#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzj n SER 2 N 0.00 1.59 -4.09 1.61 3.41 -1.26 -4.93 113.62 109.95 2dzj n SER 2 Ca 0.00 0.26 -0.33 0.00 -0.26 0.00 0.00 58.87 58.54 2dzj n SER 2 Cb 0.00 -0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 63.19 2dzj n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dzj s SER 3 N -6.32 4.82 0.00 4.04 1.04 -1.26 -5.04 113.70 110.97 2dzj s SER 3 Ca -0.24 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 54.47 2dzj s SER 3 Cb 0.06 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.51 2dzj s SER 3 CO 0.33 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.83 2dzj n GLY 4 N 4.46 0.73 4.23 7.32 0.00 -1.26 -4.90 105.19 115.76 2dzj n GLY 4 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2dzj n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dzj n SER 5 N 0.00 -2.69 -4.88 1.61 7.64 -1.26 -4.92 113.62 109.13 2dzj n SER 5 Ca 0.00 -1.04 -0.30 0.00 1.01 0.00 0.00 58.87 58.54 2dzj n SER 5 Cb 0.00 -2.64 -0.01 0.00 -1.01 0.00 0.00 64.21 60.56 2dzj n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dzj s SER 6 N -3.45 6.37 0.38 6.43 0.01 -1.26 -4.87 113.70 117.31 2dzj s SER 6 Ca 0.65 1.25 0.00 0.00 1.31 0.00 0.00 55.95 59.16 2dzj s SER 6 Cb -0.36 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2dzj s SER 6 CO 0.94 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2dzj n GLY 7 N -2.11 -0.94 3.28 3.44 0.00 -1.26 -4.82 105.19 102.78 2dzj n GLY 7 Ca 0.04 -1.17 -0.56 0.00 0.00 0.00 0.00 46.02 44.33 2dzj n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2dzj n MET 8 N -0.26 0.00 -3.83 1.61 0.00 -1.26 -4.91 117.12 108.47 2dzj n MET 8 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.70 57.36 2dzj n MET 8 Cb 0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 33.22 31.70 2dzj n MET 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 2dzj s LYS 9 N 0.23 2.04 1.25 2.12 -2.85 -1.26 -5.09 119.74 116.18 2dzj s LYS 9 Ca 0.86 -2.13 -0.19 0.00 -1.00 0.00 0.00 55.97 53.52 2dzj s LYS 9 Cb -1.20 -3.51 0.28 0.00 -2.06 0.00 0.00 37.83 31.34 2dzj s LYS 9 CO 0.55 -1.08 0.62 0.72 0.10 0.00 0.00 175.35 176.27 2dzj n HIS 10 N 4.04 -2.83 -3.44 1.78 8.25 -1.26 -4.97 115.22 116.79 2dzj n HIS 10 Ca 0.03 -0.38 -0.38 0.00 -0.26 0.00 0.00 57.72 56.72 2dzj n HIS 10 Cb 0.39 -1.41 -0.06 0.00 1.12 0.00 0.00 29.99 30.03 2dzj n HIS 10 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2dzj s TYR 11 N -2.14 3.73 -0.39 4.41 1.51 -0.91 -4.92 117.35 118.64 2dzj s TYR 11 Ca 0.55 1.05 -0.13 0.00 -1.01 0.00 0.00 57.07 57.53 2dzj s TYR 11 Cb -0.11 -2.35 0.02 0.00 -0.11 0.00 0.00 41.96 39.41 2dzj s TYR 11 CO 0.49 0.60 0.25 -1.21 -1.11 0.00 0.00 175.55 174.57 2dzj s GLU 12 N -0.95 2.89 -0.18 -0.62 2.02 -0.81 -3.18 118.70 117.86 2dzj s GLU 12 Ca 0.25 -1.06 -0.00 0.00 0.02 0.00 0.00 54.97 54.18 2dzj s GLU 12 Cb -0.17 -3.85 0.01 0.00 0.10 0.00 0.00 34.13 30.22 2dzj s GLU 12 CO 0.14 -0.73 -0.16 