#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 1.86 -3.75 1.61 2.88 -1.26 -4.97 113.62 109.99 2dzj n SER 2 Ca 0.00 0.25 -0.29 0.00 -1.33 0.00 0.00 58.87 57.51 2dzj n SER 2 Cb 0.00 -0.70 -0.06 0.00 -0.75 0.00 0.00 64.21 62.69 2dzj n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dzj n SER 3 N -4.02 -0.74 -1.01 -3.46 3.41 -1.26 -4.14 113.62 102.40 2dzj n SER 3 Ca -0.50 -0.92 0.00 0.00 -0.26 0.00 0.00 58.87 57.20 2dzj n SER 3 Cb 0.87 -1.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 2dzj n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dzj n GLY 4 N -1.27 -4.00 3.42 5.00 0.00 -1.26 -5.07 105.19 102.00 2dzj n GLY 4 Ca -0.01 -0.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 2dzj n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dzj s SER 5 N -3.05 -0.52 -0.13 1.61 0.15 -1.26 -5.15 113.70 105.35 2dzj s SER 5 Ca 0.00 0.88 -0.21 0.00 0.70 0.00 0.00 55.95 57.32 2dzj s SER 5 Cb 0.00 0.90 -0.03 0.00 -1.71 0.00 0.00 66.02 65.17 2dzj s SER 5 CO 0.00 -0.28 0.62 -0.55 1.20 0.00 0.00 173.24 174.23 2dzj s SER 6 N -0.16 6.80 -0.24 5.45 0.15 -1.26 -5.05 113.70 119.38 2dzj s SER 6 Ca -0.04 0.96 -0.08 0.00 0.70 0.00 0.00 55.95 57.50 2dzj s SER 6 Cb -0.03 -2.36 -0.03 0.00 -1.71 0.00 0.00 66.02 61.88 2dzj s SER 6 CO 0.03 -0.16 0.09 -0.83 1.20 0.00 0.00 173.24 173.57 2dzj s GLY 7 N 0.93 1.82 -0.22 9.45 0.00 -1.26 -5.08 107.32 112.95 2dzj s GLY 7 Ca 0.31 -1.06 -0.07 0.00 0.00 0.00 0.00 44.72 43.90 2dzj s GLY 7 CO 0.13 0.48 0.07 -3.16 0.00 0.00 0.00 173.10 170.62 2dzj s MET 8 N 1.44 3.79 -0.56 2.90 0.00 -1.26 -4.99 119.30 120.62 2dzj s MET 8 Ca 0.06 -0.42 -0.02 0.00 0.00 0.00 0.00 55.69 55.31 2dzj s MET 8 Cb -0.15 -3.29 0.28 0.00 0.00 0.00 0.00 34.83 31.68 2dzj s MET 8 CO 0.05 0.00 2.19 1.63 0.00 0.00 0.00 175.02 178.88 2dzj n LYS 9 N 4.36 2.40 -1.85 3.16 4.76 -1.26 -4.97 118.16 124.75 2dzj n LYS 9 Ca -0.16 -2.66 -0.29 0.00 -2.87 0.00 0.00 58.31 52.33 2dzj n LYS 9 Cb 0.52 -2.07 0.14 0.00 -1.84 0.00 0.00 35.03 31.78 2dzj n LYS 9 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2dzj s HIS 10 N -2.88 2.31 0.16 2.13 3.76 -1.26 -5.05 115.29 114.46 2dzj s HIS 10 Ca 0.52 0.58 -0.12 0.00 -0.15 0.00 0.00 55.06 55.89 2dzj s HIS 10 Cb 0.40 -3.73 -0.07 0.00 1.11 0.00 0.00 32.58 30.29 2dzj s HIS 10 CO -0.13 -2.24 0.53 0.71 -0.85 0.00 0.00 174.74 172.76 2dzj s TYR 11 N -3.66 3.55 -0.35 1.40 1.51 -0.70 -4.91 117.35 114.20 2dzj s TYR 11 Ca 0.67 0.98 -0.08 0.00 -1.01 0.00 0.00 57.07 57.63 2dzj s TYR 11 Cb -0.08 -2.31 0.03 0.00 -0.11 0.00 0.00 41.96 39.48 2dzj s TYR 11 CO 0.51 0.39 0.14 -1.21 -1.11 0.00 0.00 175.55 174.28 2dzj s GLU 12 N -2.19 2.75 -0.27 -0.62 2.02 -0.66 -3.25 118.70 116.48 2dzj s GLU 12 Ca 0.40 -1.10 0.02 0.00 0.02 0.00 0.00 54.97 54.31 2dzj s GLU 12 Cb -0.14 -3.56 0.06 0.00 0.10 0.00 0.00 34.13 30.60 2dzj s GLU 12 CO 0.20 -0.65 -0.09 0.08 0.02 