#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zmz h ALA 2 N 0.00 1.28 -2.38 3.04 0.00 -1.78 -3.42 119.26 116.00 1zmz h ALA 2 Ca 0.00 -0.13 -0.54 0.00 0.00 0.00 0.00 54.91 54.24 1zmz h ALA 2 Cb 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1zmz h ALA 2 CO 0.00 0.57 0.60 0.45 0.00 0.00 0.00 179.25 180.87 1zmz s SER 3 N -6.39 7.11 -1.17 0.00 0.15 -1.26 -4.98 113.70 107.17 1zmz s SER 3 Ca -0.11 1.85 -0.20 0.00 0.70 0.00 0.00 55.95 58.18 1zmz s SER 3 Cb 0.17 -2.57 0.06 0.00 -1.71 0.00 0.00 66.02 61.97 1zmz s SER 3 CO 0.81 -0.49 1.60 0.21 1.20 0.00 0.00 173.24 176.56 1zmz s ASN 4 N 1.25 6.69 0.43 5.45 3.84 -1.26 -4.84 114.94 126.49 1zmz s ASN 4 Ca 0.56 -2.00 0.28 0.00 0.21 0.00 0.00 52.86 51.91 1zmz s ASN 4 Cb -0.25 -2.57 0.98 0.00 -0.55 0.00 0.00 41.25 38.85 1zmz s ASN 4 CO 0.25 -1.32 1.82 -0.26 -2.79 0.00 0.00 177.10 174.80 1zmz h PHE 5 N 8.58 0.00 -3.43 0.43 0.04 -1.94 -3.49 116.94 117.13 1zmz h PHE 5 Ca 0.33 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.10 1zmz h PHE 5 Cb 0.93 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.05 1zmz h PHE 5 CO 1.36 0.00 -0.47 1.63 -0.60 0.00 0.00 178.31 180.22 1zmz n LYS 6 N -2.83 -1.57 -2.28 1.51 4.01 -1.26 -4.90 118.16 110.84 1zmz n LYS 6 Ca 0.02 1.50 -0.01 0.00 -0.51 0.00 0.00 58.31 59.32 1zmz n LYS 6 Cb 0.36 -2.21 0.00 0.00 -0.51 0.00 0.00 35.03 32.67 1zmz n LYS 6 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1zmz n LYS 7 N 0.57 -0.81 0.00 1.97 4.81 -1.26 -5.09 118.16 118.35 1zmz n LYS 7 Ca -0.10 1.09 0.00 0.00 -0.87 0.00 0.00 58.31 58.43 1zmz n LYS 7 Cb 0.16 -3.70 0.00 0.00 0.02 0.00 0.00 35.03 31.51 1zmz n LYS 7 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1zmz n ALA 8 N -1.17 1.22 -3.81 3.14 0.00 -1.26 -4.93 120.51 113.69 1zmz n ALA 8 Ca 0.01 -0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1zmz n ALA 8 Cb 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 1zmz n ALA 8 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1zmz n ASN 9 N -1.92 3.31 -0.07 0.00 5.15 -1.26 -4.95 115.26 115.53 1zmz n ASN 9 Ca 0.00 -3.23 -0.14 0.00 -0.60 0.00 0.00 54.58 50.61 1zmz n ASN 9 Cb 0.00 -0.80 -0.05 0.00 -0.53 0.00 0.00 39.78 38.40 1zmz n ASN 9 CO 0.00 0.00 0.00 0.24 1.40 0.00 0.00 177.26 178.90 1zmz h MET 10 N 5.37 0.73 -4.53 1.20 2.86 -1.92 -3.34 114.93 115.30 1zmz h MET 10 Ca 0.16 -0.46 -0.70 0.00 -2.06 0.00 0.00 59.70 56.64 1zmz h MET 10 Cb 0.75 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.41 1zmz h MET 10 CO 0.76 1.08 2.86 0.00 1.06 0.00 0.00 176.91 182.66 1zmz n ALA 11 N -2.53 4.94 -2.64 6.32 0.00 -1.26 -4.98 120.51 120.34 1zmz n ALA 11 Ca -0.05 -3.86 -0.41 0.00 0.00 0.00 0.00 53.44 49.12 1zmz n ALA 11 Cb 0.56 -3.56 -0.05 0.00 0.00 0.00 0.00 19.45 16.40 1zmz n ALA 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1zmz s SER 12 N 3.54 6.75 -1.32 0.00 0.15 -1.26 -4.99 113.70 116.58 1zmz s SER 12 Ca 0.49 0.93 -0.15 0.00 0.70 0.00 0.00 55.95 57.92 1zmz s SER 12 Cb 0.11 -2.40 -0.01 0.00 -1.71 0.00 0.00 66.02 62.01 1zmz s SER 12 CO -0.04 -0.42 2.22 -1.54 1.20 0.00 0.00 173.24 174.66 1zmz n SER 13 N 5.66 3.97 -4.45 5.45 3.41 -1.26 -4.90 113.62 121.49 1zmz n SER 13 Ca 0.03 -2.77 -0.44 0.00 -0.26 0.00 0.00 58.87 55.42 1zmz n SER 13 Cb 0.48 -1.53 -0.02 0.00 -0.26 0.00 0.00 64.21 62.89 1zmz n SER 13 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1zmz