#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 0.05 -0.19 1.61 0.01 -1.26 -5.15 113.70 108.77 2dzl s SER 2 Ca 0.00 -0.80 -0.04 0.00 1.31 0.00 0.00 55.95 56.42 2dzl s SER 2 Cb 0.00 0.42 0.09 0.00 0.21 0.00 0.00 66.02 66.74 2dzl s SER 2 CO 0.00 -0.86 0.29 -0.55 0.41 0.00 0.00 173.24 172.53 2dzl s SER 3 N -2.94 0.63 0.08 2.44 0.15 -1.26 -5.15 113.70 107.65 2dzl s SER 3 Ca 0.14 0.25 0.03 0.00 0.70 0.00 0.00 55.95 57.06 2dzl s SER 3 Cb 0.04 0.74 -0.03 0.00 -1.71 0.00 0.00 66.02 65.06 2dzl s SER 3 CO -0.03 -0.28 -0.08 -0.83 1.20 0.00 0.00 173.24 173.21 2dzl s GLY 4 N 2.43 0.69 -0.00 9.45 0.00 -1.26 -5.16 107.32 113.47 2dzl s GLY 4 Ca 0.06 -1.07 -0.28 0.00 0.00 0.00 0.00 44.72 43.43 2dzl s GLY 4 CO -0.12 -1.15 0.79 -0.45 0.00 0.00 0.00 173.10 172.18 2dzl s SER 5 N -2.29 -0.48 -0.20 1.64 0.15 -1.26 -5.15 113.70 106.12 2dzl s SER 5 Ca 0.01 0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.90 2dzl s SER 5 Cb -0.03 0.45 0.04 0.00 -1.71 0.00 0.00 66.02 64.78 2dzl s SER 5 CO -0.01 -0.65 -0.10 -0.55 1.20 0.00 0.00 173.24 173.12 2dzl s SER 6 N -2.03 3.49 0.00 5.45 0.15 -1.26 -5.06 113.70 114.45 2dzl s SER 6 Ca -0.01 -0.94 0.00 0.00 0.70 0.00 0.00 55.95 55.71 2dzl s SER 6 Cb -0.01 -1.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 2dzl s SER 6 CO -0.04 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2dzl n GLY 7 N 4.67 2.72 2.38 9.45 0.00 -1.26 -5.13 105.19 118.02 2dzl n GLY 7 Ca -0.14 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 43.79 2dzl n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dzl n MET 8 N -1.18 -4.60 -1.83 1.61 0.00 -1.26 -4.79 117.12 105.07 2dzl n MET 8 Ca 0.00 3.43 -0.43 0.00 0.00 0.00 0.00 57.70 60.70 2dzl n MET 8 Cb 0.00 -4.62 -0.03 0.00 0.00 0.00 0.00 33.22 28.57 2dzl n MET 8 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2dzl s SER 9 N -0.59 5.86 0.16 7.83 0.01 -1.26 -4.68 113.70 121.03 2dzl s SER 9 Ca -0.13 1.74 0.00 0.00 1.31 0.00 0.00 55.95 58.87 2dzl s SER 9 Cb 0.01 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2dzl s SER 9 CO 0.36 -1.66 0.00 0.52 0.41 0.00 0.00 173.24 172.87 2dzl n VAL 10 N 7.19 0.20 -1.53 3.43 0.31 -1.26 -5.09 118.33 121.57 2dzl n VAL 10 Ca 0.25 0.07 -0.36 0.00 -0.01 0.00 0.00 64.34 64.28 2dzl n VAL 10 Cb 0.45 -0.58 0.08 0.00 -0.91 0.00 0.00 33.84 32.88 2dzl n VAL 10 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2dzl n ASN 11 N -3.13 1.29 -2.56 4.52 2.85 -1.26 -4.81 115.26 112.16 2dzl n ASN 11 Ca 0.00 0.75 -0.20 0.00 -0.11 0.00 0.00 54.58 55.01 2dzl n ASN 11 Cb 0.00 -1.48 -0.10 0.00 1.24 0.00 0.00 39.78 39.44 2dzl n ASN 11 CO 0.00 0.00 0.00 1.15 -2.11 0.00 0.00 177.26 176.30 2dzl n MET 12 N -1.93 2.39 0.23 1.20 0.00 -1.26 -4.51 117.12 113.25 2dzl n MET 12 Ca 0.15 -1.35 -0.15 0.00 0.00 0.00 0.00 57.70 56.35 2dzl n MET 12 Cb 0.49 -2.26 -0.08 0.00 0.00 0.00 0.00 33.22 31.37 2dzl n MET 12 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 