0.08 0.02 0.00 0.00 175.26 174.61 2dzj s VAL 13 N 1.61 2.42 -0.46 2.63 1.01 -0.55 -1.77 120.40 125.29 2dzj s VAL 13 Ca 0.03 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.12 2dzj s VAL 13 Cb -0.19 -2.03 0.12 0.00 0.00 0.00 0.00 36.38 34.27 2dzj s VAL 13 CO 0.08 0.51 0.31 -1.83 0.00 0.00 0.00 175.10 174.17 2dzj s GLU 14 N 1.25 2.34 -0.57 2.72 1.03 -1.08 -1.29 118.70 123.10 2dzj s GLU 14 Ca 0.03 -1.81 -0.28 0.00 0.03 0.00 0.00 54.97 52.95 2dzj s GLU 14 Cb -0.14 -3.82 0.01 0.00 -0.80 0.00 0.00 34.13 29.38 2dzj s GLU 14 CO -0.09 -1.16 1.50 0.42 -1.33 0.00 0.00 175.26 174.61 2dzj s ILE 15 N 1.25 3.68 0.45 1.83 1.01 -0.39 -3.44 121.20 125.59 2dzj s ILE 15 Ca 0.07 0.55 0.08 0.00 0.00 0.00 0.00 60.65 61.35 2dzj s ILE 15 Cb -0.25 -4.35 0.01 0.00 0.01 0.00 0.00 42.46 37.89 2dzj s ILE 15 CO -0.02 -1.14 0.52 -0.76 0.00 0.00 0.00 174.94 173.54 2dzj s LEU 16 N 6.61 3.40 0.35 2.97 1.43 0.26 -1.68 118.68 132.03 2dzj s LEU 16 Ca 0.55 -0.67 -0.07 0.00 -1.03 0.00 0.00 54.13 52.91 2dzj s LEU 16 Cb -0.12 -2.16 -0.05 0.00 0.03 0.00 0.00 46.19 43.89 2dzj s LEU 16 CO 0.24 -0.84 0.65 -0.62 0.23 0.00 0.00 176.35 176.01 2dzj s ASP 17 N -4.31 6.46 0.00 2.29 2.15 -1.22 0.17 116.67 122.20 2dzj s ASP 17 Ca 0.52 0.88 0.23 0.00 0.43 0.00 0.00 52.55 54.61 2dzj s ASP 17 Cb -0.06 -2.22 0.82 0.00 -0.30 0.00 0.00 42.92 41.16 2dzj s ASP 17 CO 0.31 -0.31 1.60 0.00 -0.17 0.00 0.00 175.17 176.60 2dzj n ALA 18 N -1.20 2.53 0.04 3.66 0.00 -0.89 -2.76 120.51 121.89 2dzj n ALA 18 Ca -0.00 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2dzj n ALA 18 Cb 0.54 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2dzj n ALA 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2dzj n LYS 19 N 0.31 0.00 0.00 0.00 4.81 -1.26 -4.83 118.16 117.19 2dzj n LYS 19 Ca 0.17 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.74 2dzj n LYS 19 Cb 0.34 -0.19 0.34 0.00 0.02 0.00 0.00 35.03 35.55 2dzj n LYS 19 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2dzj n THR 20 N -3.01 0.00 -4.15 3.15 -2.24 -1.26 -4.95 114.28 101.83 2dzj n THR 20 Ca 0.00 -0.02 -0.31 0.00 -2.27 0.00 0.00 64.05 61.45 2dzj n THR 20 Cb 0.00 0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.31 2dzj n THR 20 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dzj n ARG 21 N -1.39 -2.64 -3.90 -0.78 1.74 -1.11 -4.88 116.66 103.69 2dzj n ARG 21 Ca 0.07 0.32 -0.36 0.00 -0.77 0.00 0.00 57.85 57.11 2dzj n ARG 21 Cb 0.33 -4.53 -0.07 0.00 -1.02 0.00 0.00 32.46 27.17 2dzj n ARG 21 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2dzj s GLU 22 N -6.88 3.68 -0.34 5.56 -1.05 -1.26 -4.58 118.70 113.83 2dzj s GLU 22 Ca 0.28 -0.21 -0.33 0.00 -0.15 0.00 0.00 54.97 54.57 2dzj s GLU 22 Cb -0.16 -3.22 -0.10 0.00 -0.44 0.00 0.00 34.13 30.22 2dzj s GLU 22 CO 0.93 0.57 2.23 1.17 0.95 0.00 0.00 175.26 181.11 2dzj n LYS 23 N 2.64 1.27 -0.04 -4.83 3.00 -1.26 -3.42 118.16 115.54 2dzj n LYS 23 Ca -0.18 0.32 -0.19 0.00 -0.00 