s SER 14 N 3.50 6.70 -0.51 4.04 0.01 -1.26 -5.00 113.70 121.18 1zmz s SER 14 Ca 0.51 -2.20 -0.28 0.00 1.31 0.00 0.00 55.95 55.29 1zmz s SER 14 Cb 0.14 -2.39 -0.01 0.00 0.21 0.00 0.00 66.02 63.97 1zmz s SER 14 CO -0.04 -1.00 1.64 -1.10 0.41 0.00 0.00 173.24 173.15 1zmz s GLN 15 N 2.46 3.12 0.00 12.44 -0.21 -1.26 -4.93 119.66 131.28 1zmz s GLN 15 Ca 0.34 0.77 -0.22 0.00 0.02 0.00 0.00 55.36 56.27 1zmz s GLN 15 Cb -0.05 -4.22 -0.19 0.00 1.00 0.00 0.00 33.01 29.55 1zmz s GLN 15 CO -0.08 -2.14 1.19 0.00 -2.12 0.00 0.00 175.29 172.14 1zmz h ARG 16 N 12.67 0.30 -5.89 2.91 3.08 -2.01 -3.41 114.38 122.03 1zmz h ARG 16 Ca -0.28 -0.23 -0.62 0.00 0.07 0.00 0.00 59.98 58.92 1zmz h ARG 16 Cb 1.13 0.04 -0.12 0.00 0.08 0.00 0.00 29.97 31.11 1zmz h ARG 16 CO 1.15 0.87 0.43 0.21 -1.07 0.00 0.00 179.97 181.55 1zmz s LYS 17 N -3.68 3.52 0.15 0.04 2.20 -1.26 -4.86 119.74 115.85 1zmz s LYS 17 Ca -0.15 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 1zmz s LYS 17 Cb 0.03 -3.91 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 1zmz s LYS 17 CO 0.76 -1.09 0.00 0.54 -0.36 0.00 0.00 175.35 175.20 1zmz n ARG 18 N 6.78 0.00 -4.07 4.03 5.12 -1.26 -5.10 116.66 122.17 1zmz n ARG 18 Ca 0.04 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.64 1zmz n ARG 18 Cb 0.48 -0.12 -0.16 0.00 -1.16 0.00 0.00 32.46 31.50 1zmz n ARG 18 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1zmz s MET 19 N -1.67 2.52 0.43 5.56 1.75 -1.26 -5.14 119.30 121.49 1zmz s MET 19 Ca 0.00 -0.90 -0.26 0.00 -1.25 0.00 0.00 55.69 53.28 1zmz s MET 19 Cb 0.00 -2.53 -0.09 0.00 2.84 0.00 0.00 34.83 35.05 1zmz s MET 19 CO 0.00 -0.34 1.46 -1.13 -0.65 0.00 0.00 175.02 174.36 1zmz n SER 20 N 4.62 3.51 -4.67 1.11 3.41 -1.26 -4.96 113.62 115.38 1zmz n SER 20 Ca -0.18 1.15 -0.42 0.00 -0.26 0.00 0.00 58.87 59.16 1zmz n SER 20 Cb 0.48 -1.62 -0.03 0.00 -0.26 0.00 0.00 64.21 62.78 1zmz n SER 20 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1zmz s PRO 21 N -2.37 4.19 0.00 4.33 0.04 -1.26 -5.00 135.00 134.93 1zmz s PRO 21 Ca 0.59 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.87 1zmz s PRO 21 Cb -0.45 -3.82 0.00 0.00 0.04 0.00 0.00 34.50 30.27 1zmz s PRO 21 CO 0.59 -0.79 0.00 1.63 0.04 0.00 0.00 177.00 178.48 1zmz n LYS 22 N 6.43 1.37 -2.63 4.56 5.02 -1.26 -5.04 118.16 126.62 1zmz n LYS 22 Ca 0.16 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.03 1zmz n LYS 22 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.42 1zmz n LYS 22 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1zmz s PRO 23 N 4.54 3.89 0.00 1.97 0.04 -1.26 -4.23 135.00 139.95 1zmz s PRO 23 Ca 0.00 -1.83 0.00 0.00 0.04 0.00 0.00 61.00 59.21 1zmz s PRO 23 Cb 0.00 -5.42 0.00 0.00 0.04 0.00 0.00 34.50 29.12 1zmz s PRO 23 CO 0.00 -2.18 0.00 -0.85 0.04 0.00 0.00 177.00 174.01 1zmz n GLU 24 N 8.16 0.00 -3.67 4.56 -0.00 -1.26 -5.17 120.64 123.26 1zmz n GLU 24 Ca 0.43 0.00 -0.13 0.00 -0.00 0.00 0.00 57.16 57.46 1zmz n GLU 24 Cb 0.47 0.00 -0.08 0.00 -0.00 0.00 0.00 31.44 31.83 1zmz n GLU 24 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.13 176.65 1zmz s LEU 25 N -2.71 -0.33 0.00 -1.84 2.34 -1.26 -5.11 118.68 109.78 1zmz s LEU 25 Ca 0.00 1.22 0.00 0.00 0.06 0.00 0.00 54.13 55.41 1zmz s LEU 25 Cb 0.00 2.06 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1zmz s LEU 25 CO 0.00 -0.21 0.00 0.35 -1.06 0.00 0.00 