175.97 176.19 2dzl h ASP 13 N 4.17 -0.48 0.38 3.17 1.82 -2.00 -0.58 116.42 122.90 2dzl h ASP 13 Ca 0.42 -0.07 -0.02 0.00 -0.39 0.00 0.00 57.03 56.97 2dzl h ASP 13 Cb 0.89 0.12 0.00 0.00 0.68 0.00 0.00 39.33 41.03 2dzl h ASP 13 CO 0.85 -0.22 -0.18 -0.08 -1.61 0.00 0.00 179.24 178.01 2dzl h GLU 14 N -0.74 -0.49 -0.43 0.28 4.22 -1.99 -2.84 114.58 112.58 2dzl h GLU 14 Ca -0.06 0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.46 2dzl h GLU 14 Cb 0.52 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2dzl h GLU 14 CO 0.10 -0.20 -0.38 1.25 -2.18 0.00 0.00 179.01 177.59 2dzl h LEU 15 N -0.74 -1.33 -0.96 1.64 5.85 -1.90 0.06 115.31 117.92 2dzl h LEU 15 Ca -0.05 0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.97 2dzl h LEU 15 Cb 0.51 0.57 -0.13 0.00 0.37 0.00 0.00 40.66 41.97 2dzl h LEU 15 CO 0.08 -0.22 -0.49 -1.14 -0.34 0.00 0.00 178.44 176.33 2dzl n ARG 16 N -4.50 -0.35 -0.02 1.25 0.00 -0.23 0.42 116.66 113.24 2dzl n ARG 16 Ca -0.01 1.47 -0.03 0.00 -0.00 0.00 0.00 57.85 59.27 2dzl n ARG 16 Cb 0.21 -2.16 -0.02 0.00 0.00 0.00 0.00 32.46 30.48 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 -0.41 -0.79 -0.14 2.76 -0.79 0.85 115.15 116.62 2dzl h HIS 17 Ca 0.23 0.02 0.17 0.00 -2.20 0.00 0.00 60.37 58.59 2dzl h HIS 17 Cb 0.47 0.19 -0.15 0.00 1.55 0.00 0.00 27.41 29.47 2dzl h HIS 17 CO -0.93 -0.12 -0.11 0.37 -1.30 0.00 0.00 177.93 175.83 2dzl h GLN 18 N -0.11 0.03 -0.30 5.26 4.15 0.32 0.47 115.11 124.92 2dzl h GLN 18 Ca 0.01 -0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.48 2dzl h GLN 18 Cb 0.15 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.79 2dzl h GLN 18 CO -0.13 0.02 0.01 0.28 -1.93 0.00 0.00 178.83 177.09 2dzl h VAL 19 N 0.03 0.80 0.17 2.39 2.07 0.13 -1.14 116.25 120.71 2dzl h VAL 19 Ca 0.41 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.89 2dzl h VAL 19 Cb 0.68 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2dzl h VAL 19 CO -0.77 0.02 -0.20 0.24 0.02 0.00 0.00 177.57 176.88 2dzl h MET 20 N 0.11 -0.37 -0.40 1.57 2.86 0.52 0.39 114.93 119.61 2dzl h MET 20 Ca 0.14 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.85 2dzl h MET 20 Cb 0.18 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.88 2dzl h MET 20 CO -0.23 -0.24 -0.26 0.82 1.06 0.00 0.00 176.91 178.06 2dzl h ILE 21 N -0.38 0.00 -0.93 -1.22 2.04 -0.84 0.79 117.51 116.96 2dzl h ILE 21 Ca -0.02 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.07 2dzl h ILE 21 Cb 0.34 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.24 2dzl h ILE 21 CO -0.04 0.00 -0.03 0.78 0.00 0.00 0.00 178.15 178.86 2dzl h ASN 22 N -0.03 -0.53 0.34 1.72 2.35 -1.14 0.51 115.58 118.80 2dzl h ASN 22 Ca 0.07 0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 56.06 2dzl h ASN 22 Cb 0.19 0.48 0.00 0.00 0.05 0.00 0.00 38.32 39.05 2dzl h ASN 22 CO -0.39 -0.31 -0.16 1.56 -1.65 0.00 0.00 177.43 176.47 