#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzj s SER 2 N 0.00 4.66 -0.44 1.61 0.01 -1.26 -5.03 113.70 113.25 2dzj s SER 2 Ca 0.00 -1.10 -0.45 0.00 1.31 0.00 0.00 55.95 55.72 2dzj s SER 2 Cb 0.00 -0.06 -0.19 0.00 0.21 0.00 0.00 66.02 65.98 2dzj s SER 2 CO 0.00 -0.83 1.68 -1.54 0.41 0.00 0.00 173.24 172.96 2dzj n SER 3 N -1.55 1.54 0.00 2.44 3.41 -1.26 -4.81 113.62 113.40 2dzj n SER 3 Ca -0.01 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.72 2dzj n SER 3 Cb 0.64 -0.96 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 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 4.30 1.45 3.39 5.00 0.00 -1.26 -5.17 105.19 112.90 2dzj n GLY 4 Ca 0.31 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 2dzj n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dzj s SER 5 N 2.00 3.35 0.22 1.61 0.01 -1.26 -5.15 113.70 114.48 2dzj s SER 5 Ca 0.00 -0.65 0.09 0.00 1.31 0.00 0.00 55.95 56.70 2dzj s SER 5 Cb 0.00 -0.31 -0.05 0.00 0.21 0.00 0.00 66.02 65.88 2dzj s SER 5 CO 0.00 0.22 -0.16 -0.44 0.41 0.00 0.00 173.24 173.27 2dzj s SER 6 N -1.70 2.81 0.00 2.44 0.01 -1.26 -5.08 113.70 110.92 2dzj s SER 6 Ca 0.14 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2dzj s SER 6 Cb -0.10 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2dzj s SER 6 CO 0.05 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2dzj n GLY 7 N -0.38 2.14 3.85 3.44 0.00 -1.26 -5.09 105.19 107.89 2dzj n GLY 7 Ca -0.08 -1.13 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 2dzj n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dzj s MET 8 N -3.62 3.90 -1.23 1.61 -2.45 -1.26 -5.01 119.30 111.24 2dzj s MET 8 Ca 0.00 0.38 -0.14 0.00 -1.25 0.00 0.00 55.69 54.68 2dzj s MET 8 Cb 0.00 -2.99 0.16 0.00 1.25 0.00 0.00 34.83 33.25 2dzj s MET 8 CO 0.00 0.53 1.49 1.63 1.05 0.00 0.00 175.02 179.72 2dzj n LYS 9 N 0.95 3.35 -1.75 4.11 5.02 -1.26 -5.00 118.16 123.58 2dzj n LYS 9 Ca -0.07 -3.76 -0.30 0.00 -2.02 0.00 0.00 58.31 52.16 2dzj n LYS 9 Cb 0.52 -3.10 0.18 0.00 -0.02 0.00 0.00 35.03 32.61 2dzj n LYS 9 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2dzj s HIS 10 N 1.89 1.57 0.11 2.13 3.76 -1.26 -5.03 115.29 118.45 2dzj s HIS 10 Ca 0.44 0.42 -0.24 0.00 -0.15 0.00 0.00 55.06 55.54 2dzj s HIS 10 Cb -0.02 -3.90 -0.07 0.00 1.11 0.00 0.00 32.58 29.71 2dzj s HIS 10 CO 0.01 -2.78 0.72 0.71 -0.85 0.00 0.00 174.74 172.55 2dzj s TYR 11 N -3.66 3.83 -0.39 1.40 1.51 -0.95 -4.93 117.35 114.17 2dzj s TYR 11 Ca 0.72 1.50 -0.12 0.00 -1.01 0.00 0.00 57.07 58.15 2dzj s TYR 11 Cb -0.06 -2.72 0.03 0.00 -0.11 0.00 0.00 41.96 39.10 2dzj s TYR 11 CO 0.53 0.46 0.24 -1.21 -1.11 0.00 0.00 175.55 174.46 2dzj s GLU 12 N -0.81 2.86 -0.28 -0.62 2.02 -0.89 -3.17 118.70 117.82 2dzj s GLU 12 Ca 0.35 -1.08 -0.01 0.00 0.02 0.00 0.00 54.97 54.25 2dzj s GLU 12 Cb -0.21 -3.82 0.04 0.00 0.10 0.00 0.00 