176.35 175.43 1zmz n THR 26 N 2.90 0.00 0.14 5.48 -2.24 -1.26 -4.53 114.28 114.78 1zmz n THR 26 Ca -0.14 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.50 1zmz n THR 26 Cb 0.56 -1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 67.71 1zmz n THR 26 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1zmz h GLU 27 N 0.00 -0.53 -0.33 -0.78 3.07 -1.99 -0.22 114.58 113.80 1zmz h GLU 27 Ca 0.00 0.04 0.07 0.00 -0.50 0.00 0.00 59.36 58.97 1zmz h GLU 27 Cb 0.00 0.12 -0.08 0.00 -0.84 0.00 0.00 28.75 27.95 1zmz h GLU 27 CO 0.00 -0.35 -0.27 1.49 -1.40 0.00 0.00 179.01 178.47 1zmz h GLU 28 N -0.55 -0.23 0.21 2.33 4.22 -1.99 -2.30 114.58 116.27 1zmz h GLU 28 Ca 0.01 0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.46 1zmz h GLU 28 Cb 0.55 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1zmz h GLU 28 CO -0.13 -0.15 -0.10 1.96 -2.18 0.00 0.00 179.01 178.41 1zmz h GLN 29 N -0.24 -0.28 -0.46 1.92 4.20 -1.87 -2.01 115.11 116.37 1zmz h GLN 29 Ca 0.16 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.94 1zmz h GLN 29 Cb 0.50 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.26 1zmz h GLN 29 CO -0.47 0.01 -0.52 0.87 -0.67 0.00 0.00 178.83 178.05 1zmz h LYS 30 N -0.56 -0.29 -0.19 1.46 1.79 -1.08 -2.73 116.57 114.98 1zmz h LYS 30 Ca -0.03 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.51 1zmz h LYS 30 Cb 0.41 0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 31.06 1zmz h LYS 30 CO 0.05 -0.20 -0.34 0.37 -1.08 0.00 0.00 179.45 178.25 1zmz h GLN 31 N -0.30 -0.37 0.02 3.15 -0.00 -1.51 -2.61 115.11 113.49 1zmz h GLN 31 Ca 0.08 0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.75 1zmz h GLN 31 Cb 0.52 0.08 0.00 0.00 0.00 0.00 0.00 27.48 28.08 1zmz h GLN 31 CO -0.60 -0.25 -0.01 1.49 0.00 0.00 0.00 178.83 179.46 1zmz h GLU 32 N -0.39 -0.03 -0.16 1.69 4.57 -1.21 -1.31 114.58 117.74 1zmz h GLU 32 Ca 0.11 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.21 1zmz h GLU 32 Cb 0.56 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1zmz h GLU 32 CO -0.40 0.60 -0.20 0.82 -1.18 0.00 0.00 179.01 178.65 1zmz h ILE 33 N -0.70 1.35 -0.42 2.32 5.03 -1.64 -2.24 117.51 121.21 1zmz h ILE 33 Ca -0.00 -1.40 -0.10 0.00 -0.12 0.00 0.00 64.86 63.24 1zmz h ILE 33 Cb 0.65 1.88 -0.01 0.00 -3.03 0.00 0.00 36.82 36.30 1zmz h ILE 33 CO 0.01 0.42 -0.14 -0.09 -0.68 0.00 0.00 178.15 177.66 1zmz h ARG 34 N 0.06 0.84 -0.12 2.37 2.43 -1.59 -2.60 114.38 115.76 1zmz h ARG 34 Ca 0.02 -0.34 -0.16 0.00 -0.81 0.00 0.00 59.98 58.70 1zmz h ARG 34 Cb 0.76 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 1zmz h ARG 34 CO 0.05 0.97 -0.59 1.49 -1.51 0.00 0.00 179.97 180.37 1zmz h GLU 35 N 0.66 0.41 0.48 0.20 4.57 -1.35 -2.54 114.58 117.02 1zmz h GLU 35 Ca 0.10 -0.28 -0.02 0.00 -1.18 0.00 0.00 59.36 57.98 1zmz h GLU 35 Cb 0.68 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1zmz h GLU 35 CO 0.05 0.89 -0.23 0.00 -1.18 0.00 0.00 179.01 178.53 1zmz h ALA 36 N 1.05 -0.64 -0.84 2.92 0.00 -1.45 -0.65 119.26 119.65 1zmz h ALA 36 Ca -0.00 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.77 1zmz h ALA 36 Cb 1.12 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1zmz h ALA 36 CO 0.10 -0.77 0.53 0.35 0.00 0.00 0.00 179.25 179.46 1zmz h PHE 37 N -0.82 0.99 -0.41 0.00 3.04 -1.57 -2.47 116.94 115.70 1zmz h PHE 37 Ca -0.07 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.84 