#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 2.87 -0.30 1.61 1.04 -1.26 -5.08 113.70 112.58 2dzl s SER 2 Ca 0.00 -0.96 -0.09 0.00 0.48 0.00 0.00 55.95 55.38 2dzl s SER 2 Cb 0.00 -0.20 0.18 0.00 0.10 0.00 0.00 66.02 66.10 2dzl s SER 2 CO 0.00 -0.40 0.92 -0.44 0.98 0.00 0.00 173.24 174.30 2dzl s SER 3 N 2.15 -0.73 -0.30 7.02 0.01 -1.26 -5.16 113.70 115.43 2dzl s SER 3 Ca 0.07 0.38 -0.26 0.00 1.31 0.00 0.00 55.95 57.45 2dzl s SER 3 Cb -0.16 1.58 0.20 0.00 0.21 0.00 0.00 66.02 67.85 2dzl s SER 3 CO -0.26 -0.14 1.45 -0.83 0.41 0.00 0.00 173.24 173.87 2dzl s GLY 4 N 2.93 0.31 -0.29 3.44 0.00 -1.26 -5.13 107.32 107.31 2dzl s GLY 4 Ca 0.08 3.37 -0.03 0.00 0.00 0.00 0.00 44.72 48.14 2dzl s GLY 4 CO -0.16 1.67 0.16 -0.45 0.00 0.00 0.00 173.10 174.32 2dzl s SER 5 N -0.34 3.21 -0.06 1.64 0.15 -1.26 -5.02 113.70 112.03 2dzl s SER 5 Ca 0.08 -1.24 -0.14 0.00 0.70 0.00 0.00 55.95 55.35 2dzl s SER 5 Cb -0.04 -0.21 -0.09 0.00 -1.71 0.00 0.00 66.02 63.97 2dzl s SER 5 CO -0.14 -0.43 0.57 0.77 1.20 0.00 0.00 173.24 175.21 2dzl h SER 6 N 8.33 -0.28 0.00 5.45 4.64 -2.05 -3.51 113.55 126.13 2dzl h SER 6 Ca -0.18 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2dzl h SER 6 Cb 1.02 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2dzl h SER 6 CO 0.42 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 177.20 2dzl n GLY 7 N 0.76 -0.23 3.55 -0.77 0.00 -1.26 -5.06 105.19 102.19 2dzl n GLY 7 Ca -0.06 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 2dzl n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dzl s MET 8 N -0.28 2.44 -0.01 1.61 1.00 -1.26 -4.94 119.30 117.86 2dzl s MET 8 Ca 0.00 0.71 0.07 0.00 0.00 0.00 0.00 55.69 56.47 2dzl s MET 8 Cb 0.00 -4.52 -0.02 0.00 0.00 0.00 0.00 34.83 30.28 2dzl s MET 8 CO 0.00 -3.01 -0.22 -1.12 0.00 0.00 0.00 175.02 170.67 2dzl s SER 9 N 9.24 3.43 -0.42 3.03 0.01 -1.26 -5.05 113.70 122.68 2dzl s SER 9 Ca 0.76 -0.41 0.08 0.00 1.31 0.00 0.00 55.95 57.70 2dzl s SER 9 Cb -0.13 -0.51 0.32 0.00 0.21 0.00 0.00 66.02 65.91 2dzl s SER 9 CO 0.19 0.31 0.91 0.55 0.41 0.00 0.00 173.24 175.61 2dzl n VAL 10 N 2.19 -0.11 -3.48 3.43 3.14 -1.26 -5.07 118.33 117.18 2dzl n VAL 10 Ca -0.16 -2.85 -0.20 0.00 -2.96 0.00 0.00 64.34 58.16 2dzl n VAL 10 Cb 0.52 0.59 -0.12 0.00 -1.06 0.00 0.00 33.84 33.77 2dzl n VAL 10 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2dzl s ASN 11 N -1.74 1.98 -1.12 6.55 0.01 -1.26 -5.07 114.94 114.29 2dzl s ASN 11 Ca 0.31 -0.65 -0.09 0.00 -0.71 0.00 0.00 52.86 51.72 2dzl s ASN 11 Cb 0.30 0.24 0.28 0.00 0.41 0.00 0.00 41.25 42.48 2dzl s ASN 11 CO -0.08 -0.37 1.17 0.23 -1.51 0.00 0.00 177.10 176.54 2dzl n MET 12 N 5.30 3.65 -0.07 -0.60 2.81 -1.26 -4.77 117.12 122.18 2dzl n MET 12 Ca -0.04 -4.45 -0.05 0.00 -1.81 0.00 0.00 57.70 51.35 2dzl n MET 12 Cb 0.47 -2.56 -0.02 0.00 -0.71 0.00 0.00 33.22 30.40 2dzl n