h GLU 160 CO 0.08 0.96 -0.02 0.82 -1.00 0.00 0.00 179.01 179.85 3mzo h ILE 161 N 1.00 1.26 -0.40 3.13 2.04 -0.72 -1.95 117.51 121.88 3mzo h ILE 161 Ca 0.21 -0.97 0.07 0.00 1.00 0.00 0.00 64.86 65.17 3mzo h ILE 161 Cb 0.36 1.35 -0.06 0.00 -0.74 0.00 0.00 36.82 37.73 3mzo h ILE 161 CO 0.00 0.31 0.03 0.22 0.00 0.00 0.00 178.15 178.71 3mzo h TYR 162 N 0.27 0.04 -0.62 1.37 5.03 -0.88 0.13 116.97 122.31 3mzo h TYR 162 Ca 0.08 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.44 3mzo h TYR 162 Cb 0.46 0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.74 3mzo h TYR 162 CO 0.04 -0.04 0.38 0.77 -1.32 0.00 0.00 178.16 177.99 3mzo h SER 163 N 0.14 0.62 -0.34 -2.11 0.02 -1.05 0.19 113.55 111.03 3mzo h SER 163 Ca 0.19 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 3mzo h SER 163 Cb 0.26 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 3mzo h SER 163 CO -0.29 0.43 0.03 -0.08 -1.14 0.00 0.00 176.83 175.78 3mzo h GLU 164 N 0.75 0.58 -0.10 3.45 4.22 -1.03 -0.59 114.58 121.86 3mzo h GLU 164 Ca 0.25 -0.17 -0.01 0.00 0.08 0.00 0.00 59.36 59.51 3mzo h GLU 164 Cb 0.03 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 3mzo h GLU 164 CO -0.11 0.68 0.04 0.00 -2.18 0.00 0.00 179.01 177.44 3mzo h ALA 165 N 0.88 0.13 -0.35 2.92 0.00 -0.72 -0.55 119.26 121.58 3mzo h ALA 165 Ca 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3mzo h ALA 165 Cb 0.40 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3mzo h ALA 165 CO 0.01 -0.27 0.20 1.25 0.00 0.00 0.00 179.25 180.44 3mzo h LEU 166 N -0.00 0.43 -0.94 0.00 5.85 -0.92 -0.52 115.31 119.21 3mzo h LEU 166 Ca 0.03 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.72 3mzo h LEU 166 Cb 0.18 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 3mzo h LEU 166 CO -0.00 0.38 0.61 0.00 -0.34 0.00 0.00 178.44 179.09 3mzo h ALA 167 N 1.07 1.26 -0.41 1.25 0.00 -1.04 0.17 119.26 121.56 3mzo h ALA 167 Ca 0.12 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3mzo h ALA 167 Cb 0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3mzo h ALA 167 CO -0.02 0.48 -0.31 1.15 0.00 0.00 0.00 179.25 180.55 3mzo h THR 168 N 1.18 1.27 -0.70 0.00 2.02 -0.67 -2.55 112.91 113.46 3mzo h THR 168 Ca 0.38 -1.48 0.05 0.00 0.77 0.00 0.00 66.41 66.13 3mzo h THR 168 Cb 0.02 1.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 3mzo h THR 168 CO -0.13 0.50 0.41 0.40 0.37 0.00 0.00 175.52 177.08 3mzo h ILE 169 N 0.76 1.02 0.00 3.11 2.04 -0.56 -1.95 117.51 121.93 3mzo h ILE 169 Ca 0.08 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 3mzo h ILE 169 Cb 0.90 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3mzo h ILE 169 CO 0.08 0.14 -0.07 0.22 0.00 0.00 0.00 178.15 178.53 3mzo h TYR 170 N 0.78 0.00 0.00 1.37 3.20 -0.59 -0.03 116.97 121.69 3mzo h TYR 170 Ca 0.30 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.17 3mzo h TYR 170 Cb 0.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.39 3mzo h TYR 170 CO -0.06 0.07 0.00 0.39 -1.64 0.00 0.00 178.16 176.92 3mzo n GLU 171 N -3.69 0.03 -0.64 1.82 1.02 -0.73 -1.98 120.64 116.47 3mzo n GLU 171 Ca -0.02 0.30 0.03 0.00 -0.02 0.00 0.00 57.16 57.45 3mzo n GLU 171 Cb 0.17 -1.56 0.25 0.00 -0.02 0.00 0.00 31.44 30.28 3mzo n GLU 171 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3mzo n TYR 172 N -1.62 1.23 0.14 -0.32 4.02 -0.03 -4.76 117.16 115.83 3mzo n TYR 172 Ca 0.03 -1.13 0.09 0.00 -0.01 0.00 0.00 57.90 56.88 3mzo