2dzl h GLN 23 N 0.03 -0.44 -0.94 0.81 7.50 0.25 0.46 115.11 122.78 2dzl h GLN 23 Ca 0.53 0.03 0.28 0.00 0.50 0.00 0.00 58.65 59.99 2dzl h GLN 23 Cb 1.02 0.10 -0.16 0.00 0.05 0.00 0.00 27.48 28.49 2dzl h GLN 23 CO -0.88 -0.29 0.25 0.35 -1.50 0.00 0.00 178.83 176.76 2dzl h PHE 24 N -0.46 0.36 -0.77 2.96 3.04 0.16 1.84 116.94 124.08 2dzl h PHE 24 Ca -0.05 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 61.92 2dzl h PHE 24 Cb 0.35 -0.01 -0.04 0.00 2.56 0.00 0.00 35.95 38.82 2dzl h PHE 24 CO 0.15 -0.31 0.34 0.28 -2.02 0.00 0.00 178.31 176.75 2dzl h VAL 25 N 0.13 1.25 -0.04 1.41 2.07 0.12 -0.88 116.25 120.31 2dzl h VAL 25 Ca 0.63 -0.74 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 2dzl h VAL 25 Cb 1.36 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2dzl h VAL 25 CO -0.74 0.31 -0.22 -0.07 0.02 0.00 0.00 177.57 176.87 2dzl h LEU 26 N 1.10 0.26 -0.45 2.57 3.38 0.43 0.72 115.31 123.32 2dzl h LEU 26 Ca 0.26 -0.67 0.09 0.00 0.09 0.00 0.00 57.88 57.65 2dzl h LEU 26 Cb 0.16 -0.08 -0.10 0.00 0.09 0.00 0.00 40.66 40.73 2dzl h LEU 26 CO -0.03 0.88 -0.30 0.00 0.09 0.00 0.00 178.44 179.09 2dzl h ALA 27 N 0.38 -0.07 -2.87 1.53 0.00 0.24 -3.34 119.26 115.13 2dzl h ALA 27 Ca -0.02 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2dzl h ALA 27 Cb 0.88 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2dzl h ALA 27 CO 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 179.25 178.63 2dzl n ALA 28 N -3.02 0.00 0.00 0.00 0.00 -0.36 -5.07 120.51 112.07 2dzl n ALA 28 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2dzl n ALA 28 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 2dzl n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dzl n GLY 29 N 2.47 0.49 3.02 0.00 0.00 0.25 -5.05 105.19 106.37 2dzl n GLY 29 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2dzl n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dzl s ALA 31 N -2.61 3.90 0.55 0.00 0.00 -1.26 -4.82 121.76 117.52 2dzl s ALA 31 Ca 0.30 1.59 0.32 0.00 0.00 0.00 0.00 51.96 54.17 2dzl s ALA 31 Cb -0.02 -3.69 1.48 0.00 0.00 0.00 0.00 23.12 20.89 2dzl s ALA 31 CO 0.19 -0.94 1.87 0.00 0.00 0.00 0.00 175.76 176.88 2dzl h ALA 32 N 6.41 2.81 -0.14 0.00 0.00 -1.96 0.44 119.26 126.83 2dzl h ALA 32 Ca -0.44 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 2dzl h ALA 32 Cb 1.20 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2dzl h ALA 32 CO 0.93 -1.12 -0.05 -0.44 0.00 0.00 0.00 179.25 178.57 2dzl h ASP 33 N 0.00 0.28 -0.65 0.00 3.32 -1.99 -3.14 116.42 114.23 2dzl h ASP 33 Ca 0.42 -0.40 0.13 0.00 0.02 0.00 0.00 57.03 57.20 2dzl h ASP 33 Cb 1.74 -0.08 -0.12 0.00 0.22 0.00 0.00 39.33 41.09 2dzl h ASP 33 CO -0.00 0.61 -0.24 1.56 -1.72 0.00 0.00 179.24 179.45 2dzl h GLN 34 N -0.05 -0.06 -0.43 3.56 4.20 -0.46 -1.43 115.11 120.43 2dzl h GLN 34 Ca 0.03 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.79 2dzl h GLN 34 Cb 0.50 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 2dzl h GLN 34 CO 0.02 -0.04 -0.27 0.00 -0.67 0.00 0.00 178.83 177.87 2dzl h ALA 35 N 1.42 -0.27 -0.10 3.87 0.00 -1.46 0.92 119.26 123.65 2dzl h ALA 35 Ca 0.29 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.26 2dzl h ALA 35 Cb 0.53 1.