1zmz h PHE 37 Cb 0.57 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.74 1zmz h PHE 37 CO -0.01 0.54 -0.03 0.22 -2.02 0.00 0.00 178.31 177.02 1zmz h ASP 38 N 1.01 0.65 -0.66 0.41 1.82 -1.54 0.73 116.42 118.84 1zmz h ASP 38 Ca 0.35 -0.15 0.11 0.00 -0.39 0.00 0.00 57.03 56.94 1zmz h ASP 38 Cb 0.08 -0.17 -0.08 0.00 0.68 0.00 0.00 39.33 39.84 1zmz h ASP 38 CO -0.14 0.73 0.25 0.25 -1.61 0.00 0.00 179.24 178.73 1zmz h LEU 39 N 0.63 0.25 0.04 2.28 5.85 -0.65 -3.15 115.31 120.57 1zmz h LEU 39 Ca 0.13 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 1zmz h LEU 39 Cb 0.43 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1zmz h LEU 39 CO 0.02 0.13 -0.29 -0.26 -0.34 0.00 0.00 178.44 177.70 1zmz h PHE 40 N 0.43 0.16 -1.99 1.25 0.04 -1.47 -3.40 116.94 111.95 1zmz h PHE 40 Ca 0.34 -0.11 -0.73 0.00 2.80 0.00 0.00 57.97 60.27 1zmz h PHE 40 Cb 0.44 -0.01 -0.16 0.00 2.20 0.00 0.00 35.95 38.42 1zmz h PHE 40 CO -0.17 1.11 1.45 0.34 -0.60 0.00 0.00 178.31 180.44 1zmz s ASP 41 N -6.46 7.02 -0.13 2.17 -1.08 0.24 -4.81 116.67 113.63 1zmz s ASP 41 Ca -0.18 -2.87 -0.01 0.00 -0.52 0.00 0.00 52.55 48.97 1zmz s ASP 41 Cb -0.02 -2.43 -0.24 0.00 -1.46 0.00 0.00 42.92 38.78 1zmz s ASP 41 CO 0.73 -0.82 0.31 0.00 0.52 0.00 0.00 175.17 175.91 1zmz n ALA 42 N 6.08 1.11 0.23 3.66 0.00 -1.19 -4.37 120.51 126.02 1zmz n ALA 42 Ca 0.38 -0.74 0.08 0.00 0.00 0.00 0.00 53.44 53.17 1zmz n ALA 42 Cb 0.43 -0.60 0.56 0.00 0.00 0.00 0.00 19.45 19.85 1zmz n ALA 42 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1zmz h ASP 43 N 0.05 0.00 -0.33 0.00 3.58 -1.87 -3.45 116.42 114.40 1zmz h ASP 43 Ca -0.43 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.02 1zmz h ASP 43 Cb 2.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.07 1zmz h ASP 43 CO 0.06 0.21 0.00 0.61 -2.88 0.00 0.00 179.24 177.24 1zmz n GLY 44 N -0.59 0.47 0.82 -0.78 0.00 -1.26 -2.06 105.19 101.79 1zmz n GLY 44 Ca -0.02 -0.60 -0.01 0.00 0.00 0.00 0.00 46.02 45.39 1zmz n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zmz n THR 45 N -0.05 0.62 0.00 2.61 -2.24 -1.26 -0.18 114.28 113.78 1zmz n THR 45 Ca 0.00 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 62.00 1zmz n THR 45 Cb 0.00 -1.41 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 1zmz n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zmz n GLY 46 N 3.08 2.21 3.73 3.38 0.00 -1.26 -4.46 105.19 111.86 1zmz n GLY 46 Ca -0.01 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 1zmz n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zmz s THR 47 N 0.00 4.59 0.02 2.61 -4.23 -1.26 -4.07 115.64 113.30 1zmz s THR 47 Ca 0.00 -0.16 -0.01 0.00 -1.18 0.00 0.00 61.69 60.33 1zmz s THR 47 Cb 0.00 -2.96 -0.04 0.00 1.34 0.00 0.00 72.50 70.84 1zmz s THR 47 CO 0.00 0.59 0.17 -0.51 -0.54 0.00 0.00 174.62 174.33 1zmz s ILE 48 N -0.94 5.28 0.48 2.99 2.07 -0.22 -4.94 121.20 125.92 1zmz s ILE 48 Ca 0.14 -0.31 0.07 0.00 -1.41 0.00 0.00 60.65 59.14 1zmz s ILE 48 Cb -0.11 -3.51 0.03 0.00 0.13 0.00 0.00 42.46 39.00 1zmz s ILE 48 CO 0.03 0.25 0.66 1.51 -1.91 0.00 0.00 174.94 175.48 1zmz s ASP 49 N -2.15 5.46 0.41 4.50 -4.77 -1.26 -1.54 116.67 117.33 1zmz s ASP 49 Ca 0.30 -0.39 0.08 0.00 -3.30 0.00 0.00 52.55 49.23 1zmz s ASP 49 Cb -0.13 -0.55 0.88 0.00 -1.09 0.00 0.00 42.92 42.03 1zmz s ASP 49 CO 0.22 -0.95 2.04 -0.37 0.70 0.00 0.00 