MET 12 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2dzl n ASP 13 N 2.60 1.69 -0.14 7.83 8.00 -1.26 -3.74 116.55 131.53 2dzl n ASP 13 Ca 0.25 0.57 -0.03 0.00 0.71 0.00 0.00 54.79 56.28 2dzl n ASP 13 Cb 0.38 -0.83 0.04 0.00 -0.02 0.00 0.00 41.12 40.70 2dzl n ASP 13 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2dzl h GLU 14 N -0.93 0.09 -0.09 -1.24 4.11 -2.00 -2.08 114.58 112.44 2dzl h GLU 14 Ca 0.00 -0.01 0.02 0.00 0.07 0.00 0.00 59.36 59.44 2dzl h GLU 14 Cb 0.54 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 2dzl h GLU 14 CO 0.00 0.06 -0.25 -0.07 0.07 0.00 0.00 179.01 178.82 2dzl h LEU 15 N 0.09 -0.80 -0.98 3.06 4.07 -1.93 -0.14 115.31 118.68 2dzl h LEU 15 Ca 0.23 0.10 0.13 0.00 0.08 0.00 0.00 57.88 58.41 2dzl h LEU 15 Cb 0.34 0.32 -0.14 0.00 1.08 0.00 0.00 40.66 42.25 2dzl h LEU 15 CO -0.39 -0.21 -0.46 -1.14 -1.08 0.00 0.00 178.44 175.15 2dzl n ARG 16 N -3.88 -0.31 -0.02 1.13 0.00 -0.97 0.32 116.66 112.93 2dzl n ARG 16 Ca -0.02 1.50 -0.03 0.00 -0.00 0.00 0.00 57.85 59.29 2dzl n ARG 16 Cb 0.17 -2.21 -0.02 0.00 0.00 0.00 0.00 32.46 30.39 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 -0.38 -0.80 -0.14 2.76 -0.64 0.99 115.15 116.95 2dzl h HIS 17 Ca 0.27 0.02 0.18 0.00 -2.20 0.00 0.00 60.37 58.63 2dzl h HIS 17 Cb 0.51 0.17 -0.14 0.00 1.55 0.00 0.00 27.41 29.50 2dzl h HIS 17 CO -0.92 -0.12 -0.05 0.37 -1.30 0.00 0.00 177.93 175.92 2dzl h GLN 18 N -0.11 0.06 -0.41 5.26 4.15 0.54 0.55 115.11 125.15 2dzl h GLN 18 Ca 0.01 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.47 2dzl h GLN 18 Cb 0.14 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 2dzl h GLN 18 CO -0.12 0.04 0.16 0.28 -1.93 0.00 0.00 178.83 177.26 2dzl h VAL 19 N 0.06 0.90 0.27 2.39 2.07 0.12 -1.42 116.25 120.65 2dzl h VAL 19 Ca 0.43 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.82 2dzl h VAL 19 Cb 0.75 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2dzl h VAL 19 CO -0.74 0.06 -0.22 0.24 0.02 0.00 0.00 177.57 176.93 2dzl h MET 20 N 0.33 -0.46 -0.59 1.57 2.86 0.60 0.51 114.93 119.76 2dzl h MET 20 Ca 0.18 0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.91 2dzl h MET 20 Cb 0.15 0.10 -0.07 0.00 0.06 0.00 0.00 31.60 31.84 2dzl h MET 20 CO -0.17 -0.31 -0.37 0.82 1.06 0.00 0.00 176.91 177.94 2dzl h ILE 21 N -0.48 0.00 -0.82 -1.22 2.04 -0.83 0.74 117.51 116.94 2dzl h ILE 21 Ca -0.03 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.00 2dzl h ILE 21 Cb 0.40 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.33 2dzl h ILE 21 CO -0.00 0.00 -0.13 -1.13 0.00 0.00 0.00 178.15 176.88 2dzl h ASN 22 N -0.03 -0.64 0.33 1.72 -1.24 -1.20 0.55 115.58 115.07 2dzl h ASN 22 Ca 0.09 0.24 -0.01 0.00 0.71 0.00 0.00 56.30 57.33 2dzl h ASN 22 Cb 0.27 0.47 -0.00 0.00 0.73 0.00 0.00 38.32 39.78 2dzl h ASN 22 CO -0.57 -0.26 -0.23 1.56 -1.29 0.00 0.00 177.43 176.65 