#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddj h ALA 2 N 0.00 2.26 0.00 -1.84 0.00 -1.99 -3.39 119.26 114.29 2ddj h ALA 2 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ddj h ALA 2 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2ddj h ALA 2 CO 0.00 -0.77 0.00 0.39 0.00 0.00 0.00 179.25 178.87 2ddj n GLU 3 N -3.77 0.00 -1.62 0.00 -0.58 -1.26 -5.13 120.64 108.29 2ddj n GLU 3 Ca 0.10 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.54 2ddj n GLU 3 Cb 0.71 -0.05 0.22 0.00 -0.57 0.00 0.00 31.44 31.74 2ddj n GLU 3 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ddj n ALA 4 N -2.77 -2.07 0.45 0.62 0.00 -1.26 -4.81 120.51 110.67 2ddj n ALA 4 Ca 0.00 -1.68 -0.18 0.00 0.00 0.00 0.00 53.44 51.59 2ddj n ALA 4 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.27 2ddj n ALA 4 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2ddj h GLU 5 N 0.00 -1.11 -0.81 0.00 3.07 -1.89 0.44 114.58 114.29 2ddj h GLU 5 Ca -0.42 0.08 0.02 0.00 -0.50 0.00 0.00 59.36 58.53 2ddj h GLU 5 Cb 1.19 0.25 -0.19 0.00 -0.84 0.00 0.00 28.75 29.16 2ddj h GLU 5 CO 0.29 -0.74 -0.34 0.12 -1.40 0.00 0.00 179.01 176.94 2ddj s PHE 6 N -5.31 -1.44 -0.32 4.33 5.36 -1.26 -0.05 117.98 119.30 2ddj s PHE 6 Ca -0.17 0.43 -0.10 0.00 -0.96 0.00 0.00 56.93 56.14 2ddj s PHE 6 Cb 0.02 0.26 0.19 0.00 -0.34 0.00 0.00 43.02 43.14 2ddj s PHE 6 CO 0.50 -0.93 1.04 0.99 -1.46 0.00 0.00 175.22 175.36 2ddj s THR 7 N 2.21 -0.25 -0.34 0.12 2.01 -1.26 -4.95 115.64 113.18 2ddj s THR 7 Ca 0.15 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.17 2ddj s THR 7 Cb -0.04 -0.09 0.10 0.00 0.01 0.00 0.00 72.50 72.48 2ddj s THR 7 CO -0.14 0.00 0.10 -0.62 -0.69 0.00 0.00 174.62 173.27 2ddj s ASP 8 N 2.33 4.27 0.47 3.53 2.15 -1.26 -4.52 116.67 123.64 2ddj s ASP 8 Ca 0.19 -1.98 0.19 0.00 0.43 0.00 0.00 52.55 51.38 2ddj s ASP 8 Cb 0.01 -1.19 1.18 0.00 -0.30 0.00 0.00 42.92 42.62 2ddj s ASP 8 CO -0.18 -0.38 1.96 0.00 -0.17 0.00 0.00 175.17 176.40 2ddj h ALA 9 N 7.71 2.25 -0.26 3.66 0.00 -1.91 -1.49 119.26 129.22 2ddj h ALA 9 Ca -0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2ddj h ALA 9 Cb 1.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2ddj h ALA 9 CO 0.50 -0.42 0.02 0.00 0.00 0.00 0.00 179.25 179.34 2ddj n VAL 11 N -4.35 0.00 -3.62 0.00 0.31 -0.60 -4.35 118.33 105.72 2ddj n VAL 11 Ca 0.01 -0.15 -0.37 0.00 -0.01 0.00 0.00 64.34 63.82 2ddj n VAL 11 Cb 0.19 0.90 -0.07 0.00 -0.91 0.00 0.00 33.84 33.95 2ddj n VAL 11 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2ddj s LEU 12 N -2.64 4.34 0.86 7.52 2.96 -0.70 -5.06 118.68 125.95 2ddj s LEU 12 Ca 0.17 0.60 -0.12 0.00 -0.22 0.00 0.00 54.13 54.57 2ddj s LEU 12 Cb 0.18 -2.34 0.11 0.00 0.50 0.00 0.00 46.19 44.63 2ddj s LEU 12 CO 0.63 0.24 1.11 -2.16 -1.32 0.00 0.00 176.35 174.85 2ddj s PRO 13 N -0.31 1.57 0.40 0.98 0.04 -1.26 -4.76 135.00 131.66 2ddj s PRO 13 Ca 0.18 0.57 -0.25 0.00 0.04 0.00 0.00 61.00 61.53 2ddj s PRO 13 Cb -0.14 -1.87 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 