#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzl n SER 2 N 0.00 -7.41 -4.73 1.61 2.88 -1.26 -4.94 113.62 99.78 2dzl n SER 2 Ca 0.00 0.50 -0.31 0.00 -1.33 0.00 0.00 58.87 57.73 2dzl n SER 2 Cb 0.00 -4.45 0.12 0.00 -0.75 0.00 0.00 64.21 59.13 2dzl n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dzl s SER 3 N -2.18 3.90 -0.41 -3.46 1.04 -1.26 -5.01 113.70 106.33 2dzl s SER 3 Ca 0.24 1.95 0.09 0.00 0.48 0.00 0.00 55.95 58.71 2dzl s SER 3 Cb -0.05 -2.53 0.32 0.00 0.10 0.00 0.00 66.02 63.86 2dzl s SER 3 CO 0.76 -2.44 0.82 0.61 0.98 0.00 0.00 173.24 173.97 2dzl n GLY 4 N -0.68 2.45 2.71 7.32 0.00 -1.26 -5.08 105.19 110.64 2dzl n GLY 4 Ca 0.10 -1.08 -0.23 0.00 0.00 0.00 0.00 46.02 44.82 2dzl n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dzl s SER 5 N -1.91 1.61 -0.13 1.61 1.04 -1.26 -5.13 113.70 109.53 2dzl s SER 5 Ca 0.34 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.61 2dzl s SER 5 Cb 0.30 -0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 2dzl s SER 5 CO -0.09 -0.24 -0.05 -0.55 0.98 0.00 0.00 173.24 173.30 2dzl s SER 6 N 2.05 4.74 0.00 7.02 0.15 -1.26 -4.99 113.70 121.42 2dzl s SER 6 Ca 0.04 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2dzl s SER 6 Cb -0.13 -1.60 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 2dzl s SER 6 CO -0.05 0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2dzl n GLY 7 N 3.11 0.22 3.08 9.45 0.00 -1.26 -5.09 105.19 114.71 2dzl n GLY 7 Ca -0.18 -1.94 -0.01 0.00 0.00 0.00 0.00 46.02 43.89 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 0.00 -1.14 0.00 1.61 2.81 -1.26 -4.86 117.12 114.28 2dzl n MET 8 Ca 0.00 1.31 0.00 0.00 -1.81 0.00 0.00 57.70 57.20 2dzl n MET 8 Cb 0.00 -2.16 0.00 0.00 -0.71 0.00 0.00 33.22 30.35 2dzl n MET 8 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2dzl n SER 9 N 1.08 0.00 -4.43 7.83 7.64 -1.26 -5.14 113.62 119.35 2dzl n SER 9 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 2dzl n SER 9 Cb 0.38 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.45 2dzl n SER 9 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2dzl s VAL 10 N 0.00 2.59 0.58 0.44 -7.23 -1.26 -5.04 120.40 110.47 2dzl s VAL 10 Ca 0.00 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 58.78 2dzl s VAL 10 Cb 0.00 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.84 2dzl s VAL 10 CO 0.00 0.25 0.00 0.59 -0.31 0.00 0.00 175.10 175.63 2dzl n ASN 11 N 1.33 -8.16 0.11 4.85 3.02 -1.26 -4.94 115.26 110.21 2dzl n ASN 11 Ca -0.16 1.31 0.00 0.00 -0.03 0.00 0.00 54.58 55.69 2dzl n ASN 11 Cb 0.52 -4.91 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 2dzl n ASN 11 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 2dzl n MET 12 N -4.35 0.00 -0.29 3.52 1.56 -1.26 -4.81 117.12 111.49 2dzl n MET 12 Ca -0.08 0.00 -0.06 0.00 -0.27 0.00 0.00 57.70 57.29 2dzl n MET 12 Cb 0.69 0.00 -0.02 