175.17 176.81 1zmz h VAL 50 N 0.42 1.11 0.57 2.11 -1.51 -1.62 0.30 116.25 117.63 1zmz h VAL 50 Ca -0.39 -0.26 -0.02 0.00 -1.23 0.00 0.00 66.70 64.80 1zmz h VAL 50 Cb 1.28 0.64 -0.02 0.00 -2.13 0.00 0.00 31.29 31.07 1zmz h VAL 50 CO 0.46 0.11 -0.48 0.11 -1.23 0.00 0.00 177.57 176.54 1zmz h LYS 51 N 0.47 -0.99 -0.23 5.19 1.57 -1.96 -0.91 116.57 119.71 1zmz h LYS 51 Ca 0.12 0.07 0.04 0.00 -1.87 0.00 0.00 60.65 59.01 1zmz h LYS 51 Cb 0.00 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1zmz h LYS 51 CO -0.02 -0.66 -0.02 0.93 -0.57 0.00 0.00 179.45 179.11 1zmz h GLU 52 N -1.03 0.05 -0.60 3.15 5.08 -1.93 -2.84 114.58 116.46 1zmz h GLU 52 Ca -0.07 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1zmz h GLU 52 Cb 0.86 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.07 1zmz h GLU 52 CO -0.01 0.03 0.24 1.25 -1.00 0.00 0.00 179.01 179.53 1zmz h LEU 53 N 0.05 0.79 -0.50 1.33 5.85 -0.43 0.06 115.31 122.46 1zmz h LEU 53 Ca 0.11 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1zmz h LEU 53 Cb 0.15 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1zmz h LEU 53 CO -0.20 0.71 0.26 0.11 -0.34 0.00 0.00 178.44 178.98 1zmz h LYS 54 N 0.86 0.71 -0.67 1.25 1.57 -1.16 -0.68 116.57 118.44 1zmz h LYS 54 Ca 0.20 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1zmz h LYS 54 Cb 0.16 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1zmz h LYS 54 CO -0.02 0.57 0.40 0.28 -0.57 0.00 0.00 179.45 180.11 1zmz h VAL 55 N 0.66 1.19 -0.71 0.50 2.07 -1.28 -2.46 116.25 116.22 1zmz h VAL 55 Ca 0.17 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1zmz h VAL 55 Cb 0.08 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 1zmz h VAL 55 CO -0.03 0.20 0.37 0.00 0.02 0.00 0.00 177.57 178.14 1zmz h ALA 56 N 1.52 0.91 -0.36 1.67 0.00 -0.64 -2.67 119.26 119.69 1zmz h ALA 56 Ca 0.24 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1zmz h ALA 56 Cb -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1zmz h ALA 56 CO -0.05 0.45 -0.26 0.52 0.00 0.00 0.00 179.25 179.91 1zmz h MET 57 N 0.98 0.74 -0.08 0.00 2.07 -1.03 -1.02 114.93 116.60 1zmz h MET 57 Ca 0.25 -0.31 0.02 0.00 -2.07 0.00 0.00 59.70 57.58 1zmz h MET 57 Cb 0.07 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 29.75 1zmz h MET 57 CO -0.04 0.92 -0.03 0.00 1.07 0.00 0.00 176.91 178.83 1zmz h ARG 58 N 0.64 -0.02 -0.76 1.72 3.08 -1.40 -1.72 114.38 115.92 1zmz h ARG 58 Ca 0.08 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 1zmz h ARG 58 Cb 0.77 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 1zmz h ARG 58 CO 0.06 -0.02 0.34 0.00 -1.07 0.00 0.00 179.97 179.28 1zmz h ALA 59 N 1.05 0.98 0.12 0.04 0.00 -1.49 -3.37 119.26 116.60 1zmz h ALA 59 Ca 0.04 -0.17 -0.28 0.00 0.00 0.00 0.00 54.91 54.51 1zmz h ALA 59 Cb 0.09 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.59 1zmz h ALA 59 CO -0.10 0.57 -1.22 1.25 0.00 0.00 0.00 179.25 179.76 1zmz h LEU 60 N 1.08 0.55 0.75 0.00 6.46 -1.16 -3.40 115.31 119.59 1zmz h LEU 60 Ca 0.26 -0.55 -0.03 0.00 -0.12 0.00 0.00 57.88 57.44 1zmz h LEU 60 Cb 0.16 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.91 1zmz h LEU 60 CO -0.03 1.40 -0.50 1.23 -0.62 0.00 0.00 178.44 179.92 1zmz h GLY 61 N 1.20 -1.35 0.00 3.75 0.00 -1.47 -3.46 103.07 101.74 1zmz h GLY 61 Ca -0.15 0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1zmz h GLY 61 CO 0.21 -0.44 