34.13 30.24 2dzj s GLU 12 CO 0.23 -0.73 -0.03 0.08 0.02 0.00 0.00 175.26 174.83 2dzj s VAL 13 N 1.59 2.88 -0.51 2.63 1.01 -0.01 -0.86 120.40 127.13 2dzj s VAL 13 Ca 0.03 -1.28 -0.11 0.00 0.00 0.00 0.00 61.98 60.61 2dzj s VAL 13 Cb -0.19 -2.59 0.13 0.00 0.00 0.00 0.00 36.38 33.72 2dzj s VAL 13 CO 0.08 0.01 0.41 -1.83 0.00 0.00 0.00 175.10 173.76 2dzj s GLU 14 N 1.26 2.68 -0.54 2.72 -1.05 -0.95 -1.57 118.70 121.26 2dzj s GLU 14 Ca -0.04 -1.78 -0.28 0.00 -0.15 0.00 0.00 54.97 52.72 2dzj s GLU 14 Cb -0.19 -4.06 0.02 0.00 -0.44 0.00 0.00 34.13 29.46 2dzj s GLU 14 CO -0.03 -1.24 1.33 0.42 0.95 0.00 0.00 175.26 176.69 2dzj s ILE 15 N 1.38 3.90 0.46 1.83 1.01 -0.62 -3.36 121.20 125.80 2dzj s ILE 15 Ca 0.05 0.81 0.08 0.00 0.00 0.00 0.00 60.65 61.60 2dzj s ILE 15 Cb -0.27 -4.50 0.02 0.00 0.01 0.00 0.00 42.46 37.72 2dzj s ILE 15 CO 0.00 -1.15 0.55 -0.76 0.00 0.00 0.00 174.94 173.58 2dzj s LEU 16 N 5.54 3.39 0.37 2.97 1.43 0.45 -2.24 118.68 130.59 2dzj s LEU 16 Ca 0.51 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.89 2dzj s LEU 16 Cb -0.10 -2.15 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 2dzj s LEU 16 CO 0.27 -0.88 0.65 -0.62 0.23 0.00 0.00 176.35 176.00 2dzj s ASP 17 N -4.35 6.38 0.00 2.29 2.15 -1.20 0.03 116.67 121.98 2dzj s ASP 17 Ca 0.53 0.80 0.23 0.00 0.43 0.00 0.00 52.55 54.54 2dzj s ASP 17 Cb -0.07 -2.18 0.79 0.00 -0.30 0.00 0.00 42.92 41.17 2dzj s ASP 17 CO 0.32 -0.35 1.59 0.00 -0.17 0.00 0.00 175.17 176.55 2dzj n ALA 18 N -1.52 2.53 0.04 3.66 0.00 -0.91 -2.65 120.51 121.66 2dzj n ALA 18 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2dzj n ALA 18 Cb 0.55 -1.08 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 0.41 0.00 0.00 0.00 3.00 -1.26 -4.83 118.16 115.48 2dzj n LYS 19 Ca 0.17 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.60 2dzj n LYS 19 Cb 0.37 -0.29 0.17 0.00 0.00 0.00 0.00 35.03 35.29 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 -3.12 0.00 -3.95 3.15 -2.24 -1.26 -4.97 114.28 101.89 2dzj n THR 20 Ca 0.00 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.50 2dzj n THR 20 Cb 0.00 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 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 -1.38 -3.13 -4.24 -0.78 1.74 -1.08 -4.88 116.66 102.90 2dzj n ARG 21 Ca 0.06 0.40 -0.35 0.00 -0.77 0.00 0.00 57.85 57.19 2dzj n ARG 21 Cb 0.34 -4.47 -0.09 0.00 -1.02 0.00 0.00 32.46 27.21 2dzj n ARG 21 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2dzj s GLU 22 N -6.55 3.28 -0.34 5.56 2.02 -1.26 -4.58 118.70 116.83 2dzj s GLU 22 Ca 0.03 -0.36 -0.27 0.00 0.02 0.00 0.00 54.97 54.38 2dzj s GLU 22 Cb -0.01 -2.94 -0.05 0.00 0.10 0.00 0.00 34.13 31.23 2dzj s GLU 22 CO 0.89 0.61 2.26 0.21 0.02 0.00 0.00 175.26 179.24 2dzj s LYS 23 N -0.59 2.73 -0.13 1.61 2.47 -1.26 -3.26 119.74 121.31 2dzj s LYS 23 Ca 0.10 1.72 