0.00 2.15 0.00 0.00 33.22 36.04 2dzl n MET 12 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 2dzl h ASP 13 N 0.00 -1.57 0.01 6.12 3.32 -1.99 0.71 116.42 123.02 2dzl h ASP 13 Ca 0.00 0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.35 2dzl h ASP 13 Cb 0.00 0.74 -0.06 0.00 0.22 0.00 0.00 39.33 40.24 2dzl h ASP 13 CO 0.00 -0.30 -0.52 -0.08 -1.72 0.00 0.00 179.24 176.62 2dzl h GLU 14 N -0.12 -0.64 -0.32 3.56 4.81 -1.97 -1.00 114.58 118.91 2dzl h GLU 14 Ca 0.23 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2dzl h GLU 14 Cb 0.55 0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.03 2dzl h GLU 14 CO -0.82 -0.43 -0.25 1.25 -0.73 0.00 0.00 179.01 178.03 2dzl h LEU 15 N -0.67 -0.89 -0.98 1.64 5.85 -1.32 0.11 115.31 119.06 2dzl h LEU 15 Ca 0.02 0.13 0.12 0.00 0.84 0.00 0.00 57.88 58.98 2dzl h LEU 15 Cb 0.72 0.38 -0.14 0.00 0.37 0.00 0.00 40.66 41.99 2dzl h LEU 15 CO -0.35 -0.14 -0.48 -1.14 -0.34 0.00 0.00 178.44 176.00 2dzl n ARG 16 N -3.94 -0.33 -0.02 1.25 0.00 0.04 0.12 116.66 113.78 2dzl n ARG 16 Ca -0.00 1.49 -0.09 0.00 -0.00 0.00 0.00 57.85 59.25 2dzl n ARG 16 Cb 0.13 -2.20 -0.06 0.00 0.00 0.00 0.00 32.46 30.33 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 -1.01 -0.35 -0.14 2.76 0.34 0.75 115.15 117.49 2dzl h HIS 17 Ca 0.25 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.54 2dzl h HIS 17 Cb 0.49 0.46 -0.08 0.00 1.55 0.00 0.00 27.41 29.82 2dzl h HIS 17 CO -0.93 -0.33 -0.23 1.96 -1.30 0.00 0.00 177.93 177.10 2dzl h GLN 18 N -0.33 -0.17 -0.52 5.26 4.20 0.13 -0.09 115.11 123.58 2dzl h GLN 18 Ca 0.02 0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.85 2dzl h GLN 18 Cb 0.41 0.04 -0.10 0.00 0.30 0.00 0.00 27.48 28.13 2dzl h GLN 18 CO -0.29 -0.11 -0.10 0.28 -0.67 0.00 0.00 178.83 177.93 2dzl h VAL 19 N -0.18 0.50 0.31 -0.54 2.07 0.18 -0.64 116.25 117.95 2dzl h VAL 19 Ca 0.18 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.69 2dzl h VAL 19 Cb 0.45 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2dzl h VAL 19 CO -0.46 0.00 -0.51 0.24 0.02 0.00 0.00 177.57 176.86 2dzl h MET 20 N 0.02 -0.84 -0.57 1.57 2.86 0.22 0.35 114.93 118.54 2dzl h MET 20 Ca 0.25 0.06 0.07 0.00 -2.06 0.00 0.00 59.70 58.02 2dzl h MET 20 Cb 0.39 0.19 -0.10 0.00 0.06 0.00 0.00 31.60 32.14 2dzl h MET 20 CO -0.51 -0.56 -0.50 0.82 1.06 0.00 0.00 176.91 177.21 2dzl h ILE 21 N -0.87 0.04 -0.50 -1.22 2.04 -0.38 0.82 117.51 117.44 2dzl h ILE 21 Ca -0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.93 2dzl h ILE 21 Cb 0.81 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 36.85 2dzl h ILE 21 CO -0.17 0.00 -0.00 -1.13 0.00 0.00 0.00 178.15 176.84 2dzl h ASN 22 N -0.26 -0.22 0.08 1.72 -0.73 -0.79 0.21 115.58 115.59 2dzl h ASN 22 Ca 0.14 0.12 -0.00 0.00 1.87 0.00 0.00 56.30 58.43 2dzl h ASN 22 Cb 0.56 0.22 -0.00 0.00 0.27 0.00 0.00 38.32 39.36 2dzl h ASN 