#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzl s SER 2 N 0.00 4.07 -0.22 1.61 0.01 -1.26 -5.11 113.70 112.80 2dzl s SER 2 Ca 0.00 -0.20 -0.05 0.00 1.31 0.00 0.00 55.95 57.01 2dzl s SER 2 Cb 0.00 -0.86 -0.02 0.00 0.21 0.00 0.00 66.02 65.35 2dzl s SER 2 CO 0.00 0.34 0.01 -0.44 0.41 0.00 0.00 173.24 173.56 2dzl s SER 3 N -0.82 4.74 -0.08 2.44 0.01 -1.26 -5.07 113.70 113.67 2dzl s SER 3 Ca 0.12 -0.27 -0.31 0.00 1.31 0.00 0.00 55.95 56.80 2dzl s SER 3 Cb -0.11 -1.83 0.12 0.00 0.21 0.00 0.00 66.02 64.41 2dzl s SER 3 CO 0.01 0.00 1.01 -0.83 0.41 0.00 0.00 173.24 173.84 2dzl s GLY 4 N 1.38 -0.39 -0.14 3.44 0.00 -1.26 -5.17 107.32 105.18 2dzl s GLY 4 Ca 0.05 1.29 -0.11 0.00 0.00 0.00 0.00 44.72 45.94 2dzl s GLY 4 CO 0.01 0.45 0.36 -0.45 0.00 0.00 0.00 173.10 173.47 2dzl s SER 5 N -2.28 -0.40 0.08 1.64 0.15 -1.26 -5.12 113.70 106.50 2dzl s SER 5 Ca 0.06 0.75 -0.36 0.00 0.70 0.00 0.00 55.95 57.10 2dzl s SER 5 Cb -0.01 0.72 -0.19 0.00 -1.71 0.00 0.00 66.02 64.83 2dzl s SER 5 CO -0.07 -0.14 0.94 -1.54 1.20 0.00 0.00 173.24 173.63 2dzl n SER 6 N 3.32 -0.14 -3.15 5.45 3.41 -1.26 -4.94 113.62 116.31 2dzl n SER 6 Ca -0.16 1.15 0.05 0.00 -0.26 0.00 0.00 58.87 59.64 2dzl n SER 6 Cb 0.57 -0.97 -0.01 0.00 -0.26 0.00 0.00 64.21 63.54 2dzl n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dzl s GLY 7 N -0.25 -0.83 -1.42 5.00 0.00 -1.26 -4.97 107.32 103.59 2dzl s GLY 7 Ca 0.82 2.04 -0.02 0.00 0.00 0.00 0.00 44.72 47.56 2dzl s GLY 7 CO 0.56 3.70 0.03 1.15 0.00 0.00 0.00 173.10 178.54 2dzl n MET 8 N 5.39 -0.91 -3.39 2.90 -0.00 -1.26 -4.84 117.12 115.01 2dzl n MET 8 Ca -0.00 0.08 -0.44 0.00 -0.00 0.00 0.00 57.70 57.34 2dzl n MET 8 Cb 0.54 -3.26 -0.01 0.00 -0.00 0.00 0.00 33.22 30.48 2dzl n MET 8 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2dzl s SER 9 N -4.25 7.04 -0.09 3.17 1.04 -1.26 -4.69 113.70 114.66 2dzl s SER 9 Ca 0.02 -3.51 -0.06 0.00 0.48 0.00 0.00 55.95 52.89 2dzl s SER 9 Cb -0.01 -2.16 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 2dzl s SER 9 CO 0.93 -0.30 -0.13 0.52 0.98 0.00 0.00 173.24 175.23 2dzl n VAL 10 N 2.79 0.72 -3.89 5.02 0.31 -1.26 -5.11 118.33 116.91 2dzl n VAL 10 Ca 0.22 -0.06 -0.09 0.00 -0.01 0.00 0.00 64.34 64.40 2dzl n VAL 10 Cb 0.40 -1.69 -0.04 0.00 -0.91 0.00 0.00 33.84 31.60 2dzl n VAL 10 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2dzl s ASN 11 N -5.95 -0.17 -0.04 4.52 2.20 -1.26 -5.12 114.94 109.12 2dzl s ASN 11 Ca -0.14 -0.73 -0.20 0.00 -0.94 0.00 0.00 52.86 50.85 2dzl s ASN 11 Cb 0.05 0.61 0.04 0.00 -2.00 0.00 0.00 41.25 39.94 2dzl s ASN 11 CO 0.18 -1.15 0.43 -0.32 -2.94 0.00 0.00 177.10 173.31 2dzl s MET 12 N -3.95 0.76 0.19 3.55 1.75 -1.26 -4.98 119.30 115.36 2dzl s MET 12 Ca 0.16 0.04 -0.23 0.00 -1.25 0.00 0.00 55.69 54.41 2dzl s MET 12 Cb -0.02 0.35 0.10 0.00 2.84 0.00 0.00 34.83 38.10 2dzl s MET 12 CO 0.05 -0.21 1.57 -0.44 -0.65 0.00 0.00 175.02 175.33 2dzl h ASP 13 N 3.82 -1.46 0.47 1.11 5.19 -2.02 1.44 116.42 124.97 2dzl h ASP 13 Ca -0.29 0.26 -0.04 0.00 -0.62 0.00 0.00 57.03 56.35 2dzl h ASP 13 Cb 1.17 0.70 -0.01 0.00 0.18 0.00 0.00 39.33 41.37 2dzl h ASP 13 CO 0.37 -0.31 -0.19 -0.08 -3.12 0.00 0.00 179.24 175.91 2dzl h GLU 14 N -0.14 0.00 0.85 3.56 4.57 -2.01 -3.06 114.58 118.35 2dzl h GLU 14 Ca 0.23 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.37 2dzl h GLU 14 Cb 0.56 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2dzl h GLU 14 CO -0.78 0.19 -0.41 1.25 -1.18 0.00 0.00 179.01 178.09 2dzl h LEU 15 N 0.00 -0.97 -0.97 1.64 6.46 0.14 -3.02 115.31 118.59 2dzl h LEU 15 Ca -0.00 0.03 0.12 0.00 -0.12 0.00 0.00 57.88 57.91 2dzl h LEU 15 Cb 0.48 0.25 -0.14 0.00 -0.73 0.00 0.00 40.66 40.52 2dzl h LEU 15 CO 0.03 -0.62 -0.47 -1.14 -0.62 0.00 0.00 178.44 175.62 2dzl n ARG 16 N -5.54 -0.33 -0.13 1.25 0.00 0.76 -0.89 116.66 111.79 2dzl n ARG 16 Ca -0.14 1.48 -0.04 0.00 -0.00 0.00 0.00 57.85 59.15 2dzl n ARG 16 Cb 0.45 -2.19 -0.03 0.00 0.00 0.00 0.00 32.46 30.69 2dzl n ARG 16 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2dzl h HIS 17 N 0.00 -0.62 -0.71 -0.14 2.76 -1.55 0.83 115.15 115.73 2dzl h HIS 17 Ca 0.25 0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.56 2dzl h HIS 17 Cb 0.49 0.31 -0.12 0.00 1.55 0.00 0.00 27.41 29.64 2dzl h HIS 17 CO -0.92 -0.13 -0.43 0.37 -1.30 0.00 0.00 177.93 175.52 2dzl h GLN 18 N -0.01 -0.15 -0.33 5.26 4.15 -0.88 0.23 115.11 123.38 2dzl h GLN 18 Ca 0.05 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.55 2dzl h GLN 18 Cb 0.14 0.03 -0.08 0.00 0.21 0.00 0.00 27.48 27.78 2dzl h GLN 18 CO -0.30 -0.10 -0.24 0.28 -1.93 0.00 0.00 178.83 176.54 2dzl h VAL 19 N -0.15 0.37 -0.02 2.39 2.07 0.35 -0.65 116.25 120.61 2dzl h VAL 19 Ca 0.22 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.74 2dzl h VAL 19 Cb 0.55 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2dzl h VAL 19 CO -0.77 0.00 -0.16 0.24 0.02 0.00 0.00 177.57 176.90 2dzl h MET 20 N -0.21 -0.18 -0.98 1.57 2.86 0.36 0.30 114.93 118.66 2dzl h MET 20 Ca 0.16 0.01 0.13 0.00 -2.06 0.00 0.00 59.70 57.95 2dzl h MET 20 Cb 0.47 0.04 -0.15 0.00 0.06 0.00 0.00 31.60 32.02 2dzl h MET 20 CO -0.45 -0.12 -0.45 0.82 1.06 0.00 0.00 176.91 177.77 2dzl h ILE 21 N -0.19 0.01 -0.45 -1.22 2.04 -0.60 0.90 117.51 118.00 2dzl h ILE 21 Ca 0.01 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.96 2dzl h ILE 21 Cb 0.21 0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 36.20 2dzl h ILE 21 CO -0.12 0.00 -0.16 -1.13 0.00 0.00 0.00 178.15 176.74 2dzl h ASN 22 N -0.01 -0.56 0.33 1.72 -0.73 -0.51 0.25 115.58 116.07 2dzl h ASN 22 Ca 0.28 0.15 -0.01 0.00 1.87 0.00 0.00 56.30 58.60 2dzl h ASN 22 Cb 0.54 0.33 -0.01 0.00 0.27 0.00 0.00 38.32 39.45 2dzl h ASN 22 CO -0.96 -0.19 -0.34 1.56 -0.37 0.00 0.00 177.43 177.13 2dzl h GLN 23 N -0.06 -0.64 -0.75 6.67 7.50 0.44 0.15 115.11 128.42 2dzl h GLN 23 Ca 0.22 0.04 0.15 0.00 0.50 