0.12 0.00 -1.56 0.00 0.00 55.97 56.35 2dzj s LYS 23 Cb -0.12 -4.44 -0.24 0.00 -1.46 0.00 0.00 37.83 31.57 2dzj s LYS 23 CO 0.02 -2.56 0.33 1.28 0.16 0.00 0.00 175.35 174.58 2dzj n LEU 24 N 13.25 0.86 -3.70 5.43 4.77 -0.95 -4.95 117.00 131.71 2dzj n LEU 24 Ca 0.32 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.38 2dzj n LEU 24 Cb 0.49 0.10 -0.11 0.00 -2.33 0.00 0.00 43.42 41.57 2dzj n LEU 24 CO 0.68 0.52 0.07 0.00 -1.33 0.00 0.00 177.39 177.33 2dzj s PHE 26 N 1.13 3.01 -0.44 0.00 5.36 -1.26 -1.59 117.98 124.19 2dzj s PHE 26 Ca -0.07 -2.30 -0.09 0.00 -0.96 0.00 0.00 56.93 53.51 2dzj s PHE 26 Cb -0.07 -2.09 0.10 0.00 -0.34 0.00 0.00 43.02 40.62 2dzj s PHE 26 CO -0.10 -0.87 0.29 -0.51 -1.46 0.00 0.00 175.22 172.58 2dzj s LEU 27 N 1.18 5.41 -0.02 6.12 1.43 -0.61 -4.90 118.68 127.29 2dzj s LEU 27 Ca -0.01 -1.74 0.22 0.00 -1.03 0.00 0.00 54.13 51.57 2dzj s LEU 27 Cb -0.19 -1.98 0.66 0.00 0.03 0.00 0.00 46.19 44.71 2dzj s LEU 27 CO -0.08 -0.61 1.56 -0.67 0.23 0.00 0.00 176.35 176.78 2dzj n ASP 28 N 4.88 4.08 -1.58 2.29 2.03 -1.26 -0.83 116.55 126.16 2dzj n ASP 28 Ca -0.08 -2.07 -0.07 0.00 0.52 0.00 0.00 54.79 53.08 2dzj n ASP 28 Cb 0.42 -0.51 0.09 0.00 -0.72 0.00 0.00 41.12 40.40 2dzj n ASP 28 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2dzj n LYS 29 N 1.57 2.19 -3.11 -0.67 5.02 -1.23 -4.19 118.16 117.73 2dzj n LYS 29 Ca 0.25 -3.50 -0.28 0.00 -2.02 0.00 0.00 58.31 52.75 2dzj n LYS 29 Cb 0.67 -1.67 -0.02 0.00 -0.02 0.00 0.00 35.03 33.99 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 -3.43 4.96 0.11 -0.18 1.01 -1.19 -4.89 120.40 116.79 2dzj s VAL 30 Ca 0.41 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 2dzj s VAL 30 Cb 0.38 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 2dzj s VAL 30 CO -0.04 -0.49 0.34 -1.61 0.00 0.00 0.00 175.10 173.30 2dzj s GLU 31 N -3.93 3.59 0.08 2.72 2.02 -1.26 -2.24 118.70 119.68 2dzj s GLU 31 Ca 0.46 -0.14 -0.17 0.00 0.02 0.00 0.00 54.97 55.14 2dzj s GLU 31 Cb -0.10 -2.91 -0.10 0.00 0.10 0.00 0.00 34.13 31.11 2dzj s GLU 31 CO 0.34 0.52 1.40 -1.00 0.02 0.00 0.00 175.26 176.53 2dzj h PRO 32 N 3.03 0.58 0.00 0.39 0.13 -1.98 -2.85 132.00 131.29 2dzj h PRO 32 Ca -0.46 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.36 2dzj h PRO 32 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2dzj h PRO 32 CO 0.72 0.90 0.00 -2.39 -0.23 0.00 0.00 178.00 177.00 2dzj n HIS 33 N -4.37 0.00 -2.06 1.56 1.44 -1.26 -2.02 115.22 108.51 2dzj n HIS 33 Ca -0.05 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.25 2dzj n HIS 33 Cb 0.43 -0.20 -0.03 0.00 0.12 0.00 0.00 29.99 30.31 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 -2.40 3.64 0.23 1.59 0.00 -1.08 -4.85 121.76 118.89 2dzj s ALA 34 Ca 0.21 1.26 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 2dzj s ALA 34 Cb 0.13 