0.00 0.00 58.31 58.26 2dzj n LYS 23 Cb 0.54 -2.71 -0.13 0.00 0.00 0.00 0.00 35.03 32.72 2dzj n LYS 23 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2dzj n LEU 24 N 10.81 2.55 -3.61 3.14 4.77 -0.67 -5.00 117.00 128.99 2dzj n LEU 24 Ca 0.39 0.12 -0.15 0.00 -0.03 0.00 0.00 56.01 56.34 2dzj n LEU 24 Cb 0.30 -0.94 -0.07 0.00 -2.33 0.00 0.00 43.42 40.38 2dzj n LEU 24 CO 0.74 0.84 0.43 0.00 -1.33 0.00 0.00 177.39 178.06 2dzj s PHE 26 N 0.15 2.85 -0.55 0.00 5.36 -1.26 -1.26 117.98 123.26 2dzj s PHE 26 Ca -0.02 -2.20 -0.13 0.00 -0.96 0.00 0.00 56.93 53.62 2dzj s PHE 26 Cb -0.04 -2.02 0.14 0.00 -0.34 0.00 0.00 43.02 40.76 2dzj s PHE 26 CO 0.02 -0.85 0.48 -0.51 -1.46 0.00 0.00 175.22 172.90 2dzj s LEU 27 N 1.23 6.07 0.00 6.12 1.43 -0.41 -4.88 118.68 128.24 2dzj s LEU 27 Ca -0.00 -1.95 0.16 0.00 -1.03 0.00 0.00 54.13 51.32 2dzj s LEU 27 Cb -0.19 -2.14 0.47 0.00 0.03 0.00 0.00 46.19 44.36 2dzj s LEU 27 CO -0.09 -0.77 1.39 -0.90 0.23 0.00 0.00 176.35 176.21 2dzj n ASP 28 N 4.97 2.55 -2.48 2.29 5.75 -1.26 -1.49 116.55 126.89 2dzj n ASP 28 Ca -0.09 -1.96 -0.19 0.00 -0.01 0.00 0.00 54.79 52.54 2dzj n ASP 28 Cb 0.41 -0.29 0.02 0.00 -1.03 0.00 0.00 41.12 40.22 2dzj n ASP 28 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2dzj n LYS 29 N 0.89 2.69 -3.94 0.11 5.02 -1.23 -4.13 118.16 117.57 2dzj n LYS 29 Ca 0.17 -4.01 -0.35 0.00 -2.02 0.00 0.00 58.31 52.10 2dzj n LYS 29 Cb 0.42 -1.93 -0.06 0.00 -0.02 0.00 0.00 35.03 33.44 2dzj n LYS 29 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2dzj s VAL 30 N -4.54 5.33 0.32 -0.18 1.01 -1.19 -4.90 120.40 116.24 2dzj s VAL 30 Ca 0.41 -0.04 -0.23 0.00 0.00 0.00 0.00 61.98 62.12 2dzj s VAL 30 Cb 0.41 -3.40 -0.10 0.00 0.00 0.00 0.00 36.38 33.29 2dzj s VAL 30 CO -0.07 0.46 0.88 -1.61 0.00 0.00 0.00 175.10 174.77 2dzj s GLU 31 N -1.49 4.42 0.27 2.72 0.41 -1.26 -2.13 118.70 121.65 2dzj s GLU 31 Ca 0.21 1.16 0.06 0.00 -0.41 0.00 0.00 54.97 55.98 2dzj s GLU 31 Cb -0.12 -2.71 0.39 0.00 -1.78 0.00 0.00 34.13 29.91 2dzj s GLU 31 CO 0.11 0.25 1.66 -1.00 -0.49 0.00 0.00 175.26 175.79 2dzj h PRO 32 N 3.00 0.26 -0.00 0.39 0.13 -1.98 -2.71 132.00 131.08 2dzj h PRO 32 Ca -0.47 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2dzj h PRO 32 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dzj h PRO 32 CO 0.64 0.67 -0.11 -2.39 -0.23 0.00 0.00 178.00 176.58 2dzj n HIS 33 N -3.98 0.00 -1.98 1.56 1.44 -1.26 -1.82 115.22 109.17 2dzj n HIS 33 Ca -0.02 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.27 2dzj n HIS 33 Cb 0.52 -0.33 -0.03 0.00 0.12 0.00 0.00 29.99 30.27 2dzj n HIS 33 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2dzj s ALA 34 N -2.77 3.72 0.44 1.59 0.00 -1.02 -4.84 121.76 118.88 2dzj s ALA 34 Ca 0.20 1.28 -0.10 0.00 0.00 0.00 0.00 51.96 53.34 2dzj s ALA 34 Cb 0.19 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 2dzj s ALA 34 CO 0.53 -0.83 0.81 0.95 0.00 0.00 0.00 175.76 177.22 