0.00 0.00 175.26 174.82 2dzj s VAL 13 N 1.47 2.29 -0.52 2.63 1.01 -0.82 -0.77 120.40 125.70 2dzj s VAL 13 Ca 0.00 -1.64 -0.16 0.00 0.00 0.00 0.00 61.98 60.18 2dzj s VAL 13 Cb -0.19 -2.36 0.11 0.00 0.00 0.00 0.00 36.38 33.94 2dzj s VAL 13 CO 0.04 -0.07 0.46 -1.83 0.00 0.00 0.00 175.10 173.70 2dzj s GLU 14 N 1.11 2.96 -0.66 2.72 1.03 -1.08 -2.00 118.70 122.78 2dzj s GLU 14 Ca -0.07 -1.61 -0.27 0.00 0.03 0.00 0.00 54.97 53.05 2dzj s GLU 14 Cb -0.20 -4.23 0.01 0.00 -0.80 0.00 0.00 34.13 28.90 2dzj s GLU 14 CO -0.05 -1.24 1.54 0.42 -1.33 0.00 0.00 175.26 174.61 2dzj s ILE 15 N 1.60 3.57 0.42 1.83 1.01 -0.81 -3.48 121.20 125.34 2dzj s ILE 15 Ca 0.03 0.35 0.07 0.00 0.00 0.00 0.00 60.65 61.11 2dzj s ILE 15 Cb -0.28 -4.45 0.01 0.00 0.01 0.00 0.00 42.46 37.75 2dzj s ILE 15 CO 0.04 -1.38 0.58 -0.76 0.00 0.00 0.00 174.94 173.42 2dzj s LEU 16 N 7.17 3.68 0.47 2.97 1.43 0.06 -2.70 118.68 131.74 2dzj s LEU 16 Ca 0.51 -0.31 -0.10 0.00 -1.03 0.00 0.00 54.13 53.20 2dzj s LEU 16 Cb -0.10 -2.71 -0.05 0.00 0.03 0.00 0.00 46.19 43.35 2dzj s LEU 16 CO 0.19 -0.74 0.83 -0.62 0.23 0.00 0.00 176.35 176.24 2dzj s ASP 17 N -4.32 6.42 0.00 2.29 2.15 -1.21 -0.20 116.67 121.80 2dzj s ASP 17 Ca 0.53 1.16 0.23 0.00 0.43 0.00 0.00 52.55 54.90 2dzj s ASP 17 Cb -0.10 -2.34 0.79 0.00 -0.30 0.00 0.00 42.92 40.97 2dzj s ASP 17 CO 0.33 -0.53 1.58 0.00 -0.17 0.00 0.00 175.17 176.38 2dzj n ALA 18 N -1.80 2.53 0.04 3.66 0.00 -0.71 -2.79 120.51 121.44 2dzj n ALA 18 Ca 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2dzj n ALA 18 Cb 0.54 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 0.39 0.00 0.00 0.00 0.00 -1.26 -4.83 118.16 112.46 2dzj n LYS 19 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 58.31 58.61 2dzj n LYS 19 Cb 0.36 -0.19 0.40 0.00 0.00 0.00 0.00 35.03 35.60 2dzj n LYS 19 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2dzj n THR 20 N -3.00 0.00 -4.35 3.15 -2.24 -1.26 -4.94 114.28 101.63 2dzj n THR 20 Ca 0.00 -0.13 -0.35 0.00 -2.27 0.00 0.00 64.05 61.31 2dzj n THR 20 Cb 0.00 0.36 -0.08 0.00 -2.10 0.00 0.00 70.33 68.51 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 -0.64 -1.23 -3.84 -0.78 1.74 -1.12 -4.87 116.66 105.91 2dzj n ARG 21 Ca 0.13 0.15 -0.37 0.00 -0.77 0.00 0.00 57.85 56.99 2dzj n ARG 21 Cb 0.34 -4.13 -0.06 0.00 -1.02 0.00 0.00 32.46 27.59 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 -7.24 3.50 -0.17 5.56 -1.05 -1.26 -4.58 118.70 113.47 2dzj s GLU 22 Ca 0.32 -0.09 -0.30 0.00 -0.15 0.00 0.00 54.97 54.75 2dzj s GLU 22 Cb -0.18 -3.20 -0.07 0.00 -0.44 0.00 0.00 34.13 30.23 2dzj s GLU 22 CO 0.99 0.76 2.14 1.17 0.95 0.00 0.00 175.26 181.27 2dzj n LYS 23 N 2.02 2.06 -0.12 -4.83 3.00 -1.26 -3.35 118.16 115.68 2dzj n LYS 23 Ca -0.19 0.64 -0.17 0.00 -0.00 0.00 0.00 58.31 58.58 2dzj n LYS 23 Cb 0.55 -3.04 -0.11 0.00 0.00 0.00 0.00 35.03 32.43 