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 2dzj s ALA 34 CO 0.27 -0.69 0.49 0.95 0.00 0.00 0.00 175.76 176.78 2dzj s THR 35 N 0.58 5.07 0.34 0.00 -4.23 -1.26 -2.34 115.64 113.80 2dzj s THR 35 Ca 0.63 0.07 0.13 0.00 -1.18 0.00 0.00 61.69 61.34 2dzj s THR 35 Cb -0.40 -3.68 0.36 0.00 1.34 0.00 0.00 72.50 70.12 2dzj s THR 35 CO 0.36 -0.16 1.59 0.40 -0.54 0.00 0.00 174.62 176.27 2dzj h ILE 36 N 1.68 0.07 -0.65 2.99 1.08 -1.56 0.57 117.51 121.70 2dzj h ILE 36 Ca -0.47 -0.02 0.13 0.00 -0.39 0.00 0.00 64.86 64.11 2dzj h ILE 36 Cb 1.18 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.83 2dzj h ILE 36 CO 0.69 0.01 0.11 0.00 -0.69 0.00 0.00 178.15 178.27 2dzj h ALA 37 N 1.96 0.76 -0.32 1.87 0.00 -1.87 -1.23 119.26 120.42 2dzj h ALA 37 Ca 0.74 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.76 2dzj h ALA 37 Cb 1.78 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 2dzj h ALA 37 CO -0.78 -0.34 0.01 0.93 0.00 0.00 0.00 179.25 179.07 2dzj h GLU 38 N 0.23 0.55 -0.91 0.00 5.08 -0.23 -2.97 114.58 116.32 2dzj h GLU 38 Ca 0.35 -0.17 0.19 0.00 -1.00 0.00 0.00 59.36 58.73 2dzj h GLU 38 Cb 0.55 -0.05 -0.11 0.00 0.50 0.00 0.00 28.75 29.64 2dzj h GLU 38 CO -0.47 0.68 0.48 0.82 -1.00 0.00 0.00 179.01 179.52 2dzj h ILE 39 N 0.36 0.62 -0.70 3.13 1.08 -0.80 0.66 117.51 121.86 2dzj h ILE 39 Ca 0.09 -0.20 -0.03 0.00 -0.39 0.00 0.00 64.86 64.33 2dzj h ILE 39 Cb 0.42 -0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 2dzj h ILE 39 CO 0.01 0.11 0.32 0.11 -0.69 0.00 0.00 178.15 178.01 2dzj h LYS 40 N 0.58 1.02 -0.86 2.37 1.57 -1.20 -2.67 116.57 117.39 2dzj h LYS 40 Ca 0.54 -0.16 0.06 0.00 -1.87 0.00 0.00 60.65 59.22 2dzj h LYS 40 Cb 0.90 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.97 2dzj h LYS 40 CO -0.43 0.82 0.53 -0.91 -0.57 0.00 0.00 179.45 178.88 2dzj h ASN 41 N 0.98 0.83 0.73 0.86 2.35 -0.78 -2.52 115.58 118.03 2dzj h ASN 41 Ca 0.24 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.98 2dzj h ASN 41 Cb 0.15 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.36 2dzj h ASN 41 CO -0.03 0.52 -0.46 -0.07 -1.65 0.00 0.00 177.43 175.75 2dzj h LEU 42 N 0.96 -1.16 -1.50 1.61 3.38 -1.09 -2.19 115.31 115.31 2dzj h LEU 42 Ca 0.38 0.07 0.34 0.00 0.09 0.00 0.00 57.88 58.75 2dzj h LEU 42 Cb 0.18 0.34 -0.10 0.00 0.09 0.00 0.00 40.66 41.18 2dzj h LEU 42 CO -0.18 -0.70 0.77 0.15 0.09 0.00 0.00 178.44 178.58 2dzj h PHE 43 N -1.11 0.49 -0.38 1.13 3.04 -1.35 0.32 116.94 119.08 2dzj h PHE 43 Ca -0.10 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.83 2dzj h PHE 43 Cb 0.90 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 2dzj h PHE 43 CO -0.10 -0.03 0.06 1.15 -2.02 0.00 0.00 178.31 177.38 2dzj h THR 44 N 0.23 1.24 -0.09 4.41 2.02 -0.98 -2.91 112.91 116.82 2dzj h THR 44 Ca 0.66 -0.85 0.01 0.00 0.77 0.00 0.00 66.41 67.00 2dzj h THR 44 Cb 2.00 