2dzj s THR 35 N 1.53 4.78 0.34 0.00 -4.23 -1.26 -2.98 115.64 113.82 2dzj s THR 35 Ca 0.70 0.63 0.15 0.00 -1.18 0.00 0.00 61.69 61.98 2dzj s THR 35 Cb -0.41 -3.76 0.34 0.00 1.34 0.00 0.00 72.50 70.00 2dzj s THR 35 CO 0.31 -0.63 1.64 0.40 -0.54 0.00 0.00 174.62 175.80 2dzj h ILE 36 N 0.84 0.22 -0.39 2.99 1.08 -1.48 0.27 117.51 121.03 2dzj h ILE 36 Ca -0.47 -0.08 0.08 0.00 -0.39 0.00 0.00 64.86 64.00 2dzj h ILE 36 Cb 1.19 -0.03 -0.08 0.00 -3.07 0.00 0.00 36.82 34.84 2dzj h ILE 36 CO 0.63 0.04 -0.10 0.00 -0.69 0.00 0.00 178.15 178.03 2dzj h ALA 37 N 1.89 0.25 -0.93 1.87 0.00 -1.87 -0.88 119.26 119.59 2dzj h ALA 37 Ca 0.74 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.83 2dzj h ALA 37 Cb 1.75 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.80 2dzj h ALA 37 CO -0.66 -0.46 0.61 0.93 0.00 0.00 0.00 179.25 179.67 2dzj h GLU 38 N -0.01 1.17 -0.30 0.00 4.39 -0.84 -2.58 114.58 116.41 2dzj h GLU 38 Ca 0.19 -0.07 0.06 0.00 0.34 0.00 0.00 59.36 59.88 2dzj h GLU 38 Cb 0.29 -0.26 -0.05 0.00 -0.10 0.00 0.00 28.75 28.63 2dzj h GLU 38 CO -0.41 0.77 -0.04 0.82 -1.16 0.00 0.00 179.01 178.99 2dzj h ILE 39 N 1.20 0.73 -0.73 3.13 1.08 -0.88 -1.72 117.51 120.33 2dzj h ILE 39 Ca 0.36 -0.01 0.09 0.00 -0.39 0.00 0.00 64.86 64.91 2dzj h ILE 39 Cb -0.05 0.69 -0.07 0.00 -3.07 0.00 0.00 36.82 34.32 2dzj h ILE 39 CO -0.10 0.01 0.38 0.11 -0.69 0.00 0.00 178.15 177.86 2dzj h LYS 40 N 0.04 0.63 0.35 2.37 1.57 -1.05 -2.51 116.57 117.97 2dzj h LYS 40 Ca 0.15 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2dzj h LYS 40 Cb 0.21 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2dzj h LYS 40 CO -0.28 0.41 -0.27 -0.91 -0.57 0.00 0.00 179.45 177.84 2dzj h ASN 41 N 0.65 -0.69 -0.56 0.86 2.35 -1.19 -2.39 115.58 114.60 2dzj h ASN 41 Ca 0.36 0.05 0.06 0.00 -0.55 0.00 0.00 56.30 56.22 2dzj h ASN 41 Cb 0.36 0.22 -0.09 0.00 0.05 0.00 0.00 38.32 38.86 2dzj h ASN 41 CO -0.26 -0.40 -0.55 -0.07 -1.65 0.00 0.00 177.43 174.50 2dzj h LEU 42 N -0.61 -1.89 -1.50 1.61 3.38 -0.94 0.43 115.31 115.80 2dzj h LEU 42 Ca -0.03 0.26 0.23 0.00 0.09 0.00 0.00 57.88 58.44 2dzj h LEU 42 Cb 0.53 0.80 -0.07 0.00 0.09 0.00 0.00 40.66 42.00 2dzj h LEU 42 CO -0.01 -0.36 0.64 0.15 0.09 0.00 0.00 178.44 178.95 2dzj h PHE 43 N -0.29 0.54 -0.73 1.13 3.04 -1.39 0.13 116.94 119.37 2dzj h PHE 43 Ca 0.11 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.03 2dzj h PHE 43 Cb 0.55 -0.16 -0.03 0.00 2.56 0.00 0.00 35.95 38.87 2dzj h PHE 43 CO -0.79 0.10 0.28 1.15 -2.02 0.00 0.00 178.31 177.04 2dzj h THR 44 N 0.37 1.25 -0.00 4.41 2.02 0.36 -3.13 112.91 118.19 2dzj h THR 44 Ca 0.52 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2dzj h THR 44 Cb 1.36 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2dzj h THR 44 CO -0.21 0.32 -0.00 0.29 0.37 0.00 0.00 175.52 176.30 2dzj n LYS 45 N -4.33 -0.00 -0.13 6.66 5.02 0.46 -0.22 118.16 125.62 2dzj n LYS 45 Ca 0.06 0.72 -0.05 0.00 -2.02 0.00 0.00 