22 CO -0.69 -0.08 -0.06 1.56 -0.37 0.00 0.00 177.43 177.79 2dzl h GLN 23 N 0.11 -0.13 -0.96 6.67 4.20 0.33 0.28 115.11 125.61 2dzl h GLN 23 Ca 0.25 0.01 0.30 0.00 0.06 0.00 0.00 58.65 59.28 2dzl h GLN 23 Cb 0.39 0.03 -0.16 0.00 0.30 0.00 0.00 27.48 28.03 2dzl h GLN 23 CO -0.42 -0.09 0.30 0.35 -0.67 0.00 0.00 178.83 178.30 2dzl h PHE 24 N -0.14 0.45 -0.76 2.96 3.04 0.71 1.83 116.94 125.03 2dzl h PHE 24 Ca -0.01 0.05 -0.05 0.00 3.98 0.00 0.00 57.97 61.94 2dzl h PHE 24 Cb 0.12 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 38.55 2dzl h PHE 24 CO -0.01 -0.33 0.29 0.28 -2.02 0.00 0.00 178.31 176.52 2dzl h VAL 25 N 0.12 1.26 0.05 1.41 2.07 -0.26 -1.46 116.25 119.45 2dzl h VAL 25 Ca 0.66 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 2dzl h VAL 25 Cb 1.50 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2dzl h VAL 25 CO -0.75 0.33 -0.03 -0.07 0.02 0.00 0.00 177.57 177.08 2dzl h LEU 26 N 1.10 -0.06 -0.73 2.57 3.38 0.57 0.95 115.31 123.09 2dzl h LEU 26 Ca 0.25 -0.53 0.11 0.00 0.09 0.00 0.00 57.88 57.80 2dzl h LEU 26 Cb 0.24 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 40.88 2dzl h LEU 26 CO -0.02 0.53 -0.39 0.00 0.09 0.00 0.00 178.44 178.65 2dzl h ALA 27 N 0.18 -0.09 -2.51 1.53 0.00 0.22 -3.31 119.26 115.29 2dzl h ALA 27 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2dzl h ALA 27 Cb 0.59 0.93 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2dzl h ALA 27 CO 0.01 -0.72 0.00 0.00 0.00 0.00 0.00 179.25 178.54 2dzl n ALA 28 N -3.25 0.00 0.00 0.00 0.00 -0.56 -5.06 120.51 111.64 2dzl n ALA 28 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2dzl n ALA 28 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 0.47 1.68 0.00 0.00 0.33 -5.05 105.19 105.00 2dzl n GLY 29 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.33 3.64 0.10 0.00 0.00 -1.26 -4.86 121.76 117.06 2dzl s ALA 31 Ca 0.17 1.32 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 2dzl s ALA 31 Cb -0.01 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 19.44 2dzl s ALA 31 CO 0.11 -0.73 1.48 0.00 0.00 0.00 0.00 175.76 176.61 2dzl h ALA 32 N 5.37 -0.80 -0.82 0.00 0.00 -1.95 0.49 119.26 121.55 2dzl h ALA 32 Ca -0.45 -0.04 0.19 0.00 0.00 0.00 0.00 54.91 54.61 2dzl h ALA 32 Cb 1.22 0.99 -0.15 0.00 0.00 0.00 0.00 17.79 19.85 2dzl h ALA 32 CO 0.80 -0.99 -0.07 0.22 0.00 0.00 0.00 179.25 179.21 2dzl h ASP 33 N -0.46 -0.53 -0.96 0.00 1.82 -1.97 0.78 116.42 115.11 2dzl h ASP 33 Ca 0.04 0.23 0.10 0.00 -0.39 0.00 0.00 57.03 57.01 2dzl h ASP 33 Cb 0.57 0.43 -0.13 0.00 0.68 0.00 0.00 39.33 40.89 2dzl h ASP 33 CO -0.42 -0.25 -0.51 1.67 -1.61 0.00 0.00 179.24 178.12 2dzl n GLN 34 N -5.44 -0.36 -0.33 0.28 7.27 0.14 -0.33 117.38 118.60 2dzl n GLN 34 Ca 0.15 1.45 -0.09 0.00 0.07 0.00 0.00 57.00 58.58 2dzl n GLN 34 Cb 0.50 -2.14 -0.08 0.00 2.41 0.00 0.00 30.24 30.93 2dzl n GLN 34 