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 10.12 2.97 -3.69 3.14 4.77 -1.10 -5.02 117.00 128.18 2dzj n LEU 24 Ca 0.29 -0.13 -0.14 0.00 -0.03 0.00 0.00 56.01 56.00 2dzj n LEU 24 Cb 0.40 -0.86 -0.09 0.00 -2.33 0.00 0.00 43.42 40.54 2dzj n LEU 24 CO 0.68 0.91 0.18 0.00 -1.33 0.00 0.00 177.39 177.84 2dzj s PHE 26 N -0.18 2.29 -0.62 0.00 5.36 -1.26 -1.93 117.98 121.64 2dzj s PHE 26 Ca -0.04 -1.63 -0.05 0.00 -0.96 0.00 0.00 56.93 54.25 2dzj s PHE 26 Cb -0.03 -1.55 0.16 0.00 -0.34 0.00 0.00 43.02 41.26 2dzj s PHE 26 CO 0.02 -0.75 0.46 -0.51 -1.46 0.00 0.00 175.22 172.99 2dzj s LEU 27 N 1.43 5.55 -0.05 6.12 1.43 -0.85 -4.89 118.68 127.42 2dzj s LEU 27 Ca -0.04 -2.63 0.12 0.00 -1.03 0.00 0.00 54.13 50.55 2dzj s LEU 27 Cb -0.18 -1.93 0.43 0.00 0.03 0.00 0.00 46.19 44.54 2dzj s LEU 27 CO -0.07 -0.46 1.29 -0.67 0.23 0.00 0.00 176.35 176.68 2dzj n ASP 28 N 3.85 2.91 -2.42 2.29 -0.08 -1.26 -1.94 116.55 119.90 2dzj n ASP 28 Ca 0.06 -2.21 -0.16 0.00 -1.51 0.00 0.00 54.79 50.97 2dzj n ASP 28 Cb 0.40 -0.41 0.02 0.00 2.34 0.00 0.00 41.12 43.47 2dzj n ASP 28 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2dzj n LYS 29 N 0.63 2.74 -3.93 -0.67 4.01 -1.22 -4.19 118.16 115.53 2dzj n LYS 29 Ca 0.15 -3.94 -0.33 0.00 -0.51 0.00 0.00 58.31 53.68 2dzj n LYS 29 Cb 0.54 -1.95 -0.05 0.00 -0.51 0.00 0.00 35.03 33.05 2dzj n LYS 29 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2dzj s VAL 30 N -4.39 5.35 0.33 -0.18 1.01 -1.20 -4.90 120.40 116.43 2dzj s VAL 30 Ca 0.41 -0.17 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 2dzj s VAL 30 Cb 0.39 -3.49 -0.10 0.00 0.00 0.00 0.00 36.38 33.19 2dzj s VAL 30 CO -0.03 0.34 0.83 -1.61 0.00 0.00 0.00 175.10 174.63 2dzj s GLU 31 N -1.87 4.20 0.16 2.72 0.41 -1.26 -1.71 118.70 121.35 2dzj s GLU 31 Ca 0.26 0.94 -0.09 0.00 -0.41 0.00 0.00 54.97 55.67 2dzj s GLU 31 Cb -0.13 -2.50 0.00 0.00 -1.78 0.00 0.00 34.13 29.72 2dzj s GLU 31 CO 0.17 0.17 1.50 -1.00 -0.49 0.00 0.00 175.26 175.61 2dzj h PRO 32 N 2.52 0.88 0.00 0.39 0.13 -1.96 -2.83 132.00 131.12 2dzj h PRO 32 Ca -0.48 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.19 2dzj h PRO 32 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dzj h PRO 32 CO 0.64 1.11 0.00 -2.39 -0.23 0.00 0.00 178.00 177.13 2dzj n HIS 33 N -4.05 0.00 -1.93 1.56 1.44 -1.26 -2.26 115.22 108.72 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 0.54 -0.43 -0.03 0.00 0.12 0.00 0.00 29.99 30.20 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 -2.85 3.78 0.42 1.59 0.00 -1.07 -4.84 121.76 118.78 2dzj s ALA 34 Ca 0.17 1.36 -0.11 0.00 0.00 0.00 0.00 51.96 53.38 2dzj s ALA 34 Cb 0.17 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 2dzj s ALA 34 CO 0.44 -0.81 0.80 0.95 0.00 0.00 0.00 175.76 177.14 2dzj s THR 35 N 1.27 4.75 0.33 0.00 -4.23 -1.26 -2.82 115.64 113.68 2dzj s THR 35 Ca 0.71 0.70 0.11 0.00 -1.18 0.00 0.00 61.69 62.02 2dzj s THR 35 Cb -0.44 -3.73 0.36 0.00 1.34 0.00 0.00 72.50 70.04 2dzj s THR 35 CO 0.31 -0.54 1.60 0.40 -0.54 0.00 0.00 174.62 175.86 2dzj h ILE 36 N 1.08 0.11 -0.47 2.99 1.08 -1.46 0.33 117.51 121.17 2dzj h ILE 36 Ca -0.47 -0.03 0.10 0.00 -0.39 0.00 0.00 64.86 64.06 2dzj h ILE 36 Cb 1.19 0.01 -0.09 0.00 -3.07 0.00 0.00 36.82 34.85 2dzj h ILE 36 CO 0.64 0.02 -0.16 0.00 -0.69 0.00 0.00 178.15 177.95 2dzj h ALA 37 N 1.93 0.24 -0.76 1.87 0.00 -1.86 -0.70 119.26 119.97 2dzj h ALA 37 Ca 0.70 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.82 2dzj h ALA 37 Cb 1.64 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 19.82 2dzj h ALA 37 CO -0.77 -0.49 0.48 0.93 0.00 0.00 0.00 179.25 179.40 2dzj h GLU 38 N -0.05 0.91 -0.67 0.00 4.39 -0.71 -2.64 114.58 115.81 2dzj h GLU 38 Ca 0.23 -0.05 0.13 0.00 0.34 0.00 0.00 59.36 60.01 2dzj h GLU 38 Cb 0.40 -0.21 -0.13 0.00 -0.10 0.00 0.00 28.75 28.72 2dzj h GLU 38 CO -0.51 0.60 -0.18 0.82 -1.16 0.00 0.00 179.01 178.59 2dzj h ILE 39 N 0.94 0.32 -0.15 3.13 1.08 -0.84 -0.61 117.51 121.38 2dzj h ILE 39 Ca 0.31 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.82 2dzj h ILE 39 Cb 0.02 0.32 -0.05 0.00 -3.07 0.00 0.00 36.82 34.03 2dzj h ILE 39 CO -0.11 0.00 -0.18 0.11 -0.69 0.00 0.00 178.15 177.27 2dzj h LYS 40 N -0.01 -0.21 -0.75 2.37 6.56 -1.24 -2.11 116.57 121.18 2dzj h LYS 40 Ca 0.32 0.01 0.16 0.00 -1.06 0.00 0.00 60.65 60.09 2dzj h LYS 40 Cb 0.50 0.05 -0.14 0.00 -0.57 0.00 0.00 32.23 32.07 2dzj h LYS 40 CO -0.70 -0.14 -0.10 -0.91 -2.06 0.00 0.00 179.45 175.55 2dzj h ASN 41 N -0.22 -0.53 0.08 0.86 2.35 -1.10 -1.80 115.58 115.22 2dzj h ASN 41 Ca 0.11 0.21 0.01 0.00 -0.55 0.00 0.00 56.30 56.08 2dzj h ASN 41 Cb 0.38 0.41 -0.03 0.00 0.05 0.00 0.00 38.32 39.12 2dzj h ASN 41 CO -0.29 -0.22 -0.35 -0.07 -1.65 0.00 0.00 177.43 174.85 2dzj h LEU 42 N 0.04 -1.07 -1.84 1.61 3.38 -0.97 -0.12 115.31 116.35 2dzj h LEU 42 Ca 0.39 0.11 0.42 0.00 0.09 0.00 0.00 57.88 58.89 2dzj h LEU 42 Cb 0.64 0.39 -0.08 0.00 0.09 0.00 0.00 40.66 41.71 2dzj h LEU 42 CO -0.72 -0.37 1.02 0.15 0.09 0.00 0.00 178.44 178.60 2dzj h PHE 43 N -0.50 0.15 -0.43 1.13 3.04 -1.16 0.72 116.94 119.88 2dzj h PHE 43 Ca -0.00 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.85 2dzj h PHE 43 Cb 0.51 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 2dzj h PHE 43 CO -0.40 -0.03 -0.12 1.15 -2.02 0.00 0.00 178.31 176.88 2dzj h THR 44 N 0.05 1.27 -0.16 4.41 2.02 -0.47 -3.08 112.91 116.96 2dzj h THR 44 Ca 0.73 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.68 2dzj h THR 44 Cb 2.72 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 70.29 2dzj h THR 44 CO -0.11 0.42 -0.09 0.29 0.37 0.00 0.00 175.52 176.40 2dzj n LYS 45 N -4.27 -0.07 0.27 6.66 5.02 0.25 -1.40 118.16 124.62 2dzj n LYS 45 Ca -0.01 0.93 -0.17 0.00 -2.02 0.00 0.00 58.31 