58.31 57.02 2dzj n LYS 45 Cb 0.19 -1.08 0.04 0.00 -0.02 0.00 0.00 35.03 34.15 2dzj n LYS 45 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dzj h THR 46 N 0.00 0.86 -3.50 -0.18 1.03 -1.69 -3.34 112.91 106.08 2dzj h THR 46 Ca 0.00 -0.11 -0.69 0.00 -0.01 0.00 0.00 66.41 65.60 2dzj h THR 46 Cb 0.00 0.52 -0.35 0.00 -1.07 0.00 0.00 68.15 67.26 2dzj h THR 46 CO -0.00 0.06 -0.47 -1.00 -0.01 0.00 0.00 175.52 174.09 2dzj s HIS 47 N -6.15 3.50 0.20 0.00 3.76 0.69 -4.94 115.29 112.35 2dzj s HIS 47 Ca -0.13 -2.56 -0.04 0.00 -0.15 0.00 0.00 55.06 52.18 2dzj s HIS 47 Cb 0.13 -3.21 0.13 0.00 1.11 0.00 0.00 32.58 30.74 2dzj s HIS 47 CO 0.72 -0.91 1.55 -1.00 -0.85 0.00 0.00 174.74 174.24 2dzj h PRO 48 N 7.59 0.68 -0.55 8.40 0.13 -1.39 -3.05 132.00 143.82 2dzj h PRO 48 Ca -0.08 -0.36 0.09 0.00 -0.87 0.00 0.00 66.00 64.78 2dzj h PRO 48 Cb 1.00 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 2dzj h PRO 48 CO 0.71 0.97 0.37 1.96 -0.23 0.00 0.00 178.00 181.77 2dzj h GLN 49 N 0.55 0.35 -5.94 0.86 4.20 -1.92 -3.33 115.11 109.88 2dzj h GLN 49 Ca 0.04 -0.02 -0.62 0.00 0.06 0.00 0.00 58.65 58.11 2dzj h GLN 49 Cb 0.95 -0.08 -0.11 0.00 0.30 0.00 0.00 27.48 28.54 2dzj h GLN 49 CO 0.09 0.23 1.51 -1.58 -0.67 0.00 0.00 178.83 178.41 2dzj s TRP 50 N -5.35 2.64 0.79 2.96 0.52 -1.15 -4.99 118.94 114.35 2dzj s TRP 50 Ca -0.07 -1.02 -0.11 0.00 0.02 0.00 0.00 56.10 54.93 2dzj s TRP 50 Cb 0.19 -4.66 0.06 0.00 -1.15 0.00 0.00 33.47 27.92 2dzj s TRP 50 CO 0.74 -1.87 1.09 1.52 0.02 0.00 0.00 176.95 178.46 2dzj s TYR 51 N 4.58 2.53 0.18 -1.98 1.13 -1.25 -4.63 117.35 117.91 2dzj s TYR 51 Ca 0.45 1.54 -0.06 0.00 -1.41 0.00 0.00 57.07 57.60 2dzj s TYR 51 Cb -0.00 -3.06 0.08 0.00 -1.10 0.00 0.00 41.96 37.87 2dzj s TYR 51 CO -0.08 -1.87 1.53 -1.00 -2.51 0.00 0.00 175.55 171.62 2dzj h PRO 52 N -1.19 0.75 -0.44 -3.49 0.13 -1.89 -2.39 132.00 123.48 2dzj h PRO 52 Ca -0.44 -0.40 0.13 0.00 -0.87 0.00 0.00 66.00 64.42 2dzj h PRO 52 Cb 1.24 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2dzj h PRO 52 CO 0.51 1.02 0.66 0.00 -0.23 0.00 0.00 178.00 179.97 2dzj h ALA 53 N 0.92 2.15 0.00 -0.56 0.00 -2.00 -2.63 119.26 117.14 2dzj h ALA 53 Ca 0.05 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 2dzj h ALA 53 Cb 0.96 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2dzj h ALA 53 CO 0.09 -0.89 -1.37 -2.13 0.00 0.00 0.00 179.25 174.95 2dzj n ARG 54 N -3.30 0.48 -1.42 0.00 0.63 -1.14 -4.92 116.66 106.99 2dzj n ARG 54 Ca 0.08 0.20 -0.48 0.00 -0.92 0.00 0.00 57.85 56.74 2dzj n ARG 54 Cb 0.83 -1.33 -0.11 0.00 0.45 0.00 0.00 32.46 32.29 2dzj n ARG 54 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2dzj n GLN 55 N -4.26 0.37 -3.85 -0.14 6.02 -0.91 -4.53 117.38 110.06 2dzj n GLN 55 Ca -0.24 0.06 -0.32 0.00 -0.01 0.00 0.00 57.00 56.49 2dzj n GLN 55 Cb 0.58 -1.95 -0.04 0.00 1.02 0.00 0.00 30.24 29.85 2dzj n GLN 55 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2dzj s