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2dzl h ALA 35 N 0.72 -0.46 -0.99 1.69 0.00 -0.57 0.58 119.26 120.23 2dzl h ALA 35 Ca 0.20 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.31 2dzl h ALA 35 Cb 0.44 1.30 -0.13 0.00 0.00 0.00 0.00 17.79 19.41 2dzl h ALA 35 CO -0.91 -0.80 -0.56 -0.22 0.00 0.00 0.00 179.25 176.76 2dzl h LYS 36 N -0.01 -0.00 0.06 0.00 3.64 -0.67 1.18 116.57 120.76 2dzl h LYS 36 Ca 0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2dzl h LYS 36 Cb 0.34 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2dzl h LYS 36 CO -0.75 -0.00 -0.06 1.96 -2.27 0.00 0.00 179.45 178.32 2dzl h GLN 37 N -0.00 -0.12 -0.48 1.90 4.20 0.01 0.12 115.11 120.73 2dzl h GLN 37 Ca 0.19 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.95 2dzl h GLN 37 Cb 0.44 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.19 2dzl h GLN 37 CO -0.94 -0.08 -0.29 -0.07 -0.67 0.00 0.00 178.83 176.78 2dzl h LEU 38 N -0.12 -1.07 -0.25 1.46 4.07 0.78 1.07 115.31 121.25 2dzl h LEU 38 Ca -0.01 0.16 0.02 0.00 0.08 0.00 0.00 57.88 58.14 2dzl h LEU 38 Cb 0.11 0.47 -0.03 0.00 1.08 0.00 0.00 40.66 42.28 2dzl h LEU 38 CO -0.00 -0.12 -0.17 -0.07 -1.08 0.00 0.00 178.44 177.00 2dzl h LEU 39 N -0.01 -0.60 -0.45 1.67 3.38 0.14 1.00 115.31 120.44 2dzl h LEU 39 Ca 0.08 0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.20 2dzl h LEU 39 Cb 0.21 0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.13 2dzl h LEU 39 CO -0.46 -0.08 -0.48 -0.61 0.09 0.00 0.00 178.44 176.91 2dzl h GLN 40 N -0.02 -0.32 -0.05 1.13 4.15 0.59 2.18 115.11 122.78 2dzl h GLN 40 Ca 0.04 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.50 2dzl h GLN 40 Cb 0.13 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 2dzl h GLN 40 CO -0.25 -0.21 0.32 0.00 -1.93 0.00 0.00 178.83 176.76 2dzl h ALA 41 N 0.29 1.41 -0.55 3.38 0.00 0.28 1.43 119.26 125.50 2dzl h ALA 41 Ca 0.12 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 2dzl h ALA 41 Cb 0.58 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.23 2dzl h ALA 41 CO -0.61 -0.35 0.16 0.00 0.00 0.00 0.00 179.25 178.45 2dzl n ALA 42 N -1.95 4.48 -1.81 0.00 0.00 0.53 -4.89 120.51 116.86 2dzl n ALA 42 Ca -0.01 -2.85 -0.14 0.00 0.00 0.00 0.00 53.44 50.44 2dzl n ALA 42 Cb 0.39 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.82 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 -0.90 -0.73 -2.04 0.00 -0.00 0.49 0.20 115.22 112.24 2dzl n HIS 43 Ca 0.39 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 58.00 2dzl n HIS 43 Cb 1.22 -2.80 -0.01 0.00 -0.00 0.00 0.00 29.99 28.40 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 -0.43 -2.54 4.41 7.02 0.61 -4.90 117.44 119.06 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 26.88 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 -2.22 3.53 -0.26 -0.99 1.13 0.53 -4.86 117.38 114.23 2dzl n GLN 