0.00 0.00 58.65 59.56 2dzl h GLN 23 Cb 0.39 0.15 -0.14 0.00 0.05 0.00 0.00 27.48 27.93 2dzl h GLN 23 CO -0.50 -0.43 -0.20 0.35 -1.50 0.00 0.00 178.83 176.56 2dzl h PHE 24 N -0.67 -0.43 -0.15 2.96 3.57 0.18 1.80 116.94 124.20 2dzl h PHE 24 Ca -0.04 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2dzl h PHE 24 Cb 0.58 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 2dzl h PHE 24 CO -0.19 -0.33 0.10 0.28 -2.23 0.00 0.00 178.31 175.94 2dzl h VAL 25 N -0.01 1.00 0.06 1.41 2.07 -0.20 0.56 116.25 121.14 2dzl h VAL 25 Ca 0.36 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.82 2dzl h VAL 25 Cb 0.55 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2dzl h VAL 25 CO -0.78 0.03 -0.03 -0.07 0.02 0.00 0.00 177.57 176.74 2dzl h LEU 26 N 0.15 -0.07 -0.44 2.57 3.38 0.49 0.69 115.31 122.07 2dzl h LEU 26 Ca 0.06 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.01 2dzl h LEU 26 Cb 0.07 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.75 2dzl h LEU 26 CO -0.01 0.48 -0.18 0.00 0.09 0.00 0.00 178.44 178.82 2dzl h ALA 27 N -0.89 0.17 0.11 1.53 0.00 0.23 -3.10 119.26 117.30 2dzl h ALA 27 Ca -0.01 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2dzl h ALA 27 Cb 0.18 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2dzl h ALA 27 CO 0.01 -0.53 -0.05 0.00 0.00 0.00 0.00 179.25 178.68 2dzl h ALA 28 N 1.26 -0.35 0.00 0.00 0.00 -0.01 -3.49 119.26 116.67 2dzl h ALA 28 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2dzl h ALA 28 Cb 0.42 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2dzl h ALA 28 CO -0.50 -0.34 0.00 0.41 0.00 0.00 0.00 179.25 178.82 2dzl n GLY 29 N 0.94 1.96 1.62 0.00 0.00 0.24 -5.05 105.19 104.91 2dzl n GLY 29 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 2dzl n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dzl n ALA 31 N -2.59 -2.31 0.02 0.00 0.00 -1.26 -4.79 120.51 109.58 2dzl n ALA 31 Ca -0.07 -0.80 -0.18 0.00 0.00 0.00 0.00 53.44 52.39 2dzl n ALA 31 Cb 0.26 -1.92 -0.13 0.00 0.00 0.00 0.00 19.45 17.65 2dzl n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dzl h ALA 32 N -1.96 -0.03 -0.73 0.00 0.00 -1.95 -3.29 119.26 111.31 2dzl h ALA 32 Ca -0.48 -0.63 0.08 0.00 0.00 0.00 0.00 54.91 53.89 2dzl h ALA 32 Cb 1.30 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.09 2dzl h ALA 32 CO 0.40 0.31 0.39 0.38 0.00 0.00 0.00 179.25 180.72 2dzl h ASP 33 N -0.37 0.53 -0.54 0.00 2.03 -1.98 -2.03 116.42 114.06 2dzl h ASP 33 Ca -0.10 0.05 0.09 0.00 -0.73 0.00 0.00 57.03 56.34 2dzl h ASP 33 Cb 1.44 -0.05 -0.11 0.00 -0.83 0.00 0.00 39.33 39.79 2dzl h ASP 33 CO 0.12 0.32 -0.36 1.56 -1.03 0.00 0.00 179.24 179.84 2dzl h GLN 34 N 0.67 -0.20 -0.50 4.15 1.08 -1.94 -1.35 115.11 117.02 2dzl h GLN 34 Ca 0.35 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.61 2dzl h GLN 34 Cb 0.32 0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.73 2dzl h GLN 34 CO -0.24 -0.13 -0.36 0.00 -0.95 0.00 0.00 