SER 56 N 8.19 6.40 0.01 1.08 0.15 -1.25 -4.88 113.70 123.41 2dzj s SER 56 Ca 1.21 0.37 0.04 0.00 0.70 0.00 0.00 55.95 58.27 2dzj s SER 56 Cb -1.10 -2.00 -0.01 0.00 -1.71 0.00 0.00 66.02 61.19 2dzj s SER 56 CO 0.51 0.17 -0.11 -0.76 1.20 0.00 0.00 173.24 174.24 2dzj s LEU 57 N -2.39 2.10 -0.14 3.45 1.43 -1.25 -3.23 118.68 118.64 2dzj s LEU 57 Ca 0.34 -0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 52.96 2dzj s LEU 57 Cb -0.13 -0.52 0.04 0.00 0.03 0.00 0.00 46.19 45.61 2dzj s LEU 57 CO 0.25 0.06 0.44 -0.13 0.23 0.00 0.00 176.35 177.19 2dzj s ARG 58 N -0.71 0.55 0.36 1.70 0.52 -0.96 -1.86 118.95 118.56 2dzj s ARG 58 Ca 0.02 0.51 0.26 0.00 -0.52 0.00 0.00 55.73 56.00 2dzj s ARG 58 Cb -0.06 0.26 1.25 0.00 0.52 0.00 0.00 34.95 36.93 2dzj s ARG 58 CO 0.00 -0.08 1.80 -0.07 0.02 0.00 0.00 175.30 176.96 2dzj h LEU 59 N 5.19 0.00 -7.10 2.53 3.38 -1.80 -0.42 115.31 117.09 2dzj h LEU 59 Ca -0.27 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 2dzj h LEU 59 Cb 1.18 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.76 2dzj h LEU 59 CO 0.25 0.00 0.11 -1.81 0.09 0.00 0.00 178.44 177.08 2dzj s ASP 60 N -4.44 -0.54 0.02 -0.43 1.01 -1.26 -4.85 116.67 106.18 2dzj s ASP 60 Ca 0.00 0.37 0.15 0.00 0.71 0.00 0.00 52.55 53.78 2dzj s ASP 60 Cb 0.08 0.52 0.63 0.00 1.01 0.00 0.00 42.92 45.17 2dzj s ASP 60 CO 0.34 -0.70 1.47 -0.81 0.21 0.00 0.00 175.17 175.68 2dzj n PRO 61 N 0.54 0.02 -0.19 8.23 -0.04 -1.26 -2.38 135.00 139.91 2dzj n PRO 61 Ca -0.19 0.27 0.06 0.00 -0.04 0.00 0.00 63.50 63.61 2dzj n PRO 61 Cb 0.59 -1.53 0.09 0.00 -0.04 0.00 0.00 33.50 32.62 2dzj n PRO 61 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dzj n LYS 62 N -1.56 0.95 0.00 0.54 5.02 -1.26 -5.04 118.16 116.82 2dzj n LYS 62 Ca 0.03 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.29 2dzj n LYS 62 Cb 0.17 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2dzj n LYS 62 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dzj n GLY 63 N -0.95 1.55 3.80 0.72 0.00 -1.00 -5.14 105.19 104.16 2dzj n GLY 63 Ca 0.10 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.44 2dzj n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dzj s LYS 64 N 4.31 2.22 -0.61 1.61 3.01 -1.26 -5.02 119.74 124.00 2dzj s LYS 64 Ca 0.00 -2.38 -0.24 0.00 -1.01 0.00 0.00 55.97 52.34 2dzj s LYS 64 Cb 0.00 -1.60 0.05 0.00 -1.01 0.00 0.00 37.83 35.27 2dzj s LYS 64 CO 0.00 -0.43 1.00 -1.54 0.51 0.00 0.00 175.35 174.89 2dzj s SER 65 N -3.95 6.28 0.88 2.83 1.04 -1.26 -4.51 113.70 115.00 2dzj s SER 65 Ca 0.07 -0.52 -0.16 0.00 0.48 0.00 0.00 55.95 55.82 2dzj s SER 65 Cb 0.00 -2.45 -0.07 0.00 0.10 0.00 0.00 66.02 63.60 2dzj s SER 65 CO 0.04 -1.38 -0.09 0.18 0.98 0.00 0.00 173.24 172.97 2dzj n LEU 66 N 7.82 -2.61 -4.12 2.42 4.77 -0.78 -5.01 117.00 119.50 2dzj n LEU 66 Ca 0.01 0.36 -0.16 0.00 -0.03 0.00 0.00 56.01 56.19 2dzj n LEU 66 Cb 0.47 -1.