45 Ca -0.13 -3.62 -0.07 0.00 -1.94 0.00 0.00 57.00 51.24 2dzl n GLN 45 Cb 0.56 -2.97 -0.06 0.00 0.11 0.00 0.00 30.24 27.87 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 4.54 -0.28 -0.16 1.08 -0.00 -1.26 0.17 117.46 121.55 2dzl n PHE 46 Ca 0.39 0.78 -0.05 0.00 -0.00 0.00 0.00 57.45 58.57 2dzl n PHE 46 Cb 0.39 -0.53 -0.05 0.00 -0.00 0.00 0.00 39.48 39.29 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 -0.05 0.53 -4.13 5.08 -1.97 1.47 114.58 115.52 2dzl h GLU 47 Ca 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2dzl h GLU 47 Cb 0.26 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2dzl h GLU 47 CO -0.59 -0.03 -0.33 1.15 -1.00 0.00 0.00 179.01 178.21 2dzl h THR 48 N -0.05 0.33 -0.73 1.13 2.02 -1.11 0.49 112.91 114.99 2dzl h THR 48 Ca 0.06 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.34 2dzl h THR 48 Cb 0.21 0.33 -0.12 0.00 -1.74 0.00 0.00 68.15 66.83 2dzl h THR 48 CO -0.38 0.00 -0.45 0.00 0.37 0.00 0.00 175.52 175.06 2dzl h ALA 49 N -0.40 -0.25 0.43 6.16 0.00 0.25 1.00 119.26 126.44 2dzl h ALA 49 Ca -0.06 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2dzl h ALA 49 Cb 0.66 1.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 2dzl h ALA 49 CO 0.06 -0.80 -0.26 1.25 0.00 0.00 0.00 179.25 179.50 2dzl h LEU 50 N -0.14 -0.65 -0.87 0.00 5.85 0.22 0.41 115.31 120.13 2dzl h LEU 50 Ca 0.21 0.04 0.23 0.00 0.84 0.00 0.00 57.88 59.20 2dzl h LEU 50 Cb 0.55 0.19 -0.14 0.00 0.37 0.00 0.00 40.66 41.63 2dzl h LEU 50 CO -0.79 -0.41 0.25 -1.28 -0.34 0.00 0.00 178.44 175.86 2dzl h SER 51 N -0.66 0.03 0.09 1.25 0.87 0.21 0.36 113.55 115.70 2dzl h SER 51 Ca -0.05 0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2dzl h SER 51 Cb 0.54 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 2dzl h SER 51 CO 0.05 -0.14 -0.04 0.74 -0.53 0.00 0.00 176.83 176.91 2dzl h THR 52 N 0.22 0.00 -0.90 2.23 2.02 0.15 -2.07 112.91 114.56 2dzl h THR 52 Ca 0.55 -0.08 0.36 0.00 0.77 0.00 0.00 66.41 68.00 2dzl h THR 52 Cb 1.09 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 67.34 2dzl h THR 52 CO -0.64 0.00 0.42 0.33 0.37 0.00 0.00 175.52 176.00 2dzl n PHE 53 N -2.56 0.99 -0.08 3.16 -0.00 0.14 0.19 117.46 119.29 2dzl n PHE 53 Ca -0.02 1.07 -0.11 0.00 -0.00 0.00 0.00 57.45 58.39 2dzl n PHE 53 Cb 0.05 -1.43 -0.04 0.00 -0.00 0.00 0.00 39.48 38.06 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 0.48 -0.30 -5.13 -1.00 -0.33 -3.22 116.94 107.44 2dzl h PHE 54 Ca 0.74 -0.08 -0.67 0.00 2.81 0.00 0.00 57.97 60.77 2dzl h PHE 54 Cb 1.90 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 41.32 2dzl h PHE 54 CO -0.08 0.60 3.30 1.04 -1.61 0.00 0.00 178.31 181.57 2dzl n GLN 55 N -4.63 3.84 -3.35 1.51 6.02 0.50 -4.74 117.38 116.52 2dzl n GLN 55 Ca -0.04 -2.46 -0.37 0.00 -0.01 0.00 0.00 57.00 54.12 2dzl n GLN 55 Cb 0.24 -2.72 -0.04 0.00 1.02 0.00 0.00 30.24 28.75 