n TYR 172 Cb 0.16 -0.43 0.50 0.00 -0.02 0.00 0.00 39.34 39.55 3mzo n TYR 172 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 3mzo n ARG 173 N -0.64 0.12 -0.48 -0.72 1.85 -0.84 -4.61 116.66 111.35 3mzo n ARG 173 Ca 0.28 0.62 -0.06 0.00 -1.00 0.00 0.00 57.85 57.68 3mzo n ARG 173 Cb 1.02 -1.90 -0.08 0.00 -1.05 0.00 0.00 32.46 30.45 3mzo n ARG 173 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 3mzo n GLU 174 N -2.14 0.98 -0.10 2.89 0.00 -1.26 -4.52 120.64 116.49 3mzo n GLU 174 Ca -0.01 -0.51 -0.13 0.00 0.00 0.00 0.00 57.16 56.51 3mzo n GLU 174 Cb 0.04 -1.76 -0.10 0.00 0.00 0.00 0.00 31.44 29.62 3mzo n GLU 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3mzo n ALA 176 N 2.83 1.58 -0.12 -1.84 0.00 -1.26 -4.97 120.51 116.73 3mzo n ALA 176 Ca 0.21 -0.88 -0.04 0.00 0.00 0.00 0.00 53.44 52.73 3mzo n ALA 176 Cb 0.42 0.02 0.03 0.00 0.00 0.00 0.00 19.45 19.92 3mzo n ALA 176 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3mzo h SER 177 N 0.00 -0.20 -0.05 0.00 0.02 -1.88 -1.17 113.55 110.27 3mzo h SER 177 Ca -0.44 0.10 -0.19 0.00 -0.84 0.00 0.00 61.79 60.42 3mzo h SER 177 Cb 1.73 0.18 0.00 0.00 0.14 0.00 0.00 62.40 64.45 3mzo h SER 177 CO -0.05 -0.06 -0.65 0.58 -1.14 0.00 0.00 176.83 175.50 3mzo h VAL 178 N 0.09 1.31 -0.54 2.27 2.07 -1.90 -1.15 116.25 118.40 3mzo h VAL 178 Ca 0.20 -1.90 0.09 0.00 0.82 0.00 0.00 66.70 65.90 3mzo h VAL 178 Cb 0.29 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.85 3mzo h VAL 178 CO -0.34 0.60 0.16 0.50 0.02 0.00 0.00 177.57 178.50 3mzo h LYS 179 N 0.49 0.30 -0.22 1.57 1.63 -1.71 0.72 116.57 119.35 3mzo h LYS 179 Ca -0.02 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.74 3mzo h LYS 179 Cb 1.24 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 3mzo h LYS 179 CO 0.13 0.20 0.03 -0.92 -3.45 0.00 0.00 179.45 175.44 3mzo h TYR 180 N 0.31 0.39 -0.19 1.91 3.20 -1.04 -0.30 116.97 121.25 3mzo h TYR 180 Ca 0.27 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.14 3mzo h TYR 180 Cb 0.34 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 3mzo h TYR 180 CO -0.20 0.50 -0.22 0.35 -1.64 0.00 0.00 178.16 176.96 3mzo h PHE 181 N 0.17 -0.57 -0.22 -3.82 3.57 -0.83 0.25 116.94 115.49 3mzo h PHE 181 Ca 0.07 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 3mzo h PHE 181 Cb 0.32 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 3mzo h PHE 181 CO 0.02 -0.29 -0.32 -0.07 -2.23 0.00 0.00 178.31 175.41 3mzo h LEU 182 N -0.24 0.46 0.00 0.59 3.38 -0.79 0.21 115.31 118.92 3mzo h LEU 182 Ca 0.12 -0.17 -0.27 0.00 0.09 0.00 0.00 57.88 57.65 3mzo h LEU 182 Cb 0.42 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 41.06 3mzo h LEU 182 CO -0.33 0.76 -1.11 0.50 0.09 0.00 0.00 178.44 178.35 3mzo h LYS 183 N 0.39 0.56 0.00 1.13 3.64 -0.57 -3.40 116.57 118.32 3mzo h LYS 183 Ca 0.05 -0.67 -0.10 0.00 -1.27 0.00 0.00 60.65 58.65 3mzo h LYS 183 Cb 0.76 0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 3mzo h LYS 183 CO 0.06 1.28 -1.37 0.39 -2.27 0.00 0.00 179.45 177.53 3mzo n GLU 184 N -3.77 0.50 -0.09 1.90 -0.58 0.82 -4.71 120.64 114.71 3mzo n GLU 184 Ca -0.11 0.03 -0.15 0.00 -0.42 0.00 0.00 57.16 56.52 3mzo n GLU 184 Cb 0.92 -1.13 -0.08 0.00 -0.57 0.00 0.00 31.44 30.58 3mzo n GLU 184 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 3mzo h ILE 185 N 0.00 0.57 -0.65 -3.67 2.04 -1.31 -3.33 117.51 111.16 3mzo h ILE 185 Ca -0.15 -1.72 0.09 0.00 1.00 