57.04 2dzj n LYS 45 Cb 0.39 -1.38 -0.08 0.00 -0.02 0.00 0.00 35.03 33.93 2dzj n LYS 45 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2dzj h THR 46 N 0.00 0.24 -3.53 -0.18 2.02 -1.67 -3.35 112.91 106.44 2dzj h THR 46 Ca 0.03 0.00 -0.74 0.00 0.77 0.00 0.00 66.41 66.47 2dzj h THR 46 Cb 0.07 0.24 -0.30 0.00 -1.74 0.00 0.00 68.15 66.42 2dzj h THR 46 CO -0.15 0.00 -0.22 -1.00 0.37 0.00 0.00 175.52 174.52 2dzj s HIS 47 N -6.00 3.52 0.21 3.16 3.76 -0.61 -4.92 115.29 114.42 2dzj s HIS 47 Ca -0.17 -2.15 -0.03 0.00 -0.15 0.00 0.00 55.06 52.56 2dzj s HIS 47 Cb 0.05 -3.52 0.17 0.00 1.11 0.00 0.00 32.58 30.38 2dzj s HIS 47 CO 0.62 -0.95 1.57 -1.00 -0.85 0.00 0.00 174.74 174.13 2dzj h PRO 48 N 7.81 0.62 -0.53 8.40 0.13 -1.38 -3.01 132.00 144.04 2dzj h PRO 48 Ca -0.05 -0.32 0.15 0.00 -0.87 0.00 0.00 66.00 64.91 2dzj h PRO 48 Cb 1.03 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 2dzj h PRO 48 CO 0.79 0.92 0.39 1.96 -0.23 0.00 0.00 178.00 181.83 2dzj h GLN 49 N 0.51 0.00 -5.80 0.86 1.08 -1.91 -3.38 115.11 106.47 2dzj h GLN 49 Ca 0.04 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.63 2dzj h GLN 49 Cb 0.93 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.25 2dzj h GLN 49 CO 0.08 0.00 0.39 -1.58 -0.95 0.00 0.00 178.83 176.77 2dzj s TRP 50 N -5.01 3.12 0.44 2.96 0.52 -1.14 -5.05 118.94 114.78 2dzj s TRP 50 Ca -0.05 0.58 -0.02 0.00 0.02 0.00 0.00 56.10 56.63 2dzj s TRP 50 Cb 0.20 -3.40 -0.02 0.00 -1.15 0.00 0.00 33.47 29.09 2dzj s TRP 50 CO 0.73 -0.73 0.68 1.52 0.02 0.00 0.00 176.95 179.17 2dzj s TYR 51 N 3.11 3.40 0.31 -1.98 1.13 -1.26 -4.67 117.35 117.39 2dzj s TYR 51 Ca 0.32 0.45 0.10 0.00 -1.41 0.00 0.00 57.07 56.52 2dzj s TYR 51 Cb -0.13 -2.21 0.50 0.00 -1.10 0.00 0.00 41.96 39.02 2dzj s TYR 51 CO 0.17 -0.22 1.70 -1.00 -2.51 0.00 0.00 175.55 173.69 2dzj h PRO 52 N 0.42 0.08 0.00 -3.49 0.13 -1.91 -2.93 132.00 124.30 2dzj h PRO 52 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2dzj h PRO 52 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dzj h PRO 52 CO 0.60 0.55 0.31 0.00 -0.23 0.00 0.00 178.00 179.23 2dzj h ALA 53 N 1.45 1.27 0.00 -0.56 0.00 -2.02 -2.96 119.26 116.44 2dzj h ALA 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dzj h ALA 53 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2dzj h ALA 53 CO 0.07 -0.27 -0.64 0.54 0.00 0.00 0.00 179.25 178.95 2dzj n ARG 54 N -2.50 0.34 -1.14 0.00 1.74 -1.11 -4.95 116.66 109.04 2dzj n ARG 54 Ca -0.01 0.13 -0.54 0.00 -0.77 0.00 0.00 57.85 56.66 2dzj n ARG 54 Cb 0.35 -1.08 -0.11 0.00 -1.02 0.00 0.00 32.46 30.60 2dzj n ARG 54 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2dzj n GLN 55 N -3.90 0.00 -3.77 5.56 6.02 -1.12 -4.65 117.38 115.52 2dzj n GLN 55 Ca -0.09 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.53 2dzj n GLN 55 Cb 0.33 -1.36 -0.13 0.00 1.02 0.00 0.00 30.24 30.11 