2dzl n GLN 55 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2dzl n GLU 56 N 3.04 3.31 -3.62 -1.09 1.02 -1.21 -4.90 120.64 117.19 2dzl n GLU 56 Ca 0.73 -4.55 -0.27 0.00 -0.02 0.00 0.00 57.16 53.05 2dzl n GLU 56 Cb 0.27 -2.43 -0.11 0.00 -0.02 0.00 0.00 31.44 29.15 2dzl n GLU 56 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2dzl n THR 57 N 1.70 0.37 -2.55 2.62 -2.24 -1.26 -4.98 114.28 107.95 2dzl n THR 57 Ca 0.25 -4.25 -0.05 0.00 -2.27 0.00 0.00 64.05 57.73 2dzl n THR 57 Cb 0.37 -1.95 -0.04 0.00 -2.10 0.00 0.00 70.33 66.61 2dzl n THR 57 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2dzl n ASN 58 N 2.22 -0.87 -4.91 3.42 3.02 -1.26 -5.00 115.26 111.87 2dzl n ASN 58 Ca 0.25 1.29 -0.28 0.00 -0.03 0.00 0.00 54.58 55.81 2dzl n ASN 58 Cb 0.42 -5.08 -0.03 0.00 -0.61 0.00 0.00 39.78 34.48 2dzl n ASN 58 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2dzl s ILE 59 N -0.71 5.00 -0.02 2.41 -4.36 -1.26 -5.04 121.20 117.22 2dzl s ILE 59 Ca -0.26 0.07 -0.30 0.00 -0.26 0.00 0.00 60.65 59.90 2dzl s ILE 59 Cb 0.02 -3.76 -0.04 0.00 1.25 0.00 0.00 42.46 39.93 2dzl s ILE 59 CO 0.76 -0.41 1.21 -2.16 0.24 0.00 0.00 174.94 174.58 2dzl s PRO 60 N -3.75 4.37 0.41 0.37 0.04 -1.26 -4.99 135.00 130.19 2dzl s PRO 60 Ca 0.45 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.93 2dzl s PRO 60 Cb -0.10 -3.51 -0.09 0.00 0.04 0.00 0.00 34.50 30.84 2dzl s PRO 60 CO 0.32 -0.40 1.36 -0.80 0.04 0.00 0.00 177.00 177.52 2dzl s ASN 61 N 1.39 6.23 0.11 6.66 0.01 -1.26 -5.02 114.94 123.06 2dzl s ASN 61 Ca 0.57 2.77 -0.05 0.00 -0.71 0.00 0.00 52.86 55.45 2dzl s ASN 61 Cb -0.26 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 38.73 2dzl s ASN 61 CO 0.24 -0.92 0.12 -0.55 -1.51 0.00 0.00 177.10 174.48 2dzl s SER 62 N -0.59 0.25 0.09 -1.22 0.15 -1.26 -5.18 113.70 105.94 2dzl s SER 62 Ca 0.57 -0.95 0.01 0.00 0.70 0.00 0.00 55.95 56.28 2dzl s SER 62 Cb -0.41 0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 64.18 2dzl s SER 62 CO 0.53 -0.73 -0.06 -1.38 1.20 0.00 0.00 173.24 172.79 2dzl s HIS 63 N -3.95 0.83 0.05 3.44 -3.43 -1.26 -5.17 115.29 105.79 2dzl s HIS 63 Ca 0.14 -0.94 0.02 0.00 -0.80 0.00 0.00 55.06 53.47 2dzl s HIS 63 Cb 0.06 -0.49 -0.03 0.00 -1.43 0.00 0.00 32.58 30.69 2dzl s HIS 63 CO -0.04 -0.19 -0.07 -1.01 -2.00 0.00 0.00 174.74 171.43 2dzl s HIS 64 N -3.67 0.64 0.14 0.38 3.76 -1.26 -5.07 115.29 110.21 2dzl s HIS 64 Ca 0.11 -0.59 0.00 0.00 -0.15 0.00 0.00 55.06 54.43 2dzl s HIS 64 Cb 0.06 -0.39 0.00 0.00 1.11 0.00 0.00 32.58 33.36 2dzl s HIS 64 CO -0.06 -0.12 0.00 1.58 -0.85 0.00 0.00 174.74 175.29 2dzl n HIS 65 N 1.20 -0.90 0.24 1.40 -0.00 -1.26 -5.39 115.22 110.50 2dzl n HIS 65 Ca -0.21 0.16 0.03 0.00 0.46 0.00 0.00 57.72 58.16 2dzl n HIS 65 Cb 0.56 0.27 0.02 0.00 -0.12 0.00 0.00 29.99 30.72 2dzl n HIS 65 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38