2ddj s PRO 13 CO 0.06 -1.96 1.14 0.00 0.04 0.00 0.00 177.00 176.29 2ddj s ALA 14 N -3.14 3.14 -0.01 8.56 0.00 -1.26 -4.64 121.76 124.41 2ddj s ALA 14 Ca 0.62 0.92 0.01 0.00 0.00 0.00 0.00 51.96 53.51 2ddj s ALA 14 Cb -0.15 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2ddj s ALA 14 CO 0.55 -0.46 -0.04 0.08 0.00 0.00 0.00 175.76 175.89 2ddj s VAL 15 N -1.45 0.31 -0.07 0.00 1.01 -1.26 -5.07 120.40 113.87 2ddj s VAL 15 Ca 0.57 -0.15 -0.15 0.00 0.00 0.00 0.00 61.98 62.25 2ddj s VAL 15 Cb -0.29 -0.28 -0.11 0.00 0.00 0.00 0.00 36.38 35.70 2ddj s VAL 15 CO 0.37 0.10 0.57 1.56 0.00 0.00 0.00 175.10 177.69 2ddj h GLN 16 N 6.20 -0.20 0.00 2.72 4.20 -1.92 -3.43 115.11 122.68 2ddj h GLN 16 Ca -0.29 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.43 2ddj h GLN 16 Cb 1.19 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2ddj h GLN 16 CO 0.50 0.13 0.00 0.41 -0.67 0.00 0.00 178.83 179.20 2ddj n GLY 17 N 1.00 0.92 0.13 3.46 0.00 -1.26 -0.46 105.19 108.98 2ddj n GLY 17 Ca -0.06 -2.23 0.13 0.00 0.00 0.00 0.00 46.02 43.86 2ddj n GLY 17 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ddj h PRO 18 N 0.00 0.00 0.00 1.61 0.13 -1.92 -3.47 132.00 128.35 2ddj h PRO 18 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.71 2ddj h PRO 18 Cb 0.00 0.00 0.18 0.00 0.13 0.00 0.00 31.00 31.31 2ddj h PRO 18 CO 0.00 0.00 0.34 0.00 -0.23 0.00 0.00 178.00 178.11 2ddj n ARG 20 N -4.06 0.33 -2.54 0.00 1.74 -1.26 -4.96 116.66 105.92 2ddj n ARG 20 Ca 0.16 -0.61 -0.32 0.00 -0.77 0.00 0.00 57.85 56.32 2ddj n ARG 20 Cb 0.58 -0.80 -0.03 0.00 -1.02 0.00 0.00 32.46 31.18 2ddj n ARG 20 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2ddj s GLY 21 N -0.23 2.04 -0.06 -0.13 0.00 -1.26 -5.07 107.32 102.61 2ddj s GLY 21 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 44.72 44.82 2ddj s GLY 21 CO 0.00 0.33 -0.10 -0.98 0.00 0.00 0.00 173.10 172.35 2ddj s TRP 22 N -2.54 1.28 -0.15 1.90 0.23 -1.26 -4.28 118.94 114.13 2ddj s TRP 22 Ca 0.57 -0.46 -0.01 0.00 -2.03 0.00 0.00 56.10 54.17 2ddj s TRP 22 Cb -0.10 -0.97 0.04 0.00 0.03 0.00 0.00 33.47 32.47 2ddj s TRP 22 CO 0.31 -0.26 -0.04 -2.00 0.96 0.00 0.00 176.95 175.92 2ddj s GLU 23 N 0.74 1.26 0.24 4.98 2.56 0.15 -4.98 118.70 123.65 2ddj s GLU 23 Ca -0.13 -0.39 -0.30 0.00 0.00 0.00 0.00 54.97 54.15 2ddj s GLU 23 Cb -0.15 -1.82 -0.10 0.00 2.00 0.00 0.00 34.13 34.06 2ddj s GLU 23 CO 0.03 -0.41 1.36 -1.25 -0.56 0.00 0.00 175.26 174.42 2ddj s PRO 24 N 1.71 4.34 0.35 4.30 0.04 -1.26 -0.83 135.00 143.65 2ddj s PRO 24 Ca 0.02 2.17 0.06 0.00 0.04 0.00 0.00 61.00 63.29 2ddj s PRO 24 Cb -0.15 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2ddj s PRO 24 CO -0.07 -0.30 0.22 1.03 0.04 0.00 0.00 177.00 177.91 2ddj s ARG 25 N -0.48 1.79 -0.03 4.56 1.81 -0.52 -4.89 118.95 121.18 2ddj s ARG 25 Ca 0.56 -2.05 0.07 0.00 -1.72 0.00 0.00 55.73 52.59 2ddj s ARG 25 Cb -0.39 -0.01 -0.02 0.00 -0.45 0.00 0.00 34.95 34.09 2ddj s ARG 25 CO 0.42 -0.58 -0.25 -1.58 -0.68 0.00 0.00 175.30 172.63 2ddj s TRP 26 N -3.41 2.32 0.02 -0.53 0.52 0.47 -0.16 118.94 118.17 2ddj s TRP 26 Ca 0.35 -0.51 0.02 0.00 0.02 0.00 0.00 56.10 55.97 2ddj s TRP 26 Cb 0.03 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.83 2ddj s TRP 26 CO 0.22 -0.09 -0.07 0.00 0.02 0.00 0.00 176.95 177.03 2ddj s ALA 27 N -0.47 0.52 0.21 0.98 0.00 -0.43 -0.55 121.76 122.02 2ddj s ALA 27 Ca 0.06 -0.53 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 2ddj s ALA 27 Cb -0.11 -0.03 -0.08 0.00 0.00 0.00 0.00 23.12 22.90 2ddj s ALA 27 CO 0.00 0.04 0.99 -0.47 0.00 0.00 0.00 175.76 176.32 2ddj s TYR 28 N -0.83 3.85 -0.25 0.00 5.04 -1.26 -1.35 117.35 122.54 2ddj s TYR 28 Ca -0.05 1.83 -0.00 0.00 -2.44 0.00 0.00 57.07 56.41 2ddj s TYR 28 Cb -0.07 -3.07 0.04 0.00 0.35 0.00 0.00 41.96 39.21 2ddj s TYR 28 CO 0.00 0.14 -0.08 -1.12 -1.34 0.00 0.00 175.55 173.15 2ddj s SER 29 N -0.78 4.31 0.29 4.32 0.01 0.38 -4.81 113.70 117.42 2ddj s SER 29 Ca 0.44 -1.07 0.04 0.00 1.31 0.00 0.00 55.95 56.67 2ddj s SER 29 Cb -0.27 -1.62 0.43 0.00 0.21 0.00 0.00 66.02 64.78 2ddj s SER 29 CO 0.33 -0.15 1.71 1.55 0.41 0.00 0.00 173.24 177.09 2ddj h PRO 30 N 7.93 0.38 0.00 12.44 0.13 -1.82 0.54 132.00 151.61 2ddj h PRO 30 Ca -0.28 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2ddj h PRO 30 Cb 1.08 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2ddj h PRO 30 CO 0.54 0.66 0.00 1.28 -0.23 0.00 0.00 178.00 180.26 2ddj n LEU 31 N -4.09 0.47 -0.14 1.56 4.77 -1.26 -1.28 117.00 117.04 2ddj n LEU 31 Ca -0.01 0.65 0.03 0.00 -0.03 0.00 0.00 56.01 56.65 2ddj n LEU 31 Cb 0.43 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2ddj n LEU 31 CO 0.42 -0.62 0.20 0.18 -1.33 0.00 0.00 177.39 176.23 2ddj n LEU 32 N -2.06 0.98 -3.38 2.23 4.77 -0.89 -5.00 117.00 113.66 2ddj n LEU 32 Ca 0.01 -0.80 -0.23 0.00 -0.03 0.00 0.00 56.01 54.97 2ddj n LEU 32 Cb 0.14 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.22 2ddj n LEU 32 CO 0.14 0.21 -0.05 1.67 -1.33 0.00 0.00 177.39 178.02 2ddj n GLN 33 N -0.26 -2.95 -3.67 3.23 7.27 0.10 -4.89 117.38 116.21 2ddj n GLN 33 Ca 0.02 0.38 -0.08 0.00 0.07 0.00 0.00 57.00 57.39 2ddj n GLN 33 Cb 0.12 -5.04 -0.02 0.00 2.41 0.00 0.00 30.24 27.71 2ddj n GLN 33 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2ddj s GLN 34 N -6.01 1.40 0.34 3.69 2.00 -0.70 -4.75 119.66 115.63 2ddj s GLN 34 Ca 0.39 -0.68 -0.04 0.00 -2.00 0.00 0.00 55.36 53.03 2ddj s GLN 34 Cb -0.21 0.53 -0.05 0.00 0.80 0.00 0.00 33.01 34.08 2ddj s GLN 34 CO 0.48 -0.63 0.60 0.00 -0.50 0.00 0.00 175.29 175.24 2ddj s HIS 36 N -2.25 -0.18 0.95 0.00 -3.43 -0.46 -4.92 115.29 105.00 2ddj s HIS 36 Ca 0.44 0.10 -0.11 0.00 -0.80 0.00 0.00 55.06 54.70 2ddj s HIS 36 Cb -0.10 0.15 0.16 0.00 -1.43 0.00 0.00 32.58 31.37 2ddj s HIS 36 CO 0.34 -0.53 1.12 -2.14 -2.00 0.00 0.00 174.74 171.52 2ddj s PRO 37 N -2.47 0.75 0.20 -0.38 0.02 -1.26 -1.31 135.00 130.55 2ddj s PRO 37 Ca -0.05 1.34 -0.23 0.00 0.02 0.00 0.00 61.00 62.08 2ddj s PRO 