2dzl h GLN 23 N 0.02 -0.51 -1.02 6.67 4.20 0.25 0.31 115.11 125.03 2dzl h GLN 23 Ca 0.42 0.03 0.30 0.00 0.06 0.00 0.00 58.65 59.46 2dzl h GLN 23 Cb 0.68 0.12 -0.14 0.00 0.30 0.00 0.00 27.48 28.45 2dzl h GLN 23 CO -0.81 -0.34 0.60 0.35 -0.67 0.00 0.00 178.83 177.96 2dzl h PHE 24 N -0.53 0.91 -0.33 2.96 3.04 0.12 1.71 116.94 124.83 2dzl h PHE 24 Ca -0.04 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.83 2dzl h PHE 24 Cb 0.44 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.68 2dzl h PHE 24 CO -0.04 -0.08 -0.24 0.28 -2.02 0.00 0.00 178.31 176.20 2dzl h VAL 25 N 0.40 1.27 0.11 1.41 2.07 0.48 -0.97 116.25 121.02 2dzl h VAL 25 Ca 0.70 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 2dzl h VAL 25 Cb 1.57 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2dzl h VAL 25 CO -0.53 0.43 -0.05 -0.07 0.02 0.00 0.00 177.57 177.37 2dzl h LEU 26 N 0.57 -0.12 -0.87 2.57 3.38 0.54 1.38 115.31 122.76 2dzl h LEU 26 Ca 0.08 -0.38 0.22 0.00 0.09 0.00 0.00 57.88 57.89 2dzl h LEU 26 Cb 0.72 0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.37 2dzl h LEU 26 CO 0.06 0.50 0.30 0.00 0.09 0.00 0.00 178.44 179.39 2dzl h ALA 27 N -0.44 1.32 -2.58 1.53 0.00 0.19 -3.28 119.26 116.00 2dzl h ALA 27 Ca -0.02 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2dzl h ALA 27 Cb 0.50 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2dzl h ALA 27 CO 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 179.25 178.87 2dzl n ALA 28 N -2.60 0.00 0.00 0.00 0.00 -0.37 -5.07 120.51 112.47 2dzl n ALA 28 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2dzl n ALA 28 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 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 2.39 0.75 0.00 0.00 0.00 0.47 -5.04 105.19 103.76 2dzl n GLY 29 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 3.50 0.21 0.00 0.00 -1.26 -4.88 121.76 117.33 2dzl s ALA 31 Ca 0.00 1.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.97 2dzl s ALA 31 Cb 0.00 -3.46 0.29 0.00 0.00 0.00 0.00 23.12 19.95 2dzl s ALA 31 CO 0.00 -0.51 1.69 0.00 0.00 0.00 0.00 175.76 176.93 2dzl h ALA 32 N 4.76 0.66 -0.30 0.00 0.00 -1.95 0.33 119.26 122.75 2dzl h ALA 32 Ca -0.46 0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.66 2dzl h ALA 32 Cb 1.22 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 2dzl h ALA 32 CO 0.73 -0.35 0.01 0.22 0.00 0.00 0.00 179.25 179.86 2dzl h ASP 33 N 0.19 -0.10 -0.98 0.00 1.82 -1.99 -2.55 116.42 112.82 2dzl h ASP 33 Ca 0.32 0.06 0.09 0.00 -0.39 0.00 0.00 57.03 57.11 2dzl h ASP 33 Cb 0.49 0.11 -0.12 0.00 0.68 0.00 0.00 39.33 40.49 2dzl h ASP 33 CO -0.45 -0.02 -0.57 -0.61 -1.61 0.00 0.00 179.24 175.98 2dzl h GLN 34 N 0.10 -0.01 -0.98 0.28 5.75 -1.31 0.17 115.11 119.11 2dzl h GLN 34 Ca 0.14 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.74 2dzl h GLN 34 Cb 0.19 0.00 -0.12 0.00 1.07 0.00 0.00 27.48 28.62 2dzl h GLN 34 CO -0.23 -0.01 -0.56 0.00 -2.65 0.00 0.00 178.83 175.37 2dzl n ALA 35 N -3.26 -0.59 -0.34 3.38 0.00 -0.96 0.64 120.51 119.37 2dzl n ALA 35 Ca 0.02 0.85 -0.10 0.00 0.00 0.00 0.00 53.44 54.21 2dzl n ALA 35 Cb 0.27 -0.