0.00 0.69 0.00 0.00 0.00 176.54 177.00 1zmz n PHE 62 N -5.62 0.00 -3.17 5.60 3.72 -1.26 -3.96 117.46 112.77 1zmz n PHE 62 Ca -0.14 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.07 1zmz n PHE 62 Cb 0.50 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.98 1zmz n PHE 62 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1zmz s GLU 63 N 0.00 0.93 0.00 -1.08 2.02 -1.26 -5.18 118.70 114.13 1zmz s GLU 63 Ca 0.00 -1.62 0.00 0.00 0.02 0.00 0.00 54.97 53.37 1zmz s GLU 63 Cb 0.00 -0.88 0.00 0.00 0.10 0.00 0.00 34.13 33.35 1zmz s GLU 63 CO 0.00 -1.35 0.00 -0.35 0.02 0.00 0.00 175.26 173.58 1zmz n PRO 64 N 3.03 1.90 0.00 0.39 -0.04 -1.25 -5.11 135.00 133.92 1zmz n PRO 64 Ca 0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 1zmz n PRO 64 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 1zmz n PRO 64 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1zmz n LYS 65 N -0.30 0.00 0.00 0.54 4.81 -1.26 -5.04 118.16 116.91 1zmz n LYS 65 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1zmz n LYS 65 Cb 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 35.03 34.34 1zmz n LYS 65 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1zmz n LYS 66 N -0.28 0.00 -1.87 1.64 4.76 -1.26 -5.04 118.16 116.11 1zmz n LYS 66 Ca 0.00 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 1zmz n LYS 66 Cb 0.00 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.18 1zmz n LYS 66 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1zmz n GLU 67 N -0.59 3.74 0.04 1.97 0.00 -1.26 -4.60 120.64 119.94 1zmz n GLU 67 Ca 0.00 -3.00 -0.00 0.00 0.00 0.00 0.00 57.16 54.16 1zmz n GLU 67 Cb 0.00 -2.90 -0.00 0.00 0.00 0.00 0.00 31.44 28.54 1zmz n GLU 67 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1zmz n GLU 68 N 3.71 0.00 0.02 3.44 4.71 -1.26 -4.53 120.64 126.73 1zmz n GLU 68 Ca 0.58 0.00 -0.18 0.00 -0.01 0.00 0.00 57.16 57.54 1zmz n GLU 68 Cb 0.31 -0.44 -0.14 0.00 -1.01 0.00 0.00 31.44 30.16 1zmz n GLU 68 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1zmz h ILE 69 N -0.01 1.57 -0.75 -3.67 1.08 -1.97 -2.25 117.51 111.51 1zmz h ILE 69 Ca 0.00 -2.44 -0.04 0.00 -0.39 0.00 0.00 64.86 62.00 1zmz h ILE 69 Cb 0.01 3.18 -0.03 0.00 -3.07 0.00 0.00 36.82 36.90 1zmz h ILE 69 CO 0.00 0.68 0.32 0.50 -0.69 0.00 0.00 178.15 178.96 1zmz h LYS 70 N -0.49 1.11 -0.18 2.37 3.64 -1.91 -2.84 116.57 118.26 1zmz h LYS 70 Ca -0.10 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1zmz h LYS 70 Cb 1.45 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1zmz h LYS 70 CO 0.11 0.89 0.09 -0.22 -2.27 0.00 0.00 179.45 178.06 1zmz h LYS 71 N 1.07 0.19 0.52 1.90 3.11 -1.79 -1.60 116.57 119.97 1zmz h LYS 71 Ca 0.25 -0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 58.05 1zmz h LYS 71 Cb 0.18 -0.04 0.01 0.00 -1.00 0.00 0.00 32.23 31.38 1zmz h LYS 71 CO -0.02 0.13 -0.25 0.52 -2.81 0.00 0.00 179.45 177.01 1zmz h MET 72 N 0.20 -0.67 -0.67 1.90 2.86 -1.45 -2.05 114.93 115.05 1zmz h MET 72 Ca 0.07 0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.68 1zmz h MET 72 Cb 0.01 0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1zmz h MET 72 CO -0.05 -0.44 0.10 0.82 1.06 0.00 0.00 176.91 178.40 1zmz h ILE 73 N -0.71 1.26 -0.46 -1.22 1.08 -1.54 -2.77 117.51 113.16 1zmz h ILE 73 Ca -0.07 -1.04 -0.13 0.00 -0.39 0.00 0.00 64.86 63.22 1zmz h ILE 73 Cb 0.54 