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 2dzl h ALA 35 CO -0.70 -0.45 -0.06 -0.22 0.00 0.00 0.00 179.25 177.81 2dzl h LYS 36 N -0.01 -0.00 -0.04 0.00 3.64 -1.33 1.48 116.57 120.30 2dzl h LYS 36 Ca 0.07 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2dzl h LYS 36 Cb 0.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2dzl h LYS 36 CO -0.41 -0.00 -0.06 1.96 -2.27 0.00 0.00 179.45 178.66 2dzl h GLN 37 N -0.00 -0.05 -0.73 1.90 4.20 -0.93 1.33 115.11 120.83 2dzl h GLN 37 Ca 0.02 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.80 2dzl h GLN 37 Cb 0.04 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.75 2dzl h GLN 37 CO -0.10 -0.03 -0.44 -0.07 -0.67 0.00 0.00 178.83 177.52 2dzl h LEU 38 N -0.05 -1.61 -0.02 1.46 4.07 0.14 1.56 115.31 120.86 2dzl h LEU 38 Ca 0.01 0.24 0.01 0.00 0.08 0.00 0.00 57.88 58.22 2dzl h LEU 38 Cb 0.07 0.71 -0.02 0.00 1.08 0.00 0.00 40.66 42.50 2dzl h LEU 38 CO -0.06 -0.18 -0.19 -0.07 -1.08 0.00 0.00 178.44 176.86 2dzl h LEU 39 N -0.01 -0.59 -0.57 1.67 3.38 0.26 0.72 115.31 120.17 2dzl h LEU 39 Ca 0.12 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.21 2dzl h LEU 39 Cb 0.31 0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.20 2dzl h LEU 39 CO -0.69 -0.18 -0.50 -0.61 0.09 0.00 0.00 178.44 176.55 2dzl h GLN 40 N -0.22 -0.20 -0.35 1.13 4.15 0.30 2.24 115.11 122.16 2dzl h GLN 40 Ca 0.01 0.01 0.10 0.00 0.77 0.00 0.00 58.65 59.54 2dzl h GLN 40 Cb 0.25 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 2dzl h GLN 40 CO -0.14 -0.13 0.44 0.00 -1.93 0.00 0.00 178.83 177.07 2dzl h ALA 41 N 0.00 2.01 -0.87 3.38 0.00 0.25 1.50 119.26 125.53 2dzl h ALA 41 Ca 0.09 -0.01 -0.38 0.00 0.00 0.00 0.00 54.91 54.62 2dzl h ALA 41 Cb 0.45 0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.04 2dzl h ALA 41 CO -0.64 -0.62 0.47 0.00 0.00 0.00 0.00 179.25 178.46 2dzl n ALA 42 N -2.27 5.12 -1.78 0.00 0.00 0.60 -4.86 120.51 117.32 2dzl n ALA 42 Ca 0.06 -2.67 -0.14 0.00 0.00 0.00 0.00 53.44 50.69 2dzl n ALA 42 Cb 0.59 -1.34 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.72 -0.68 -2.00 0.00 -0.00 0.51 0.20 115.22 112.54 2dzl n HIS 43 Ca 0.51 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 58.11 2dzl n HIS 43 Cb 1.53 -2.81 -0.02 0.00 -0.00 0.00 0.00 29.99 28.69 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 -2.51 -0.41 -2.53 4.41 7.02 0.62 -4.90 117.44 119.13 2dzl n TRP 44 Ca -0.15 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 55.90 2dzl n TRP 44 Cb 0.53 -2.53 0.00 0.00 -2.42 0.00 0.00 31.31 26.89 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 -2.26 3.41 -0.31 -0.99 1.13 0.52 -4.85 117.38 114.04 2dzl n GLN 45 Ca -0.13 -3.53 -0.07 0.00 -1.94 0.00 0.00 57.00 51.32 2dzl n GLN 45 Cb 0.55 -3.06 -0.06 0.00 0.11 0.00 0.00 30.24 27.78 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 5.19 -0.27 -0.17 1.08 -0.00 -1.26 0.19 117.46 122.22 2dzl n PHE 46 Ca 0.41 0.92 -0.12 0.00 -0.00 0.00 0.00 57.45 58.66 2dzl n PHE 46 Cb 0.40 -0.60 -0.09 0.00 -0.00 0.00 0.00 39.48 39.19 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 -0.29 0.59 -4.13 5.08 -1.97 1.37 114.58 115.24 2dzl h GLU 47 Ca 0.14 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2dzl h GLU 47 Cb 0.33 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.65 2dzl h GLU 47 CO -0.70 -0.19 -0.28 1.15 -1.00 0.00 0.00 179.01 177.98 2dzl h THR 48 N -0.30 0.40 -0.61 1.13 2.02 -0.73 0.66 112.91 115.48 2dzl h THR 48 Ca 0.08 -0.10 0.09 0.00 0.77 0.00 0.00 66.41 67.25 2dzl h THR 48 Cb 0.51 0.44 -0.11 0.00 -1.74 0.00 0.00 68.15 67.25 2dzl h THR 48 CO -0.59 0.01 -0.43 0.00 0.37 0.00 0.00 175.52 174.88 2dzl h ALA 49 N -0.48 -0.30 0.42 6.16 0.00 0.26 1.45 119.26 126.76 2dzl h ALA 49 Ca -0.08 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2dzl h ALA 49 Cb 0.63 0.97 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2dzl h ALA 49 CO 0.13 -0.82 -0.20 1.25 0.00 0.00 0.00 179.25 179.62 2dzl h LEU 50 N -0.21 -0.47 -0.85 0.00 5.85 0.19 0.45 115.31 120.27 2dzl h LEU 50 Ca 0.19 0.02 0.20 0.00 0.84 0.00 0.00 57.88 59.13 2dzl h LEU 50 Cb 0.56 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.59 2dzl h LEU 50 CO -0.71 -0.34 0.31 -1.28 -0.34 0.00 0.00 178.44 176.08 2dzl h SER 51 N -0.56 0.20 0.13 1.25 0.87 0.20 0.22 113.55 115.86 2dzl h SER 51 Ca -0.06 0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2dzl h SER 51 Cb 0.43 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2dzl h SER 51 CO 0.09 -0.02 -0.06 0.74 -0.53 0.00 0.00 176.83 177.05 2dzl h THR 52 N 0.35 0.00 -0.87 2.23 2.02 0.24 0.01 112.91 116.88 2dzl h THR 52 Ca 0.51 -0.11 0.18 0.00 0.77 0.00 0.00 66.41 67.77 2dzl h THR 52 Cb 0.95 0.00 -0.17 0.00 -1.74 0.00 0.00 68.15 67.19 2dzl h THR 52 CO -0.53 0.00 -0.18 0.33 0.37 0.00 0.00 175.52 175.50 2dzl n PHE 53 N -2.79 0.35 -0.05 3.16 -0.00 0.15 0.18 117.46 118.47 2dzl n PHE 53 Ca -0.02 1.06 -0.12 0.00 -0.00 0.00 0.00 57.45 58.38 2dzl n PHE 53 Cb 0.07 -1.03 -0.06 0.00 -0.00 0.00 0.00 39.48 38.46 2dzl n PHE 53 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 2dzl h PHE 54 N 0.00 0.27 0.00 -5.13 -1.00 -0.64 -2.42 116.94 108.02 2dzl h PHE 54 Ca 0.44 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 61.16 2dzl h PHE 54 Cb 0.70 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.19 2dzl h PHE 54 CO -0.64 0.45 -0.04 0.37 -1.61 0.00 0.00 178.31 176.84 2dzl h GLN 55 N 0.02 0.00 0.32 1.51 4.15 0.25 -3.09 115.11 118.27 2dzl h GLN 55 Ca 0.04 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 