178.83 177.15 2dzl h ALA 35 N 0.83 -0.43 -0.32 3.87 0.00 -1.43 0.85 119.26 122.63 2dzl h ALA 35 Ca 0.20 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2dzl h ALA 35 Cb 0.56 1.15 -0.04 0.00 0.00 0.00 0.00 17.79 19.45 2dzl h ALA 35 CO -0.65 -0.65 -0.19 -0.22 0.00 0.00 0.00 179.25 177.54 2dzl h LYS 36 N -0.08 -0.00 -0.01 0.00 3.64 -1.25 1.47 116.57 120.34 2dzl h LYS 36 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2dzl h LYS 36 Cb 0.29 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2dzl h LYS 36 CO -0.51 -0.00 -0.07 1.96 -2.27 0.00 0.00 179.45 178.56 2dzl h GLN 37 N -0.00 -0.07 -0.35 1.90 4.20 -0.61 0.53 115.11 120.71 2dzl h GLN 37 Ca 0.05 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.80 2dzl h GLN 37 Cb 0.13 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2dzl h GLN 37 CO -0.30 -0.05 -0.22 -0.07 -0.67 0.00 0.00 178.83 177.52 2dzl h LEU 38 N -0.08 -0.80 -0.26 1.46 4.07 0.13 1.54 115.31 121.38 2dzl h LEU 38 Ca 0.00 0.12 0.03 0.00 0.08 0.00 0.00 57.88 58.11 2dzl h LEU 38 Cb 0.09 0.35 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 2dzl h LEU 38 CO -0.05 -0.09 -0.20 -0.07 -1.08 0.00 0.00 178.44 176.95 2dzl h LEU 39 N -0.01 -0.71 -0.45 1.67 3.38 0.23 0.76 115.31 120.17 2dzl h LEU 39 Ca 0.06 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.20 2dzl h LEU 39 Cb 0.16 0.30 -0.09 0.00 0.09 0.00 0.00 40.66 41.12 2dzl h LEU 39 CO -0.34 -0.10 -0.47 -0.61 0.09 0.00 0.00 178.44 177.01 2dzl h GLN 40 N -0.06 -0.31 -0.08 1.13 4.15 0.13 2.08 115.11 122.15 2dzl h GLN 40 Ca 0.04 0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.51 2dzl h GLN 40 Cb 0.17 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.93 2dzl h GLN 40 CO -0.28 -0.21 0.36 0.00 -1.93 0.00 0.00 178.83 176.78 2dzl h ALA 41 N 0.33 1.50 -0.58 3.38 0.00 0.35 1.51 119.26 125.75 2dzl h ALA 41 Ca 0.13 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.76 2dzl h ALA 41 Cb 0.58 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.22 2dzl h ALA 41 CO -0.61 -0.40 0.19 0.00 0.00 0.00 0.00 179.25 178.42 2dzl n ALA 42 N -1.97 4.61 -1.86 0.00 0.00 0.53 -4.89 120.51 116.93 2dzl n ALA 42 Ca -0.00 -2.91 -0.14 0.00 0.00 0.00 0.00 53.44 50.39 2dzl n ALA 42 Cb 0.43 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 2dzl n ALA 42 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2dzl n HIS 43 N -0.97 -0.76 -1.94 0.00 -0.00 0.52 0.20 115.22 112.27 2dzl n HIS 43 Ca 0.41 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 58.01 2dzl n HIS 43 Cb 1.26 -2.86 -0.02 0.00 -0.00 0.00 0.00 29.99 28.36 2dzl n HIS 43 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 2dzl n TRP 44 N -2.65 -0.38 -2.57 4.41 7.02 0.58 -4.90 117.44 118.95 2dzl n TRP 44 Ca -0.16 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 55.89 2dzl n TRP 44 Cb 0.54 -2.51 0.00 0.00 -2.42 0.00 0.00 31.31 26.93 2dzl n TRP 44 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2dzl n