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 1zmz h ILE 73 CO 0.12 0.39 -0.25 -1.28 -0.69 0.00 0.00 178.15 176.44 1zmz h SER 74 N 1.03 0.99 -0.02 1.72 0.87 -1.40 -3.15 113.55 113.59 1zmz h SER 74 Ca 0.20 -0.39 -0.22 0.00 -1.23 0.00 0.00 61.79 60.16 1zmz h SER 74 Cb 0.45 -0.27 0.02 0.00 -0.44 0.00 0.00 62.40 62.15 1zmz h SER 74 CO 0.01 1.18 -0.84 -0.08 -0.53 0.00 0.00 176.83 176.57 1zmz h GLU 75 N 0.82 0.60 0.00 2.24 4.81 -1.28 -3.32 114.58 118.45 1zmz h GLU 75 Ca 0.10 -0.62 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1zmz h GLU 75 Cb 0.82 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1zmz h GLU 75 CO 0.07 1.23 0.00 0.82 -0.73 0.00 0.00 179.01 180.40 1zmz h ILE 76 N 0.21 0.00 -0.79 2.32 2.04 -1.68 -3.38 117.51 116.24 1zmz h ILE 76 Ca -0.10 -0.97 -0.73 0.00 1.00 0.00 0.00 64.86 64.06 1zmz h ILE 76 Cb 1.51 1.97 -0.10 0.00 -0.74 0.00 0.00 36.82 39.46 1zmz h ILE 76 CO 0.17 0.00 2.49 -0.67 0.00 0.00 0.00 178.15 180.14 1zmz n ASP 77 N -3.05 4.56 0.00 1.72 -0.08 -1.19 -4.00 116.55 114.50 1zmz n ASP 77 Ca 0.04 -2.98 0.00 0.00 -1.51 0.00 0.00 54.79 50.34 1zmz n ASP 77 Cb 0.52 -1.57 0.00 0.00 2.34 0.00 0.00 41.12 42.41 1zmz n ASP 77 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1zmz n LYS 78 N 5.08 0.00 0.00 -0.67 5.02 -1.26 -4.81 118.16 121.52 1zmz n LYS 78 Ca 0.45 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1zmz n LYS 78 Cb 0.38 -0.21 0.00 0.00 -0.02 0.00 0.00 35.03 35.18 1zmz n LYS 78 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1zmz n GLU 79 N 0.00 0.00 -3.00 1.97 1.02 -1.26 -4.95 120.64 114.42 1zmz n GLU 79 Ca 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.99 1zmz n GLU 79 Cb 0.35 -0.21 0.01 0.00 -0.02 0.00 0.00 31.44 31.58 1zmz n GLU 79 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zmz n GLY 80 N 2.42 2.28 0.00 0.62 0.00 -1.26 -5.09 105.19 104.15 1zmz n GLY 80 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1zmz n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zmz n THR 81 N 0.49 -0.89 -2.54 2.61 -2.24 -1.26 -4.98 114.28 105.47 1zmz n THR 81 Ca 0.17 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.52 1zmz n THR 81 Cb 0.66 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.62 1zmz n THR 81 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1zmz s GLY 82 N -1.52 1.67 -0.13 3.38 0.00 -1.26 -4.78 107.32 104.67 1zmz s GLY 82 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 44.72 45.06 1zmz s GLY 82 CO 0.00 2.34 -0.22 -1.59 0.00 0.00 0.00 173.10 173.63 1zmz s LYS 83 N 3.36 3.04 -0.08 2.90 0.00 -1.26 -1.37 119.74 126.33 1zmz s LYS 83 Ca 0.49 -0.85 0.04 0.00 0.00 0.00 0.00 55.97 55.65 1zmz s LYS 83 Cb -0.18 -2.42 -0.01 0.00 0.00 0.00 0.00 37.83 35.22 1zmz s LYS 83 CO 0.10 0.03 -0.21 1.41 0.00 0.00 0.00 175.35 176.68 1zmz s MET 84 N 0.71 2.79 0.47 1.78 1.75 -0.59 -4.99 119.30 121.21 1zmz s MET 84 Ca -0.10 -0.83 0.07 0.00 -1.25 0.00 0.00 55.69 53.58 1zmz s MET 84 Cb -0.16 -2.30 0.03 0.00 2.84 0.00 0.00 34.83 35.24 1zmz s MET 84 CO 0.01 0.35 0.64 1.21 -0.65 0.00 0.00 175.02 176.57 1zmz s ASN 85 N -0.05 5.50 0.29 1.11 3.84 -1.26 -1.06 114.94 123.31 1zmz s ASN 85 Ca -0.06 -0.41 0.07 0.00 0.21 0.00 0.00 52.86 52.67 1zmz s ASN 85 Cb -0.15 -0.55 0.45 0.00 -0.55 0.00 0.00 41.25 40.46 1zmz s ASN 85 CO 0.05 -0.92 1.69 0.15 -2.79 0.00 0.00 177.10 175.28 1zmz h PHE 86 N 0.47 0.24 -0.75 0.43 