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.44 2dzj n LEU 66 CO 0.65 -4.58 -0.43 -0.54 -1.33 0.00 0.00 177.39 171.16 2dzj s LYS 67 N -2.56 0.69 0.25 3.23 1.02 -1.26 -4.88 119.74 116.24 2dzj s LYS 67 Ca 0.52 -0.87 -0.13 0.00 0.02 0.00 0.00 55.97 55.51 2dzj s LYS 67 Cb -0.26 -0.59 0.35 0.00 -0.52 0.00 0.00 37.83 36.81 2dzj s LYS 67 CO 0.71 0.12 1.56 0.38 -0.92 0.00 0.00 175.35 177.20 2dzj h ASP 68 N 4.38 -1.17 -0.77 2.83 3.04 -1.95 0.49 116.42 123.26 2dzj h ASP 68 Ca -0.39 0.30 0.32 0.00 -3.24 0.00 0.00 57.03 54.03 2dzj h ASP 68 Cb 1.20 0.68 -0.13 0.00 -1.04 0.00 0.00 39.33 40.04 2dzj h ASP 68 CO 0.40 -0.31 0.43 -1.84 -2.04 0.00 0.00 179.24 175.88 2dzj n GLU 69 N -5.55 -0.04 -1.73 4.15 0.28 -1.26 -3.36 120.64 113.13 2dzj n GLU 69 Ca 0.13 1.02 -0.38 0.00 -0.16 0.00 0.00 57.16 57.77 2dzj n GLU 69 Cb 0.45 -1.85 0.06 0.00 1.43 0.00 0.00 31.44 31.52 2dzj n GLU 69 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2dzj n ASP 70 N -4.64 2.31 -4.12 -1.84 9.92 0.17 -4.92 116.55 113.43 2dzj n ASP 70 Ca 0.29 0.90 -0.14 0.00 -0.53 0.00 0.00 54.79 55.30 2dzj n ASP 70 Cb 0.98 -1.56 -0.11 0.00 -0.64 0.00 0.00 41.12 39.79 2dzj n ASP 70 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2dzj s VAL 71 N -1.34 0.75 -0.67 2.53 1.01 -1.26 -2.45 120.40 118.97 2dzj s VAL 71 Ca 0.77 -1.36 0.15 0.00 0.00 0.00 0.00 61.98 61.55 2dzj s VAL 71 Cb -0.40 -1.00 0.15 0.00 0.00 0.00 0.00 36.38 35.13 2dzj s VAL 71 CO 0.45 -0.46 1.46 0.18 0.00 0.00 0.00 175.10 176.73 2dzj n LEU 72 N 1.03 0.31 -0.00 3.92 4.77 -1.16 0.14 117.00 126.01 2dzj n LEU 72 Ca -0.20 0.61 0.05 0.00 -0.03 0.00 0.00 56.01 56.44 2dzj n LEU 72 Cb 0.56 -0.60 -0.07 0.00 -2.33 0.00 0.00 43.42 40.98 2dzj n LEU 72 CO 0.23 -0.57 -0.41 0.00 -1.33 0.00 0.00 177.39 175.31 2dzj n GLN 73 N -1.88 1.51 -0.06 3.23 10.64 -0.76 -4.56 117.38 125.51 2dzj n GLN 73 Ca 0.01 -0.06 -0.06 0.00 -1.83 0.00 0.00 57.00 55.06 2dzj n GLN 73 Cb 0.11 -1.14 -0.15 0.00 -0.86 0.00 0.00 30.24 28.21 2dzj n GLN 73 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2dzj n LYS 74 N -1.63 0.66 -1.18 2.61 4.76 -0.69 -4.97 118.16 117.73 2dzj n LYS 74 Ca -0.01 0.07 -0.34 0.00 -2.87 0.00 0.00 58.31 55.16 2dzj n LYS 74 Cb 0.22 -1.62 0.12 0.00 -1.84 0.00 0.00 35.03 31.91 2dzj n LYS 74 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2dzj n LEU 75 N -2.78 4.30 -0.75 -0.35 -0.00 0.12 -4.81 117.00 112.73 2dzj n LEU 75 Ca -0.23 0.61 0.00 0.00 -0.00 0.00 0.00 56.01 56.39 2dzj n LEU 75 Cb 1.03 -1.49 0.00 0.00 -0.00 0.00 0.00 43.42 42.96 2dzj n LEU 75 CO 0.44 -1.74 0.18 -0.81 -0.00 0.00 0.00 177.39 175.46 2dzj n PRO 76 N -2.93 0.49 -4.61 1.47 -0.04 -1.26 -4.73 135.00 123.38 2dzj n PRO 76 Ca 0.13 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.31 2dzj n PRO 76 Cb 0.50 -1.25 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 2dzj n PRO 76 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2dzj s VAL 77 N -0.25 1.92 0.00 0.52 1.01 -1.26 -5.16 120.40 117.18 2dzj s VAL 77 