GLN 45 N -2.30 3.48 -0.30 -0.99 1.13 0.52 -4.85 117.38 114.08 2dzl n GLN 45 Ca -0.13 -3.62 -0.06 0.00 -1.94 0.00 0.00 57.00 51.24 2dzl n GLN 45 Cb 0.53 -3.00 -0.05 0.00 0.11 0.00 0.00 30.24 27.84 2dzl n GLN 45 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2dzl n PHE 46 N 4.80 -0.23 -0.20 1.08 -0.00 -1.26 0.19 117.46 121.84 2dzl n PHE 46 Ca 0.39 0.91 -0.08 0.00 -0.00 0.00 0.00 57.45 58.67 2dzl n PHE 46 Cb 0.39 -0.62 -0.03 0.00 -0.00 0.00 0.00 39.48 39.22 2dzl n PHE 46 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 2dzl h GLU 47 N 0.00 -0.22 0.50 -4.13 5.08 -1.96 1.32 114.58 115.16 2dzl h GLU 47 Ca 0.15 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2dzl h GLU 47 Cb 0.34 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2dzl h GLU 47 CO -0.70 -0.15 -0.24 1.15 -1.00 0.00 0.00 179.01 178.08 2dzl h THR 48 N -0.23 0.36 -0.76 1.13 2.02 -0.05 0.32 112.91 115.69 2dzl h THR 48 Ca 0.18 -0.44 0.14 0.00 0.77 0.00 0.00 66.41 67.06 2dzl h THR 48 Cb 0.56 0.51 -0.14 0.00 -1.74 0.00 0.00 68.15 67.34 2dzl h THR 48 CO -0.68 0.06 -0.28 0.00 0.37 0.00 0.00 175.52 174.98 2dzl h ALA 49 N -0.70 0.26 0.86 6.16 0.00 0.26 1.49 119.26 127.60 2dzl h ALA 49 Ca -0.07 0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2dzl h ALA 49 Cb 0.60 0.74 0.01 0.00 0.00 0.00 0.00 17.79 19.14 2dzl h ALA 49 CO 0.11 -0.54 -0.41 1.25 0.00 0.00 0.00 179.25 179.66 2dzl h LEU 50 N -0.06 -0.98 -0.88 0.00 5.85 0.17 0.36 115.31 119.78 2dzl h LEU 50 Ca 0.32 0.03 0.24 0.00 0.84 0.00 0.00 57.88 59.32 2dzl h LEU 50 Cb 0.58 0.25 -0.15 0.00 0.37 0.00 0.00 40.66 41.71 2dzl h LEU 50 CO -0.80 -0.63 0.18 -1.28 -0.34 0.00 0.00 178.44 175.57 2dzl h SER 51 N -1.30 -0.12 0.13 1.25 0.87 0.97 0.26 113.55 115.61 2dzl h SER 51 Ca -0.12 0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2dzl h SER 51 Cb 0.89 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2dzl h SER 51 CO 0.19 -0.20 -0.06 0.74 -0.53 0.00 0.00 176.83 176.97 2dzl h THR 52 N 0.15 0.00 -0.88 2.23 2.02 0.22 -0.89 112.91 115.76 2dzl h THR 52 Ca 0.55 -0.06 0.19 0.00 0.77 0.00 0.00 66.41 67.87 2dzl h THR 52 Cb 1.12 0.00 -0.17 0.00 -1.74 0.00 0.00 68.15 67.36 2dzl h THR 52 CO -0.71 0.00 -0.16 0.33 0.37 0.00 0.00 175.52 175.35 2dzl n PHE 53 N -2.62 0.38 -0.08 3.16 7.35 0.13 0.12 117.46 125.91 2dzl n PHE 53 Ca -0.02 1.07 -0.10 0.00 -0.76 0.00 0.00 57.45 57.64 2dzl n PHE 53 Cb 0.07 -1.05 -0.03 0.00 0.35 0.00 0.00 39.48 38.82 2dzl n PHE 53 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2dzl h PHE 54 N 0.00 0.37 0.00 -5.13 0.04 -0.54 -3.38 116.94 108.30 2dzl h PHE 54 Ca 0.45 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.21 2dzl h PHE 54 Cb 0.76 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 38.79 2dzl h PHE 54 CO -0.62 0.33 0.00 1.04 -0.60 0.00 0.00 178.31 178.46 2dzl n GLN 55 N -4.83 0.00 -3.53 1.51 1.13 0.33 -4.34 117.38 107.66 2dzl n GLN 55 Ca -0.02 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.81 