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.47 2dzl n ALA 35 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2dzl h LYS 36 N 0.00 -0.04 0.23 0.00 3.64 -0.65 1.55 116.57 121.30 2dzl h LYS 36 Ca 0.17 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 2dzl h LYS 36 Cb 0.42 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2dzl h LYS 36 CO -0.93 -0.03 -0.17 1.96 -2.27 0.00 0.00 179.45 178.02 2dzl h GLN 37 N -0.04 -0.37 -0.70 1.90 4.20 -0.05 0.15 115.11 120.20 2dzl h GLN 37 Ca 0.13 0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.93 2dzl h GLN 37 Cb 0.38 0.08 -0.09 0.00 0.30 0.00 0.00 27.48 28.16 2dzl h GLN 37 CO -0.80 -0.25 -0.43 -0.07 -0.67 0.00 0.00 178.83 176.61 2dzl h LEU 38 N -0.39 -1.58 -0.15 1.46 4.07 0.91 1.41 115.31 121.03 2dzl h LEU 38 Ca -0.03 0.24 0.02 0.00 0.08 0.00 0.00 57.88 58.19 2dzl h LEU 38 Cb 0.32 0.70 -0.03 0.00 1.08 0.00 0.00 40.66 42.73 2dzl h LEU 38 CO 0.01 -0.18 -0.18 -0.07 -1.08 0.00 0.00 178.44 176.94 2dzl h LEU 39 N -0.02 -0.60 -0.45 1.67 3.38 0.23 0.80 115.31 120.31 2dzl h LEU 39 Ca 0.11 0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.23 2dzl h LEU 39 Cb 0.31 0.25 -0.09 0.00 0.09 0.00 0.00 40.66 41.22 2dzl h LEU 39 CO -0.67 -0.12 -0.47 -0.61 0.09 0.00 0.00 178.44 176.66 2dzl h GLN 40 N -0.11 -0.31 -0.05 1.13 4.15 0.69 2.15 115.11 122.76 2dzl h GLN 40 Ca 0.03 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.48 2dzl h GLN 40 Cb 0.18 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.94 2dzl h GLN 40 CO -0.20 -0.21 0.32 0.00 -1.93 0.00 0.00 178.83 176.81 2dzl h ALA 41 N 0.34 1.41 -0.54 3.38 0.00 0.28 1.46 119.26 125.59 2dzl h ALA 41 Ca 0.13 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 2dzl h ALA 41 Cb 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.25 2dzl h ALA 41 CO -0.61 -0.35 0.15 0.00 0.00 0.00 0.00 179.25 178.45 2dzl n ALA 42 N -1.97 4.34 -1.79 0.00 0.00 0.53 -4.89 120.51 116.73 2dzl n ALA 42 Ca -0.01 -2.75 -0.15 0.00 0.00 0.00 0.00 53.44 50.53 2dzl n ALA 42 Cb 0.38 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.79 -0.67 -1.92 0.00 -0.00 0.50 0.19 115.22 112.53 2dzl n HIS 43 Ca 0.37 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.98 2dzl n HIS 43 Cb 1.21 -2.87 -0.02 0.00 -0.00 0.00 0.00 29.99 28.30 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 -2.55 -0.36 -2.55 4.41 7.02 0.60 -4.90 117.44 119.12 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 -2.43 0.00 0.00 -2.42 0.00 0.00 31.31 27.00 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 -2.27 3.44 -0.19 -0.99 1.13 0.51 -4.86 117.38 114.15 