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 5.47 5.22 0.06 1.08 0.15 -1.25 -4.93 113.70 119.49 2dzj s SER 56 Ca 1.09 -1.07 -0.10 0.00 0.70 0.00 0.00 55.95 56.57 2dzj s SER 56 Cb -1.36 -1.85 -0.06 0.00 -1.71 0.00 0.00 66.02 61.04 2dzj s SER 56 CO 0.60 -0.29 0.38 -0.76 1.20 0.00 0.00 173.24 174.36 2dzj s LEU 57 N 1.41 4.37 -0.14 3.45 1.43 -1.25 -2.04 118.68 125.91 2dzj s LEU 57 Ca -0.01 0.78 -0.08 0.00 -1.03 0.00 0.00 54.13 53.78 2dzj s LEU 57 Cb -0.19 -2.88 0.05 0.00 0.03 0.00 0.00 46.19 43.20 2dzj s LEU 57 CO 0.02 0.20 0.34 -0.13 0.23 0.00 0.00 176.35 177.01 2dzj s ARG 58 N -1.78 0.32 0.60 1.70 0.52 -0.80 -0.87 118.95 118.64 2dzj s ARG 58 Ca 0.31 0.63 0.30 0.00 -0.52 0.00 0.00 55.73 56.45 2dzj s ARG 58 Cb -0.14 -0.02 1.66 0.00 0.52 0.00 0.00 34.95 36.97 2dzj s ARG 58 CO 0.17 -0.14 2.05 -0.07 0.02 0.00 0.00 175.30 177.33 2dzj h LEU 59 N 6.88 0.00 -7.60 2.53 3.38 -1.86 -2.58 115.31 116.06 2dzj h LEU 59 Ca -0.36 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.50 2dzj h LEU 59 Cb 1.17 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.74 2dzj h LEU 59 CO 0.33 0.00 -0.31 -1.81 0.09 0.00 0.00 178.44 176.74 2dzj s ASP 60 N -5.47 -0.10 0.00 -0.43 1.11 -1.26 -4.87 116.67 105.65 2dzj s ASP 60 Ca -0.04 -0.15 0.14 0.00 0.18 0.00 0.00 52.55 52.68 2dzj s ASP 60 Cb 0.14 0.32 0.65 0.00 1.07 0.00 0.00 42.92 45.10 2dzj s ASP 60 CO 0.51 -0.53 1.44 -0.81 1.18 0.00 0.00 175.17 176.95 2dzj n PRO 61 N 0.87 0.06 -1.01 8.23 -0.04 -1.26 -2.56 135.00 139.29 2dzj n PRO 61 Ca -0.20 0.22 0.05 0.00 -0.04 0.00 0.00 63.50 63.53 2dzj n PRO 61 Cb 0.58 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.64 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 -1.44 0.69 0.00 0.54 4.76 -1.26 -5.03 118.16 116.42 2dzj n LYS 62 Ca 0.04 -2.47 0.00 0.00 -2.87 0.00 0.00 58.31 53.01 2dzj n LYS 62 Cb 0.15 -0.74 0.00 0.00 -1.84 0.00 0.00 35.03 32.60 2dzj n LYS 62 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dzj n GLY 63 N -0.26 1.26 3.30 0.72 0.00 -1.06 -5.17 105.19 103.98 2dzj n GLY 63 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 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 3.21 1.67 0.15 1.61 1.02 -1.26 -5.03 119.74 121.11 2dzj s LYS 64 Ca 0.00 -1.96 -0.30 0.00 0.02 0.00 0.00 55.97 53.73 2dzj s LYS 64 Cb 0.00 0.20 -0.07 0.00 -0.52 0.00 0.00 37.83 37.44 2dzj s LYS 64 CO 0.00 -0.58 1.00 -1.54 -0.92 0.00 0.00 175.35 173.31 2dzj s SER 65 N -3.36 7.45 0.70 2.83 1.04 -1.26 -4.14 113.70 116.96 2dzj s SER 65 Ca 0.39 1.90 -0.12 0.00 0.48 0.00 0.00 55.95 58.60 2dzj s SER 65 Cb 0.03 -2.60 0.01 0.00 0.10 0.00 0.00 66.02 63.57 2dzj s SER 65 CO 0.23 -0.08 1.07 -0.76 0.98 0.00 0.00 173.24 174.68 2dzj s LEU 66 N -0.25 3.17 0.02 2.42 1.43 -0.05 -4.99 118.68 120.44 2dzj s LEU 66 Ca 0.47 1.72 0.05 0.00 -1.03 0.00 0.00 54.13 55.34 2dzj s LEU 66 Cb -0.25 -4.51 -0.02 0.00 0.03 