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2dzj s VAL 77 Cb 0.00 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2dzj s VAL 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 2dzj n GLY 78 N -1.02 4.95 0.45 4.51 0.00 -1.26 -4.90 105.19 107.92 2dzj n GLY 78 Ca -0.06 -2.07 0.38 0.00 0.00 0.00 0.00 46.02 44.27 2dzj n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dzj n THR 79 N -0.11 -0.27 -3.25 2.61 -2.24 -1.26 -3.11 114.28 106.65 2dzj n THR 79 Ca 0.00 1.79 -0.46 0.00 -2.27 0.00 0.00 64.05 63.11 2dzj n THR 79 Cb 0.00 -2.93 -0.03 0.00 -2.10 0.00 0.00 70.33 65.27 2dzj n THR 79 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2dzj s THR 80 N -5.24 5.29 -0.02 4.28 2.01 -1.26 -1.93 115.64 118.76 2dzj s THR 80 Ca -0.07 -1.85 -0.07 0.00 0.31 0.00 0.00 61.69 60.00 2dzj s THR 80 Cb 0.31 -4.46 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 2dzj s THR 80 CO 0.80 -1.04 0.25 0.00 -0.69 0.00 0.00 174.62 173.94 2dzj s ALA 81 N 1.23 3.84 -0.15 7.40 0.00 -0.73 -5.00 121.76 128.36 2dzj s ALA 81 Ca 0.13 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.55 2dzj s ALA 81 Cb -0.18 -2.07 0.02 0.00 0.00 0.00 0.00 23.12 20.89 2dzj s ALA 81 CO -0.03 0.63 -0.19 0.99 0.00 0.00 0.00 175.76 177.17 2dzj s THR 82 N -1.21 1.88 -0.06 0.00 2.01 -1.26 -2.62 115.64 114.38 2dzj s THR 82 Ca 0.24 -0.84 0.05 0.00 0.31 0.00 0.00 61.69 61.45 2dzj s THR 82 Cb -0.13 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 2dzj s THR 82 CO 0.13 0.51 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.62 2dzj s LEU 83 N 1.17 2.40 -0.13 4.42 1.43 -1.22 -4.55 118.68 122.20 2dzj s LEU 83 Ca 0.00 -0.36 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 2dzj s LEU 83 Cb -0.14 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 2dzj s LEU 83 CO -0.08 0.29 0.07 -0.31 0.23 0.00 0.00 176.35 176.54 2dzj s TYR 84 N -0.39 3.34 -0.02 0.29 2.02 -0.17 -0.57 117.35 121.85 2dzj s TYR 84 Ca 0.04 0.26 -0.11 0.00 -0.37 0.00 0.00 57.07 56.89 2dzj s TYR 84 Cb -0.12 -1.94 -0.05 0.00 -0.40 0.00 0.00 41.96 39.44 2dzj s TYR 84 CO 0.02 0.44 0.31 0.12 -1.57 0.00 0.00 175.55 174.87 2dzj s PHE 85 N -0.47 3.65 -0.09 2.71 2.19 0.13 -2.26 117.98 123.83 2dzj s PHE 85 Ca 0.10 0.77 -0.01 0.00 0.33 0.00 0.00 56.93 58.12 2dzj s PHE 85 Cb -0.12 -2.13 0.03 0.00 -1.31 0.00 0.00 43.02 39.49 2dzj s PHE 85 CO 0.02 0.65 -0.02 0.50 1.83 0.00 0.00 175.22 178.20 2dzj s ARG 86 N -1.28 0.93 -0.01 10.12 6.06 -1.20 -2.10 118.95 131.46 2dzj s ARG 86 Ca 0.23 -0.04 -0.30 0.00 -2.50 0.00 0.00 55.73 53.12 2dzj s ARG 86 Cb -0.14 -1.24 -0.06 0.00 0.06 0.00 0.00 34.95 33.57 2dzj s ARG 86 CO 0.12 -0.31 1.46 0.16 -2.50 0.00 0.00 175.30 174.23 2dzj s ASP 87 N 1.88 6.80 0.00 -2.12 1.47 -1.26 -3.81 116.67 119.63 2dzj s ASP 87 Ca 0.05 2.15 0.07 0.00 1.18 0.00 0.00 52.55 56.00 2dzj s ASP 87 Cb -0.13 -2.56 0.06 0.00 -0.34 0.00 0.00 42.92 39.96 2dzj s ASP 87 CO -0.06 -0.77 0.73 0.18 0.68 0.00 0.00 175.17 175.93