2dzl n GLN 45 Ca -0.13 -3.57 -0.05 0.00 -1.94 0.00 0.00 57.00 51.31 2dzl n GLN 45 Cb 0.52 -3.03 -0.05 0.00 0.11 0.00 0.00 30.24 27.79 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 5.01 -0.20 0.00 1.08 -0.00 -1.26 0.20 117.46 122.29 2dzl n PHE 46 Ca 0.40 0.57 0.00 0.00 -0.00 0.00 0.00 57.45 58.42 2dzl n PHE 46 Cb 0.40 -0.48 0.00 0.00 -0.00 0.00 0.00 39.48 39.39 2dzl n PHE 46 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2dzl n GLU 47 N -4.10 0.00 -0.03 -4.13 1.02 -1.26 0.13 120.64 112.27 2dzl n GLU 47 Ca 0.01 0.94 -0.09 0.00 -0.02 0.00 0.00 57.16 58.00 2dzl n GLU 47 Cb 0.12 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.02 2dzl n GLU 47 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2dzl h THR 48 N 0.00 0.39 -0.56 2.62 2.02 -1.47 0.28 112.91 116.19 2dzl h THR 48 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 2dzl h THR 48 Cb 0.00 0.39 -0.10 0.00 -1.74 0.00 0.00 68.15 66.70 2dzl h THR 48 CO 0.00 0.00 -0.50 0.00 0.37 0.00 0.00 175.52 175.39 2dzl h ALA 49 N 0.71 -0.53 -0.10 6.16 0.00 0.32 1.25 119.26 127.07 2dzl h ALA 49 Ca 0.12 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2dzl h ALA 49 Cb 0.47 1.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 2dzl h ALA 49 CO -0.36 -0.93 -0.16 1.25 0.00 0.00 0.00 179.25 179.05 2dzl h LEU 50 N -0.27 -0.49 -0.48 0.00 5.85 0.18 0.96 115.31 121.06 2dzl h LEU 50 Ca 0.14 0.09 0.09 0.00 0.84 0.00 0.00 57.88 59.04 2dzl h LEU 50 Cb 0.56 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.73 2dzl h LEU 50 CO -0.68 -0.21 -0.07 0.28 -0.34 0.00 0.00 178.44 177.42 2dzl h SER 51 N -0.21 -0.35 0.22 1.25 0.02 0.18 0.15 113.55 114.80 2dzl h SER 51 Ca 0.08 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 2dzl h SER 51 Cb 0.34 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2dzl h SER 51 CO -0.22 -0.12 -0.10 0.74 -1.14 0.00 0.00 176.83 175.98 2dzl h THR 52 N 0.04 0.00 -1.14 -2.27 2.02 0.23 0.41 112.91 112.21 2dzl h THR 52 Ca 0.23 -0.09 0.41 0.00 0.77 0.00 0.00 66.41 67.74 2dzl h THR 52 Cb 0.36 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.63 2dzl h THR 52 CO -0.45 0.00 0.70 0.33 0.37 0.00 0.00 175.52 176.46 2dzl n PHE 53 N -3.02 0.77 0.12 3.16 7.35 0.32 0.17 117.46 126.35 2dzl n PHE 53 Ca -0.04 0.78 -0.06 0.00 -0.76 0.00 0.00 57.45 57.37 2dzl n PHE 53 Cb 0.11 -1.20 -0.03 0.00 0.35 0.00 0.00 39.48 38.72 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 -1.00 -0.61 -3.21 116.94 106.61 2dzl h PHE 54 Ca 0.79 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.56 2dzl h PHE 54 Cb 2.39 0.12 0.00 0.00 3.61 0.00 0.00 35.95 42.08 2dzl h PHE 54 CO -0.01 -0.23 0.06 1.96 -1.61 0.00 0.00 178.31 178.48 2dzl h GLN 55 N -1.10 0.00 0.24 1.51 1.08 0.17 -2.85 115.11 114.16 2dzl h GLN 55 Ca -0.04 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 2dzl h GLN 55 Cb 