0.00 0.00 46.19 41.44 2dzj s LEU 66 CO 0.32 -1.57 -0.15 -0.54 0.23 0.00 0.00 176.35 174.63 2dzj s LYS 67 N -4.82 1.05 0.27 1.70 -0.14 -1.26 -4.90 119.74 111.64 2dzj s LYS 67 Ca 0.60 -0.70 0.02 0.00 -1.36 0.00 0.00 55.97 54.53 2dzj s LYS 67 Cb -0.15 -1.06 0.67 0.00 -1.68 0.00 0.00 37.83 35.60 2dzj s LYS 67 CO 0.52 0.27 1.34 -3.47 -0.76 0.00 0.00 175.35 173.25 2dzj n ASP 68 N 2.14 -0.09 -0.26 2.83 -0.08 -1.26 0.30 116.55 120.14 2dzj n ASP 68 Ca -0.17 1.45 0.11 0.00 -1.51 0.00 0.00 54.79 54.68 2dzj n ASP 68 Cb 0.55 -0.53 0.22 0.00 2.34 0.00 0.00 41.12 43.70 2dzj n ASP 68 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 2dzj n GLU 69 N -5.23 -0.06 -1.85 -0.67 0.28 -1.26 -3.44 120.64 108.42 2dzj n GLU 69 Ca 0.20 1.12 -0.38 0.00 -0.16 0.00 0.00 57.16 57.95 2dzj n GLU 69 Cb 0.67 -1.78 0.04 0.00 1.43 0.00 0.00 31.44 31.80 2dzj n GLU 69 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2dzj s ASP 70 N -5.00 5.17 0.11 -1.84 1.11 0.15 -4.91 116.67 111.46 2dzj s ASP 70 Ca -0.10 2.63 0.05 0.00 0.18 0.00 0.00 52.55 55.31 2dzj s ASP 70 Cb 0.22 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.55 2dzj s ASP 70 CO 0.58 -1.63 -0.11 -0.69 1.18 0.00 0.00 175.17 174.51 2dzj s VAL 71 N -1.39 1.11 -0.91 -1.27 1.01 -1.26 -2.16 120.40 115.52 2dzj s VAL 71 Ca 0.75 -1.75 0.08 0.00 0.00 0.00 0.00 61.98 61.06 2dzj s VAL 71 Cb -0.37 -1.51 0.07 0.00 0.00 0.00 0.00 36.38 34.58 2dzj s VAL 71 CO 0.42 -0.55 1.26 0.18 0.00 0.00 0.00 175.10 176.41 2dzj n LEU 72 N 0.40 0.08 -0.00 3.92 4.77 -1.13 0.02 117.00 125.06 2dzj n LEU 72 Ca -0.15 0.53 0.04 0.00 -0.03 0.00 0.00 56.01 56.41 2dzj n LEU 72 Cb 0.58 -0.53 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 2dzj n LEU 72 CO 0.28 -0.45 -0.57 0.00 -1.33 0.00 0.00 177.39 175.32 2dzj n GLN 73 N -1.60 0.48 -0.03 3.23 10.64 -0.96 -4.59 117.38 124.56 2dzj n GLN 73 Ca 0.01 -0.08 -0.07 0.00 -1.83 0.00 0.00 57.00 55.04 2dzj n GLN 73 Cb 0.08 -1.19 -0.14 0.00 -0.86 0.00 0.00 30.24 28.13 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 -1.77 0.65 -1.21 2.61 4.76 -0.65 -4.95 118.16 117.59 2dzj n LYS 74 Ca -0.01 0.19 -0.34 0.00 -2.87 0.00 0.00 58.31 55.27 2dzj n LYS 74 Cb 0.22 -1.71 0.12 0.00 -1.84 0.00 0.00 35.03 31.82 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 -2.91 4.49 -0.74 -0.35 -0.00 0.10 -4.82 117.00 112.77 2dzj n LEU 75 Ca -0.20 0.62 0.00 0.00 -0.00 0.00 0.00 56.01 56.44 2dzj n LEU 75 Cb 1.03 -1.50 0.00 0.00 -0.00 0.00 0.00 43.42 42.95 2dzj n LEU 75 CO 0.44 -1.66 0.18 -0.81 -0.00 0.00 0.00 177.39 175.54 2dzj n PRO 76 N -2.93 0.49 -4.56 1.47 -0.04 -1.26 -4.73 135.00 123.43 2dzj n PRO 76 Ca 0.14 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.32 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 -0.26 1.96 0.00 0.52 1.01 -1.26 -5.16 120.40 117.20 2dzj s VAL 77 Ca 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 