2dzl n GLN 55 Cb 0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 30.24 30.35 2dzl n GLN 55 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2dzl n GLU 56 N 0.00 -1.74 -4.34 -1.09 1.02 -0.89 0.60 120.64 114.20 2dzl n GLU 56 Ca 0.00 0.07 -0.37 0.00 -0.02 0.00 0.00 57.16 56.84 2dzl n GLU 56 Cb 0.00 -4.47 -0.08 0.00 -0.02 0.00 0.00 31.44 26.87 2dzl n GLU 56 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2dzl n THR 57 N -3.24 -0.32 0.18 2.62 5.66 -1.26 -4.71 114.28 113.20 2dzl n THR 57 Ca 0.06 -0.16 0.16 0.00 -3.05 0.00 0.00 64.05 61.07 2dzl n THR 57 Cb 0.46 -0.64 0.78 0.00 -1.55 0.00 0.00 70.33 69.38 2dzl n THR 57 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 175.07 170.89 2dzl h ASN 58 N -1.11 0.00 -4.21 1.09 -0.73 -0.04 -3.42 115.58 107.16 2dzl h ASN 58 Ca -0.59 0.00 -0.52 0.00 1.87 0.00 0.00 56.30 57.06 2dzl h ASN 58 Cb 1.32 0.00 0.15 0.00 0.27 0.00 0.00 38.32 40.06 2dzl h ASN 58 CO 0.79 0.00 0.35 0.27 -0.37 0.00 0.00 177.43 178.47 2dzl s ILE 59 N -4.76 2.57 0.15 2.57 -4.36 -1.26 -4.96 121.20 111.15 2dzl s ILE 59 Ca -0.05 0.25 -0.30 0.00 -0.26 0.00 0.00 60.65 60.29 2dzl s ILE 59 Cb 0.16 -2.69 -0.07 0.00 1.25 0.00 0.00 42.46 41.11 2dzl s ILE 59 CO 0.60 -0.18 1.13 -2.16 0.24 0.00 0.00 174.94 174.56 2dzl s PRO 60 N -4.20 4.55 0.46 0.37 0.04 -1.26 -4.80 135.00 130.16 2dzl s PRO 60 Ca 0.70 1.74 0.00 0.00 0.04 0.00 0.00 61.00 63.48 2dzl s PRO 60 Cb -0.25 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.00 2dzl s PRO 60 CO 0.48 -0.01 0.00 -1.71 0.04 0.00 0.00 177.00 175.80 2dzl n ASN 61 N 2.71 -3.80 -2.69 6.66 2.85 -1.26 -5.11 115.26 114.61 2dzl n ASN 61 Ca 0.04 0.87 -0.04 0.00 -0.11 0.00 0.00 54.58 55.34 2dzl n ASN 61 Cb 0.46 3.55 0.01 0.00 1.24 0.00 0.00 39.78 45.04 2dzl n ASN 61 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2dzl n SER 62 N -3.47 -7.54 -4.54 1.20 7.64 -1.26 -4.99 113.62 100.66 2dzl n SER 62 Ca 0.00 0.85 -0.29 0.00 1.01 0.00 0.00 58.87 60.45 2dzl n SER 62 Cb 0.00 -5.05 0.19 0.00 -1.01 0.00 0.00 64.21 58.35 2dzl n SER 62 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2dzl s HIS 63 N -2.07 1.80 -0.14 1.43 3.76 -1.26 -5.03 115.29 113.78 2dzl s HIS 63 Ca 0.13 0.90 -0.13 0.00 -0.15 0.00 0.00 55.06 55.81 2dzl s HIS 63 Cb -0.04 -3.29 -0.04 0.00 1.11 0.00 0.00 32.58 30.32 2dzl s HIS 63 CO 0.72 -3.15 -0.26 0.72 -0.85 0.00 0.00 174.74 171.92 2dzl n HIS 64 N -4.34 0.17 -1.49 1.40 8.25 -1.26 -5.11 115.22 112.85 2dzl n HIS 64 Ca 0.06 0.07 0.12 0.00 -0.26 0.00 0.00 57.72 57.71 2dzl n HIS 64 Cb 0.58 -0.48 -0.06 0.00 1.12 0.00 0.00 29.99 31.15 2dzl n HIS 64 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2dzl n HIS 65 N -4.16 -3.94 -0.54 4.41 -0.00 -1.26 -5.35 115.22 104.39 2dzl n HIS 65 Ca -0.10 2.16 0.00 0.00 0.46 0.00 0.00 57.72 60.24 2dzl n HIS 65 Cb 0.39 -3.49 0.00 0.00 -0.12 0.00 0.00 29.99 26.77 2dzl n HIS 65 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38