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2dzl h GLN 55 CO 0.07 0.00 -0.12 0.93 -0.95 0.00 0.00 178.83 178.76 2dzl h GLU 56 N 0.00 -0.31 -4.11 1.46 5.08 0.18 -3.27 114.58 113.60 2dzl h GLU 56 Ca 0.00 0.02 -0.72 0.00 -1.00 0.00 0.00 59.36 57.66 2dzl h GLU 56 Cb 0.12 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.37 2dzl h GLU 56 CO 0.00 -0.21 2.75 0.25 -1.00 0.00 0.00 179.01 180.80 2dzl n THR 57 N -2.89 3.72 -3.46 1.13 -2.24 -1.08 -4.84 114.28 104.62 2dzl n THR 57 Ca -0.04 -3.48 -0.14 0.00 -2.27 0.00 0.00 64.05 58.13 2dzl n THR 57 Cb 0.13 -2.52 -0.03 0.00 -2.10 0.00 0.00 70.33 65.80 2dzl n THR 57 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2dzl s ASN 58 N 2.79 -0.57 0.66 3.42 3.84 -1.24 -5.01 114.94 118.83 2dzl s ASN 58 Ca 0.46 0.19 -0.17 0.00 0.21 0.00 0.00 52.86 53.55 2dzl s ASN 58 Cb 0.11 0.57 -0.05 0.00 -0.55 0.00 0.00 41.25 41.34 2dzl s ASN 58 CO -0.05 -0.85 0.69 2.30 -2.79 0.00 0.00 177.10 176.39 2dzl n ILE 59 N 0.02 2.51 -1.53 -5.21 -5.35 -1.26 -4.97 119.36 103.58 2dzl n ILE 59 Ca -0.18 -0.44 -0.29 0.00 -0.27 0.00 0.00 62.75 61.57 2dzl n ILE 59 Cb 0.63 -0.86 0.17 0.00 -1.74 0.00 0.00 39.64 37.83 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 -2.67 0.56 0.02 6.28 0.04 -1.26 -5.07 135.00 132.90 2dzl s PRO 60 Ca 0.70 0.07 -0.02 0.00 0.04 0.00 0.00 61.00 61.79 2dzl s PRO 60 Cb -0.39 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 2dzl s PRO 60 CO 0.53 -2.55 0.02 1.21 0.04 0.00 0.00 177.00 176.25 2dzl s ASN 61 N -4.19 0.19 0.03 6.66 3.84 -1.26 -5.12 114.94 115.10 2dzl s ASN 61 Ca 0.67 -0.44 -0.30 0.00 0.21 0.00 0.00 52.86 53.00 2dzl s ASN 61 Cb -0.11 0.13 -0.07 0.00 -0.55 0.00 0.00 41.25 40.64 2dzl s ASN 61 CO 0.54 -0.33 1.67 -0.94 -2.79 0.00 0.00 177.10 175.24 2dzl s SER 62 N -1.50 6.62 -0.27 -4.21 1.04 -1.26 -4.96 113.70 109.16 2dzl s SER 62 Ca -0.15 2.42 -0.25 0.00 0.48 0.00 0.00 55.95 58.45 2dzl s SER 62 Cb -0.09 -2.55 0.12 0.00 0.10 0.00 0.00 66.02 63.60 2dzl s SER 62 CO -0.01 -0.90 0.99 -2.28 0.98 0.00 0.00 173.24 172.02 2dzl s HIS 63 N 3.15 -0.50 -0.68 5.02 2.46 -1.26 -5.08 115.29 118.39 2dzl s HIS 63 Ca 0.75 1.20 0.05 0.00 0.47 0.00 0.00 55.06 57.52 2dzl s HIS 63 Cb -0.38 0.36 0.26 0.00 -0.13 0.00 0.00 32.58 32.69 2dzl s HIS 63 CO 0.32 -0.26 0.84 0.72 -2.47 0.00 0.00 174.74 173.90 2dzl n HIS 64 N 2.13 3.54 -0.04 3.88 8.25 -1.26 -4.87 115.22 126.85 2dzl n HIS 64 Ca -0.13 -3.98 -0.00 0.00 -0.26 0.00 0.00 57.72 53.36 2dzl n HIS 64 Cb 0.56 -0.63 -0.00 0.00 1.12 0.00 0.00 29.99 31.04 2dzl n HIS 64 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2dzl h HIS 65 N 4.23 0.00 0.00 4.41 2.76 -2.00 -3.58 115.15 120.97 2dzl h HIS 65 Ca 0.20 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2dzl h HIS 65 Cb 0.64 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.60 2dzl h HIS 65 CO 0.76 0.00 0.00 0.72 -1.30 0.00 0.00 177.93 178.11