61.98 60.02 2dzj s VAL 77 Cb 0.00 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.47 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 -1.04 3.22 0.36 4.51 0.00 -1.26 -4.90 105.19 106.09 2dzj n GLY 78 Ca -0.06 -1.89 0.14 0.00 0.00 0.00 0.00 46.02 44.21 2dzj n GLY 78 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2dzj h THR 79 N 0.00 0.71 -3.16 2.61 1.35 -1.94 -3.30 112.91 109.17 2dzj h THR 79 Ca 0.00 -0.25 -0.74 0.00 -0.55 0.00 0.00 66.41 64.87 2dzj h THR 79 Cb 0.00 -0.08 -0.23 0.00 -1.73 0.00 0.00 68.15 66.12 2dzj h THR 79 CO 0.00 0.13 0.06 -0.89 -0.25 0.00 0.00 175.52 174.57 2dzj s THR 80 N -5.79 5.15 0.15 6.82 2.01 -1.26 -1.65 115.64 121.06 2dzj s THR 80 Ca -0.11 -1.60 -0.07 0.00 0.31 0.00 0.00 61.69 60.22 2dzj s THR 80 Cb 0.25 -4.46 -0.06 0.00 0.01 0.00 0.00 72.50 68.24 2dzj s THR 80 CO 0.80 -1.05 0.42 0.00 -0.69 0.00 0.00 174.62 174.10 2dzj s ALA 81 N 1.66 3.72 -0.11 7.40 0.00 0.05 -5.00 121.76 129.48 2dzj s ALA 81 Ca 0.12 -0.45 0.02 0.00 0.00 0.00 0.00 51.96 51.65 2dzj s ALA 81 Cb -0.21 -2.23 0.02 0.00 0.00 0.00 0.00 23.12 20.69 2dzj s ALA 81 CO -0.00 0.61 -0.15 0.99 0.00 0.00 0.00 175.76 177.20 2dzj s THR 82 N -1.63 1.53 0.00 0.00 2.01 -1.26 -2.65 115.64 113.64 2dzj s THR 82 Ca 0.40 -0.66 0.08 0.00 0.31 0.00 0.00 61.69 61.83 2dzj s THR 82 Cb -0.12 -1.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.97 2dzj s THR 82 CO 0.22 0.45 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.59 2dzj s LEU 83 N 1.02 2.15 -0.15 4.42 1.43 -1.23 -4.76 118.68 121.56 2dzj s LEU 83 Ca -0.06 -0.49 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 2dzj s LEU 83 Cb -0.15 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 2dzj s LEU 83 CO -0.02 0.30 0.03 -0.31 0.23 0.00 0.00 176.35 176.58 2dzj s TYR 84 N -0.69 3.20 0.04 0.29 2.02 -0.97 -0.76 117.35 120.47 2dzj s TYR 84 Ca 0.11 0.04 -0.06 0.00 -0.37 0.00 0.00 57.07 56.79 2dzj s TYR 84 Cb -0.10 -1.99 -0.05 0.00 -0.40 0.00 0.00 41.96 39.43 2dzj s TYR 84 CO 0.00 0.21 0.29 0.12 -1.57 0.00 0.00 175.55 174.60 2dzj s PHE 85 N 0.03 3.56 -0.09 2.71 2.19 0.73 -1.91 117.98 125.20 2dzj s PHE 85 Ca 0.04 0.56 -0.02 0.00 0.33 0.00 0.00 56.93 57.84 2dzj s PHE 85 Cb -0.13 -1.98 0.03 0.00 -1.31 0.00 0.00 43.02 39.64 2dzj s PHE 85 CO 0.01 0.58 0.01 0.50 1.83 0.00 0.00 175.22 178.16 2dzj s ARG 86 N -1.96 0.53 0.19 10.12 6.06 -0.86 -1.73 118.95 131.30 2dzj s ARG 86 Ca 0.30 0.06 -0.31 0.00 -2.50 0.00 0.00 55.73 53.28 2dzj s ARG 86 Cb -0.13 -1.10 -0.10 0.00 0.06 0.00 0.00 34.95 33.68 2dzj s ARG 86 CO 0.18 -0.36 1.55 0.34 -2.50 0.00 0.00 175.30 174.51 2dzj s ASP 87 N 1.98 6.58 0.00 -2.12 2.15 -1.26 -3.91 116.67 120.09 2dzj s ASP 87 Ca 0.04 2.66 0.24 0.00 0.43 0.00 0.00 52.55 55.93 2dzj s ASP 87 Cb -0.13 -2.60 0.28 0.00 -0.30 0.00 0.00 42.92 40.16 2dzj s ASP 87 CO -0.06 -0.81 1.31 0.18 -0.17 0.00 0.00 175.17 175.62