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 69.46 2dzj h THR 44 CO -0.27 0.29 -0.05 0.29 0.37 0.00 0.00 175.52 176.14 2dzj n LYS 45 N -4.55 -0.04 0.29 6.66 5.02 0.11 -1.11 118.16 124.54 2dzj n LYS 45 Ca -0.01 0.77 -0.16 0.00 -2.02 0.00 0.00 58.31 56.89 2dzj n LYS 45 Cb 0.23 -1.15 -0.08 0.00 -0.02 0.00 0.00 35.03 34.00 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 0.45 -3.68 -0.18 2.02 -1.66 -3.35 112.91 106.52 2dzj h THR 46 Ca 0.01 0.00 -0.75 0.00 0.77 0.00 0.00 66.41 66.45 2dzj h THR 46 Cb 0.04 0.45 -0.30 0.00 -1.74 0.00 0.00 68.15 66.60 2dzj h THR 46 CO -0.09 0.00 -0.12 -1.00 0.37 0.00 0.00 175.52 174.68 2dzj s HIS 47 N -6.08 3.59 0.30 3.16 3.76 -0.40 -4.90 115.29 114.73 2dzj s HIS 47 Ca -0.17 -2.29 0.09 0.00 -0.15 0.00 0.00 55.06 52.55 2dzj s HIS 47 Cb 0.04 -3.55 0.48 0.00 1.11 0.00 0.00 32.58 30.67 2dzj s HIS 47 CO 0.63 -0.93 1.70 -1.00 -0.85 0.00 0.00 174.74 174.29 2dzj h PRO 48 N 7.49 0.12 -0.05 8.40 0.13 -1.26 -2.96 132.00 143.87 2dzj h PRO 48 Ca 0.04 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2dzj h PRO 48 Cb 1.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2dzj h PRO 48 CO 0.74 0.57 0.02 1.96 -0.23 0.00 0.00 178.00 181.07 2dzj h GLN 49 N 0.10 0.07 -5.48 0.86 1.08 -1.90 -3.36 115.11 106.47 2dzj h GLN 49 Ca 0.00 -0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.57 2dzj h GLN 49 Cb 0.87 -0.02 -0.14 0.00 -0.05 0.00 0.00 27.48 28.14 2dzj h GLN 49 CO 0.07 0.06 0.70 -1.58 -0.95 0.00 0.00 178.83 177.13 2dzj s TRP 50 N -5.10 2.72 0.67 2.96 0.52 -1.12 -5.03 118.94 114.56 2dzj s TRP 50 Ca -0.05 -0.69 -0.11 0.00 0.02 0.00 0.00 56.10 55.27 2dzj s TRP 50 Cb 0.17 -4.35 -0.01 0.00 -1.15 0.00 0.00 33.47 28.13 2dzj s TRP 50 CO 0.68 -1.67 1.05 1.52 0.02 0.00 0.00 176.95 178.55 2dzj s TYR 51 N 4.00 3.34 0.22 -1.98 1.13 -1.26 -4.63 117.35 118.17 2dzj s TYR 51 Ca 0.27 1.32 0.23 0.00 -1.41 0.00 0.00 57.07 57.48 2dzj s TYR 51 Cb -0.13 -2.84 0.99 0.00 -1.10 0.00 0.00 41.96 38.89 2dzj s TYR 51 CO 0.06 -1.02 1.87 -1.00 -2.51 0.00 0.00 175.55 172.94 2dzj h PRO 52 N -0.56 0.00 0.00 -3.49 0.13 -1.90 -2.36 132.00 123.82 2dzj h PRO 52 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dzj h PRO 52 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dzj h PRO 52 CO 0.60 0.24 0.00 0.00 -0.23 0.00 0.00 178.00 178.60 2dzj h ALA 53 N 1.76 1.00 0.00 -0.56 0.00 -2.01 -3.24 119.26 116.20 2dzj h ALA 53 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 2dzj h ALA 53 Cb 0.67 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 2dzj h ALA 53 CO 0.03 0.00 -2.02 -2.13 0.00 0.00 0.00 179.25 175.14 2dzj n ARG 54 N -2.39 0.42 -1.68 0.00 0.63 -1.02 -4.97 116.66 107.65 2dzj n ARG 54 Ca 0.01 0.18 -0.49 0.00 -0.92 0.00 0.00 57.85 56.63 2dzj n ARG 54 Cb 0.19 -1.20 -0.05 0.00 0.45 0.00 0.00 32.46 31.85 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 -3.91 2.01 -3.86 -0.14 6.02 -0.92 -4.09 117.38 112.50 2dzj n GLN 55 Ca -0.37 0.73 -0.36 0.00 -0.01 0.00 0.00 57.00 57.00 2dzj n GLN 55 Cb 0.75 -2.54 -0.13 0.00 1.02 0.00 0.00 30.24 29.33 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 3.55 4.72 -0.05 1.08 0.15 -1.13 -4.89 113.70 117.12 2dzj s SER 56 Ca 0.92 -0.74 -0.06 0.00 0.70 0.00 0.00 55.95 56.77 2dzj s SER 56 Cb -0.75 -1.78 -0.04 0.00 -1.71 0.00 0.00 66.02 61.74 2dzj s SER 56 CO 0.52 -0.15 0.19 -0.76 1.20 0.00 0.00 173.24 174.24 2dzj s LEU 57 N 1.43 4.38 -0.17 3.45 1.43 -1.26 -1.46 118.68 126.48 2dzj s LEU 57 Ca 0.02 0.46 -0.13 0.00 -1.03 0.00 0.00 54.13 53.45 2dzj s LEU 57 Cb -0.17 -2.41 0.05 0.00 0.03 0.00 0.00 46.19 43.70 2dzj s LEU 57 CO -0.01 0.32 0.43 -0.13 0.23 0.00 0.00 176.35 177.19 2dzj s ARG 58 N -1.51 0.46 0.56 1.70 0.52 -0.91 -0.66 118.95 119.11 2dzj s ARG 58 Ca 0.22 0.69 0.26 0.00 -0.52 0.00 0.00 55.73 56.38 2dzj s ARG 58 Cb -0.13 0.13 1.51 0.00 0.52 0.00 0.00 34.95 36.98 2dzj s ARG 58 CO 0.12 -0.10 2.06 -0.07 0.02 0.00 0.00 175.30 177.33 2dzj h LEU 59 N 6.19 0.00 -7.90 2.53 3.38 -1.85 -1.63 115.31 116.03 2dzj h LEU 59 Ca -0.31 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 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 0.26 0.00 -0.51 -1.81 0.09 0.00 0.00 178.44 176.47 2dzj s ASP 60 N -6.08 0.18 0.00 -0.43 1.01 -1.26 -4.77 116.67 105.32 2dzj s ASP 60 Ca -0.05 -0.57 0.15 0.00 0.71 0.00 0.00 52.55 52.79 2dzj s ASP 60 Cb 0.17 0.24 0.72 0.00 1.01 0.00 0.00 42.92 45.07 2dzj s ASP 60 CO 0.62 -0.55 1.42 -0.81 0.21 0.00 0.00 175.17 176.07 2dzj n PRO 61 N 0.61 0.17 -0.19 8.23 -0.04 -1.26 -2.29 135.00 140.22 2dzj n PRO 61 Ca -0.18 0.17 0.03 0.00 -0.04 0.00 0.00 63.50 63.48 2dzj n PRO 61 Cb 0.59 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.60 2dzj n PRO 61 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2dzj n LYS 62 N -1.32 0.92 0.00 0.54 -0.00 -1.26 -5.02 118.16 112.01 2dzj n LYS 62 Ca 0.06 -1.55 0.00 0.00 -0.00 0.00 0.00 58.31 56.83 2dzj n LYS 62 Cb 0.13 -0.93 0.00 0.00 -0.00 0.00 0.00 35.03 34.23 2dzj n LYS 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dzj n GLY 63 N -0.58 0.48 3.48 2.58 0.00 -0.97 -5.15 105.19 105.03 2dzj n GLY 63 Ca 0.06 0.00 -0.13 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 2.71 1.77 0.23 1.61 -0.14 -1.26 -5.02 119.74 119.64 2dzj s LYS 64 Ca 0.00 -1.64 -0.30 0.00 -1.36 0.00 0.00 55.97 52.67 2dzj s LYS 64 Cb 0.00 0.43 -0.09 0.00 -1.68 0.00 0.00 37.83 36.49 2dzj s LYS 64 CO 0.00 -0.72 1.17 0.45 -0.76 0.00 0.00 175.35 175.49 2dzj s SER 65 N -3.19 7.12 0.51 2.83 0.15 -1.26 -4.12 113.70 115.74 2dzj s SER 65 Ca 0.30 2.29 -0.17 0.00 0.70 0.00 0.00 55.95 59.07 2dzj s SER 65 Cb 0.00 -2.62 -0.08 0.00 -1.71 0.00 0.00 66.02 61.61 2dzj s SER 65 CO 0.17 -0.30 0.99 -0.76 1.20 0.00 0.00 173.24 174.53 2dzj s LEU 66 N -0.82 3.65 0.16 3.45 