0.00 0.00 64.86 64.08 3mzo h ILE 185 Cb 1.24 1.37 -0.07 0.00 -0.74 0.00 0.00 36.82 38.62 3mzo h ILE 185 CO -0.02 0.19 0.28 0.25 0.00 0.00 0.00 178.15 178.85 3mzo h LEU 186 N -1.00 0.32 -1.56 1.44 5.85 -1.23 -0.92 115.31 118.21 3mzo h LEU 186 Ca -0.21 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 3mzo h LEU 186 Cb 0.99 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3mzo h LEU 186 CO -0.13 0.19 0.24 -0.65 -0.34 0.00 0.00 178.44 177.75 3mzo h PRO 187 N 0.49 0.53 -1.41 5.25 0.11 -1.77 -1.36 132.00 133.84 3mzo h PRO 187 Ca 0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.39 3mzo h PRO 187 Cb 0.38 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3mzo h PRO 187 CO -0.29 0.37 0.00 -0.25 -0.21 0.00 0.00 178.00 177.62 3mzo n ASP 188 N -4.45 0.43 0.00 -2.05 8.00 -0.35 -1.46 116.55 116.66 3mzo n ASP 188 Ca 0.03 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.18 3mzo n ASP 188 Cb 0.08 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 3mzo n ASP 188 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3mzo n LEU 190 N 0.79 0.00 -0.22 0.64 4.77 -0.51 -3.00 117.00 119.47 3mzo n LEU 190 Ca 0.00 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.13 3mzo n LEU 190 Cb 0.08 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 41.82 3mzo n LEU 190 CO 0.00 0.00 0.92 0.00 -1.33 0.00 0.00 177.39 176.98 3mzo n ALA 191 N 0.00 2.70 -1.75 -1.18 0.00 -0.54 -4.78 120.51 114.96 3mzo n ALA 191 Ca 0.00 -0.32 -0.38 0.00 0.00 0.00 0.00 53.44 52.74 3mzo n ALA 191 Cb 0.00 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.18 3mzo n ALA 191 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3mzo s GLU 192 N -2.19 3.10 -0.18 0.00 0.41 -1.16 -4.88 118.70 113.81 3mzo s GLU 192 Ca 0.37 2.24 -0.38 0.00 -0.41 0.00 0.00 54.97 56.79 3mzo s GLU 192 Cb 0.21 -2.24 -0.14 0.00 -1.78 0.00 0.00 34.13 30.18 3mzo s GLU 192 CO 0.40 -1.22 1.76 1.17 -0.49 0.00 0.00 175.26 176.88 3mzo n LYS 193 N -1.08 1.54 -0.01 1.61 4.81 -1.26 -2.61 118.16 121.16 3mzo n LYS 193 Ca 0.11 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 3mzo n LYS 193 Cb 0.45 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.20 3mzo n LYS 193 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3mzo n GLY 194 N 4.13 0.62 0.27 3.14 0.00 -1.26 -4.91 105.19 107.18 3mzo n GLY 194 Ca 0.24 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.41 3mzo n GLY 194 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3mzo h ILE 195 N 0.00 0.36 0.00 -0.61 1.08 -1.81 -1.31 117.51 115.21 3mzo h ILE 195 Ca 0.00 -0.55 -0.01 0.00 -0.39 0.00 0.00 64.86 63.91 3mzo h ILE 195 Cb 0.00 1.40 -0.00 0.00 -3.07 0.00 0.00 36.82 35.15 3mzo h ILE 195 CO 0.00 0.09 -0.04 1.05 -0.69 0.00 0.00 178.15 178.56 3mzo h GLU 196 N 0.00 0.00 0.00 2.37 9.09 -1.86 -2.06 114.58 122.12 3mzo h GLU 196 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3mzo h GLU 196 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 3mzo h GLU 196 CO 0.01 0.04 0.00 1.63 0.05 0.00 0.00 179.01 180.74 3mzo n LYS 197 N -4.27 0.36 -1.74 1.06 5.02 -0.49 -4.86 118.16 113.24 3mzo n LYS 197 Ca -0.03 0.04 -0.06 0.00 -2.02 0.00 0.00 58.31 56.25 3mzo n LYS 197 Cb 0.12 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.65 3mzo n LYS 197 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3mzo n THR 198 N -1.29 0.00 0.88 -0.18 -2.24 -0.78 -5.03 114.28 105.65 3mzo n THR 198 Ca 0.12 -0.53 0.12 0.00 -2.27 0.00 0.00 64.05 61.49 3mzo n THR 198 Cb 0.21 -0.69 0.16 0.00 -2.10 0.00 0.00 70.33 67.91 3mzo n THR 198 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3mzo n GLU 199 N -1.14 2.32 -0.11 -0.78 1.02 -1.26 -4.60 120.64 116.08 3mzo n GLU 199 Ca 0.02 -1.93 -0.07 0.00 -0.02 0.00 0.00 57.16 55.16 3mzo n GLU 199 Cb 0.16 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 3mzo n GLU 199 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3mzo h LEU 200 N 4.45 0.34 -0.42 -4.62 3.38 -1.96 0.14 115.31 116.62 3mzo h LEU 200 Ca 0.00 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3mzo h LEU 200 Cb 0.95 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.55 3mzo h LEU 200 CO 0.00 0.24 -0.19 -0.65 0.09 0.00 0.00 178.44 177.93 3mzo h PRO 201 N 0.43 -0.11 -0.22 1.13 0.11 -1.81 0.20 132.00 131.73 3mzo h PRO 201 Ca 0.15 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 3mzo h PRO 201 Cb 0.01 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 3mzo h PRO 201 CO -0.07 -0.07 0.09 0.37 -0.21 0.00 0.00 178.00 178.10 3mzo h GLN 202 N -0.11 0.34 -0.81 1.05 5.75 -1.70 -2.47 115.11 117.16 3mzo h GLN 202 Ca 0.20 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 3mzo h GLN 202 Cb 0.42 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.88 3mzo h GLN 202 CO -0.49 0.39 0.34 -0.07 -2.65 0.00 0.00 178.83 176.35 3mzo h LEU 203 N 0.21 1.10 -0.57 -2.39 3.38 -0.66 -1.94 115.31 114.44 3mzo h LEU 203 Ca 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3mzo h LEU 203 Cb 0.18 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3mzo h LEU 203 CO -0.01 0.96 0.30 0.74 0.09 0.00 0.00 178.44 180.52 3mzo h THR 204 N 1.17 1.19 -0.51 0.22 2.02 -0.44 0.55 112.91 117.11 3mzo h THR 204 Ca 0.27 -0.51 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 3mzo h THR 204 Cb 0.19 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 3mzo h THR 204 CO -0.03 0.21 0.30 0.74 0.37 0.00 0.00 175.52 177.11 3mzo h THR 205 N 0.78 1.16 -0.55 3.16 2.02 -1.05 -1.74 112.91 116.69 3mzo h THR 205 Ca 0.20 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 3mzo h THR 205 Cb 0.07 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 3mzo h THR 205 CO -0.03 0.17 0.24 -0.33 0.37 0.00 0.00 175.52 175.94 3mzo h GLU 206 N 0.68 0.80 -0.12 6.66 5.08 -0.87 -3.06 114.58 123.75 3mzo h GLU 206 Ca 0.18 -0.13 -0.21 0.00 -1.00 0.00 0.00 59.36 58.20 3mzo h GLU 206 Cb 0.02 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.13 3mzo h GLU 206 CO -0.03 0.68 -0.75 0.82 -1.00 0.00 0.00 179.01 178.73 3mzo h ILE 207 N 0.74 1.32 -0.47 3.13 2.04 -0.71 -2.63 117.51 120.93 3mzo h ILE 207 Ca 0.19 -2.04 0.00 0.00 1.00 0.00 0.00 64.86 64.01 3mzo h ILE 207 Cb 0.16 2.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3mzo h ILE 207 CO -0.02 0.63 0.00 0.35 0.00 0.00 0.00 178.15 179.11 3mzo n THR 208 N -3.89 2.02 0.00 -0.27 -2.24 -0.67 -4.54 114.28 104.69 3mzo n THR 208 Ca -0.06 -1.06 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 3mzo n THR 208 Cb 0.73 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 3mzo n THR 208 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3mzo n THR 209 N 0.58 0.00 0.54 4.28 -2.24 -1.16 -5.04 114.28 111.23 3mzo n THR 209 Ca 0.22 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.04 3mzo n THR 209 Cb 0.94 -0.13 0.25 0.00 -2.10 0.00 0.00 70.33 69.29 3mzo n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79