2dzl h GLN 55 Cb 0.33 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.03 2dzl h GLN 55 CO 0.01 0.04 -0.15 0.93 -1.93 0.00 0.00 178.83 177.72 2dzl h GLU 56 N 0.00 -0.41 -4.18 1.69 4.39 0.24 -3.50 114.58 112.81 2dzl h GLU 56 Ca -0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2dzl h GLU 56 Cb 0.26 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 2dzl h GLU 56 CO 0.01 -0.27 -0.96 -2.37 -1.16 0.00 0.00 179.01 174.26 2dzl n THR 57 N -3.75 -8.16 -2.54 1.13 5.66 -1.03 -4.97 114.28 100.62 2dzl n THR 57 Ca -0.05 2.90 -0.27 0.00 -3.05 0.00 0.00 64.05 63.57 2dzl n THR 57 Cb 0.17 -4.10 0.02 0.00 -1.55 0.00 0.00 70.33 64.86 2dzl n THR 57 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2dzl s ASN 58 N -1.55 5.92 0.75 1.09 0.01 -1.26 -5.03 114.94 114.86 2dzl s ASN 58 Ca 0.00 0.79 -0.15 0.00 -0.71 0.00 0.00 52.86 52.78 2dzl s ASN 58 Cb 0.00 -1.95 0.00 0.00 0.41 0.00 0.00 41.25 39.71 2dzl s ASN 58 CO 0.00 -0.82 0.78 2.30 -1.51 0.00 0.00 177.10 177.85 2dzl n ILE 59 N -2.40 2.07 -2.47 0.60 -5.35 -1.26 -4.90 119.36 105.65 2dzl n ILE 59 Ca 0.03 -0.35 -0.42 0.00 -0.27 0.00 0.00 62.75 61.74 2dzl n ILE 59 Cb 0.56 -0.93 -0.03 0.00 -1.74 0.00 0.00 39.64 37.50 2dzl n ILE 59 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2dzl s PRO 60 N -3.23 4.48 -0.04 6.28 0.04 -1.26 -5.04 135.00 136.23 2dzl s PRO 60 Ca 0.69 1.73 0.06 0.00 0.04 0.00 0.00 61.00 63.52 2dzl s PRO 60 Cb -0.33 -3.34 -0.01 0.00 0.04 0.00 0.00 34.50 30.86 2dzl s PRO 60 CO 0.55 -0.17 -0.23 -0.80 0.04 0.00 0.00 177.00 176.39 2dzl s ASN 61 N 0.80 2.82 -0.42 6.66 0.01 -1.26 -5.06 114.94 118.49 2dzl s ASN 61 Ca 0.56 -0.46 -0.42 0.00 -0.71 0.00 0.00 52.86 51.83 2dzl s ASN 61 Cb -0.29 -0.61 -0.17 0.00 0.41 0.00 0.00 41.25 40.60 2dzl s ASN 61 CO 0.30 0.25 1.94 -1.20 -1.51 0.00 0.00 177.10 176.88 2dzl n SER 62 N 2.81 1.51 -3.34 -1.22 7.64 -1.26 -4.88 113.62 114.88 2dzl n SER 62 Ca -0.17 0.84 -0.12 0.00 1.01 0.00 0.00 58.87 60.42 2dzl n SER 62 Cb 0.52 -1.02 -0.07 0.00 -1.01 0.00 0.00 64.21 62.63 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 5.01 -0.74 -0.16 1.43 3.76 -1.26 -5.13 115.29 118.20 2dzl s HIS 63 Ca 1.10 -0.07 -0.29 0.00 -0.15 0.00 0.00 55.06 55.65 2dzl s HIS 63 Cb -1.27 -0.27 0.09 0.00 1.11 0.00 0.00 32.58 32.23 2dzl s HIS 63 CO 0.66 -0.98 0.81 -1.58 -0.85 0.00 0.00 174.74 172.81 2dzl s HIS 64 N 2.22 -0.60 -0.39 1.40 2.46 -1.26 -5.04 115.29 114.08 2dzl s HIS 64 Ca 0.11 1.20 -0.13 0.00 0.47 0.00 0.00 55.06 56.72 2dzl s HIS 64 Cb -0.13 0.38 0.02 0.00 -0.13 0.00 0.00 32.58 32.72 2dzl s HIS 64 CO -0.24 -0.44 0.47 0.72 -2.47 0.00 0.00 174.74 172.78 2dzl n HIS 65 N 1.46 -3.38 0.00 3.88 8.25 -1.26 -5.32 115.22 118.85 2dzl n HIS 65 Ca -0.15 1.39 0.00 0.00 -0.26 0.00 0.00 57.72 58.70 2dzl n HIS 65 Cb 0.57 -3.94 0.00 0.00 1.12 0.00 0.00 29.99 27.73 2dzl n HIS 65 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70