1.43 0.16 -4.97 118.68 121.73 2dzj s LEU 66 Ca 0.49 1.59 0.09 0.00 -1.03 0.00 0.00 54.13 55.27 2dzj s LEU 66 Cb -0.33 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.34 2dzj s LEU 66 CO 0.40 -0.59 -0.16 -0.54 0.23 0.00 0.00 176.35 175.69 2dzj s LYS 67 N -4.00 1.83 0.32 1.70 1.02 -1.26 -4.89 119.74 114.45 2dzj s LYS 67 Ca 0.59 -1.28 0.10 0.00 0.02 0.00 0.00 55.97 55.40 2dzj s LYS 67 Cb -0.10 -2.07 0.92 0.00 -0.52 0.00 0.00 37.83 36.05 2dzj s LYS 67 CO 0.30 0.45 1.70 0.38 -0.92 0.00 0.00 175.35 177.26 2dzj h ASP 68 N 3.33 0.55 -1.05 2.83 3.04 -1.96 0.19 116.42 123.35 2dzj h ASP 68 Ca -0.48 0.16 0.35 0.00 -3.24 0.00 0.00 57.03 53.81 2dzj h ASP 68 Cb 1.19 0.09 -0.15 0.00 -1.04 0.00 0.00 39.33 39.42 2dzj h ASP 68 CO 0.49 0.01 0.62 1.05 -2.04 0.00 0.00 179.24 179.37 2dzj h GLU 69 N 0.46 0.25 -7.07 4.15 4.11 -1.98 -3.30 114.58 111.20 2dzj h GLU 69 Ca 0.66 -0.02 -0.54 0.00 0.07 0.00 0.00 59.36 59.53 2dzj h GLU 69 Cb 1.33 -0.06 0.13 0.00 0.50 0.00 0.00 28.75 30.65 2dzj h GLU 69 CO -0.53 0.17 0.53 -0.51 0.07 0.00 0.00 179.01 178.74 2dzj s ASP 70 N -4.82 5.19 0.08 3.06 1.01 0.65 -4.94 116.67 116.90 2dzj s ASP 70 Ca -0.09 2.57 0.03 0.00 0.71 0.00 0.00 52.55 55.76 2dzj s ASP 70 Cb 0.30 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.58 2dzj s ASP 70 CO 0.79 -1.61 -0.08 -0.69 0.21 0.00 0.00 175.17 173.79 2dzj s VAL 71 N -1.44 0.76 -1.12 -1.27 1.01 -1.26 -2.48 120.40 114.60 2dzj s VAL 71 Ca 0.75 -1.58 0.09 0.00 0.00 0.00 0.00 61.98 61.24 2dzj s VAL 71 Cb -0.35 -1.26 0.10 0.00 0.00 0.00 0.00 36.38 34.87 2dzj s VAL 71 CO 0.40 -0.60 1.25 0.18 0.00 0.00 0.00 175.10 176.32 2dzj n LEU 72 N 0.62 0.00 -0.00 3.92 4.77 -0.99 0.05 117.00 125.38 2dzj n LEU 72 Ca -0.17 0.44 0.03 0.00 -0.03 0.00 0.00 56.01 56.29 2dzj n LEU 72 Cb 0.58 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 2dzj n LEU 72 CO 0.26 -0.31 -0.49 0.00 -1.33 0.00 0.00 177.39 175.52 2dzj n GLN 73 N -1.44 0.94 -0.04 3.23 10.64 -0.86 -4.61 117.38 125.25 2dzj n GLN 73 Ca 0.03 -0.05 -0.04 0.00 -1.83 0.00 0.00 57.00 55.10 2dzj n GLN 73 Cb 0.09 -1.11 -0.14 0.00 -0.86 0.00 0.00 30.24 28.22 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 -1.65 0.66 -1.19 2.61 5.02 -0.75 -4.97 118.16 117.90 2dzj n LYS 74 Ca -0.01 0.06 -0.34 0.00 -2.02 0.00 0.00 58.31 56.00 2dzj n LYS 74 Cb 0.17 -1.63 0.11 0.00 -0.02 0.00 0.00 35.03 33.67 2dzj n LYS 74 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 2dzj n LEU 75 N -2.74 4.07 -0.75 -0.35 -0.00 0.11 -4.81 117.00 112.53 2dzj n LEU 75 Ca -0.21 0.61 0.00 0.00 -0.00 0.00 0.00 56.01 56.41 2dzj n LEU 75 Cb 0.98 -1.47 0.00 0.00 -0.00 0.00 0.00 43.42 42.92 2dzj n LEU 75 CO 0.44 -1.83 0.18 -0.81 -0.00 0.00 0.00 177.39 175.37 2dzj n PRO 76 N -2.79 0.49 -4.56 1.47 -0.04 -1.26 -4.73 135.00 123.58 2dzj n PRO 76 Ca 0.13 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 -0.24 2.03 0.00 0.52 1.01 -1.26 -5.16 120.40 117.29 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 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.39 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 -1.01 3.95 0.27 4.51 0.00 -1.26 -4.91 105.19 106.74 2dzj n GLY 78 Ca -0.05 -2.11 0.19 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.26 -0.34 -3.10 2.61 -2.24 -1.26 -3.14 114.28 106.55 2dzj n THR 79 Ca 0.00 1.72 -0.45 0.00 -2.27 0.00 0.00 64.05 63.05 2dzj n THR 79 Cb 0.00 -2.65 -0.04 0.00 -2.10 0.00 0.00 70.33 65.54 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 -5.49 4.86 0.07 4.28 2.01 -1.26 -2.09 115.64 118.02 2dzj s THR 80 Ca -0.09 -1.17 -0.09 0.00 0.31 0.00 0.00 61.69 60.65 2dzj s THR 80 Cb 0.26 -4.53 -0.06 0.00 0.01 0.00 0.00 72.50 68.18 2dzj s THR 80 CO 0.64 -1.18 0.37 0.00 -0.69 0.00 0.00 174.62 173.76 2dzj s ALA 81 N 2.51 3.75 -0.11 7.40 0.00 -0.04 -5.00 121.76 130.28 2dzj s ALA 81 Ca 0.15 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.69 2dzj s ALA 81 Cb -0.20 -2.23 0.02 0.00 0.00 0.00 0.00 23.12 20.71 2dzj s ALA 81 CO 0.03 0.59 -0.11 0.99 0.00 0.00 0.00 175.76 177.26 2dzj s THR 82 N -1.39 1.20 0.17 0.00 2.01 -1.26 -2.23 115.64 114.14 2dzj s THR 82 Ca 0.32 -0.44 0.11 0.00 0.31 0.00 0.00 61.69 61.99 2dzj s THR 82 Cb -0.14 -1.15 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 2dzj s THR 82 CO 0.18 0.39 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.52 2dzj s LEU 83 N 1.31 2.52 -0.10 4.42 1.43 -1.21 -4.72 118.68 122.32 2dzj s LEU 83 Ca -0.02 -0.77 0.02 0.00 -1.03 0.00 0.00 54.13 52.33 2dzj s LEU 83 Cb -0.14 -1.29 -0.01 0.00 0.03 0.00 0.00 46.19 44.78 2dzj s LEU 83 CO -0.05 0.14 -0.16 -0.31 0.23 0.00 0.00 176.35 176.20 2dzj s TYR 84 N -1.49 2.72 -0.01 0.29 1.51 -0.61 -0.41 117.35 119.34 2dzj s TYR 84 Ca 0.20 -0.62 -0.12 0.00 -1.01 0.00 0.00 57.07 55.52 2dzj s TYR 84 Cb -0.09 -1.76 -0.05 0.00 -0.11 0.00 0.00 41.96 39.95 2dzj s TYR 84 CO 0.10 -0.17 0.35 0.12 -1.11 0.00 0.00 175.55 174.84 2dzj s PHE 85 N 0.10 3.67 -0.03 2.71 2.19 0.11 -2.15 117.98 124.58 2dzj s PHE 85 Ca -0.07 0.85 0.01 0.00 0.33 0.00 0.00 56.93 58.05 2dzj s PHE 85 Cb -0.15 -2.19 0.02 0.00 -1.31 0.00 0.00 43.02 39.40 2dzj s PHE 85 CO 0.05 0.64 -0.01 0.50 1.83 0.00 0.00 175.22 178.23 2dzj s ARG 86 N -1.23 0.40 0.14 10.12 6.06 -0.54 -2.14 118.95 131.77 2dzj s ARG 86 Ca 0.24 0.01 -0.30 0.00 -2.50 0.00 0.00 55.73 53.18 2dzj s ARG 86 Cb -0.15 -0.52 -0.07 0.00 0.06 0.00 0.00 34.95 34.27 2dzj s ARG 86 CO 0.12 -0.09 1.17 0.34 -2.50 0.00 0.00 175.30 174.34 2dzj s ASP 87 N 0.83 7.14 0.00 -2.12 -1.08 -1.26 -2.86 116.67 117.33 2dzj s ASP 87 Ca -0.09 2.11 0.00 0.00 -0.52 0.00 0.00 52.55 54.05 2dzj s ASP 87 Cb -0.12 -2.60 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 2dzj s ASP 87 CO -0.01 -0.36 0.45 0.18 0.52 0.00 0.00 175.17 175.95