3.57 -2.00 -2.20 116.94 116.69 1zmz h PHE 86 Ca -0.39 -0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.10 1zmz h PHE 86 Cb 1.28 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.92 1zmz h PHE 86 CO 0.39 0.61 0.45 0.78 -2.23 0.00 0.00 178.31 178.31 1zmz h GLY 87 N 1.27 1.11 0.97 2.40 0.00 -1.97 0.23 103.07 107.08 1zmz h GLY 87 Ca 0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 1zmz h GLY 87 CO 0.07 0.23 -0.29 -0.55 0.00 0.00 0.00 176.54 175.99 1zmz h ASP 88 N 0.84 -0.69 -0.18 0.19 3.32 -1.94 -2.57 116.42 115.39 1zmz h ASP 88 Ca 0.32 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.40 1zmz h ASP 88 Cb 0.14 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1zmz h ASP 88 CO -0.16 -0.47 0.07 0.15 -1.72 0.00 0.00 179.24 177.11 1zmz h PHE 89 N -0.86 0.13 0.62 4.55 3.57 -1.28 -0.35 116.94 123.31 1zmz h PHE 89 Ca -0.08 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 1zmz h PHE 89 Cb 0.64 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 1zmz h PHE 89 CO -0.02 0.07 -0.46 1.25 -2.23 0.00 0.00 178.31 176.92 1zmz h LEU 90 N 0.17 -1.21 0.30 0.59 5.85 -1.08 -2.42 115.31 117.51 1zmz h LEU 90 Ca 0.07 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1zmz h LEU 90 Cb 0.03 0.38 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1zmz h LEU 90 CO -0.07 -0.67 -0.15 0.71 -0.34 0.00 0.00 178.44 177.93 1zmz h THR 91 N -1.04 0.73 0.17 1.05 1.35 -1.43 -2.55 112.91 111.19 1zmz h THR 91 Ca -0.08 -0.36 -0.01 0.00 -0.55 0.00 0.00 66.41 65.41 1zmz h THR 91 Cb 0.87 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1zmz h THR 91 CO 0.02 0.08 -0.08 1.62 -0.25 0.00 0.00 175.52 176.91 1zmz h VAL 92 N -0.60 0.93 -0.17 6.82 3.04 -1.19 -2.33 116.25 122.74 1zmz h VAL 92 Ca -0.04 -0.47 -0.04 0.00 -1.01 0.00 0.00 66.70 65.13 1zmz h VAL 92 Cb 0.44 1.21 -0.00 0.00 -2.01 0.00 0.00 31.29 30.92 1zmz h VAL 92 CO 0.07 0.11 -0.07 -0.03 -1.01 0.00 0.00 177.57 176.64 1zmz h MET 93 N -0.46 0.35 0.35 4.17 1.85 -1.57 -2.30 114.93 117.33 1zmz h MET 93 Ca -0.02 -0.15 -0.02 0.00 -0.61 0.00 0.00 59.70 58.90 1zmz h MET 93 Cb 0.35 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.37 1zmz h MET 93 CO 0.04 0.64 -0.17 1.79 -0.40 0.00 0.00 176.91 178.81 1zmz h THR 94 N 0.05 0.63 -0.08 -0.77 1.35 -1.57 -2.59 112.91 109.92 1zmz h THR 94 Ca 0.04 -0.49 -0.05 0.00 -0.55 0.00 0.00 66.41 65.36 1zmz h THR 94 Cb 0.53 0.87 -0.01 0.00 -1.73 0.00 0.00 68.15 67.81 1zmz h THR 94 CO 0.02 0.09 -0.18 -0.61 -0.25 0.00 0.00 175.52 174.59 1zmz h GLN 95 N -0.76 0.13 -0.53 4.72 5.75 -1.55 -0.10 115.11 122.76 1zmz h GLN 95 Ca -0.05 -0.03 -0.12 0.00 -0.15 0.00 0.00 58.65 58.30 1zmz h GLN 95 Cb 0.51 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 1zmz h GLN 95 CO 0.08 0.32 -0.13 -0.22 -2.65 0.00 0.00 178.83 176.23 1zmz h LYS 96 N 0.12 1.02 0.27 1.69 1.63 -1.48 -3.36 116.57 116.46 1zmz h LYS 96 Ca 0.02 -0.39 -0.01 0.00 -0.85 0.00 0.00 60.65 59.42 1zmz h LYS 96 Cb 0.40 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 1zmz h LYS 96 CO 0.03 1.07 -0.13 0.52 -3.45 0.00 0.00 179.45 177.49 1zmz h MET 97 N 0.90 -0.35 -0.00 1.90 2.86 -1.32 -3.51 114.93 115.41 1zmz h MET 97 Ca 0.14 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1zmz h MET 97 Cb 0.70 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.44 1zmz h MET 97 CO 0.05 -0.23 0.00 -1.13 1.06 0.00 0.00 176.91 176.66