37 Cb -0.01 -1.71 0.05 0.00 0.02 0.00 0.00 34.50 32.85 2ddj s PRO 37 CO -0.03 -2.75 0.74 -0.59 -0.33 0.00 0.00 177.00 174.05 2ddj s PHE 38 N -2.65 -0.29 -0.18 6.54 -0.71 0.77 -4.78 117.98 116.68 2ddj s PHE 38 Ca 0.66 -0.04 -0.23 0.00 -1.04 0.00 0.00 56.93 56.29 2ddj s PHE 38 Cb -0.22 0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 42.20 2ddj s PHE 38 CO 0.59 -0.99 0.71 0.08 -1.34 0.00 0.00 175.22 174.27 2ddj s VAL 39 N -3.69 4.97 0.31 -2.49 1.01 -1.26 -1.43 120.40 117.81 2ddj s VAL 39 Ca 0.08 1.37 0.10 0.00 0.00 0.00 0.00 61.98 63.53 2ddj s VAL 39 Cb -0.03 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 2ddj s VAL 39 CO -0.01 0.09 -0.04 -0.47 0.00 0.00 0.00 175.10 174.67 2ddj s TYR 40 N 1.93 2.53 -2.75 5.22 5.04 -0.01 -4.46 117.35 124.85 2ddj s TYR 40 Ca 0.33 -0.35 0.23 0.00 -2.44 0.00 0.00 57.07 54.84 2ddj s TYR 40 Cb -0.16 -1.29 0.28 0.00 0.35 0.00 0.00 41.96 41.13 2ddj s TYR 40 CO 0.11 0.57 1.31 0.41 -1.34 0.00 0.00 175.55 176.61 2ddj n GLY 41 N -0.86 1.26 4.17 8.97 0.00 0.39 -0.68 105.19 118.45 2ddj n GLY 41 Ca -0.05 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2ddj n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddj n GLY 42 N 1.39 1.78 1.13 -0.02 0.00 -1.26 -4.48 105.19 103.73 2ddj n GLY 42 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 2ddj n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddj n GLU 44 N -1.60 0.00 -3.88 0.00 4.71 -1.26 -4.86 120.64 113.76 2ddj n GLU 44 Ca 0.05 0.00 -0.03 0.00 -0.01 0.00 0.00 57.16 57.17 2ddj n GLU 44 Cb 0.17 -0.94 0.02 0.00 -1.01 0.00 0.00 31.44 29.68 2ddj n GLU 44 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2ddj s GLY 45 N -0.25 0.11 0.71 0.62 0.00 -1.26 -3.97 107.32 103.27 2ddj s GLY 45 Ca 0.58 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.98 2ddj s GLY 45 CO 0.40 2.39 0.98 -1.31 0.00 0.00 0.00 173.10 175.56 2ddj s ASN 46 N -3.40 4.39 0.00 1.64 -0.87 -1.26 -5.02 114.94 110.42 2ddj s ASN 46 Ca 0.22 -0.55 0.21 0.00 -1.57 0.00 0.00 52.86 51.17 2ddj s ASN 46 Cb -0.03 0.21 0.91 0.00 -0.02 0.00 0.00 41.25 42.32 2ddj s ASN 46 CO 0.05 -1.85 1.67 0.61 -2.57 0.00 0.00 177.10 175.01 2ddj n GLY 47 N -2.76 -1.19 3.16 0.66 0.00 -1.26 -4.17 105.19 99.64 2ddj n GLY 47 Ca 0.16 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2ddj n GLY 47 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ddj n ASN 48 N -1.47 5.07 -3.52 1.61 2.85 -1.26 -4.84 115.26 113.70 2ddj n ASN 48 Ca 0.06 -3.03 -0.15 0.00 -0.11 0.00 0.00 54.58 51.35 2ddj n ASN 48 Cb 0.23 -1.54 -0.12 0.00 1.24 0.00 0.00 39.78 39.59 2ddj n ASN 48 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2ddj s ASN 49 N 2.03 0.86 0.08 1.20 3.84 -1.26 -4.66 114.94 117.03 2ddj s ASN 49 Ca 0.42 0.11 0.06 0.00 0.21 0.00 0.00 52.86 53.67 2ddj s ASN 49 Cb 0.04 0.61 -0.03 0.00 -0.55 0.00 0.00 41.25 41.32 2ddj s ASN 49 CO 0.00 -0.29 -0.17 -0.36 -2.79 0.00 0.00 177.10 173.49 2ddj s PHE 50 N 2.39 1.49 -1.87 0.43 0.08 0.28 -4.95 117.98 115.84 2ddj s PHE 50 Ca 0.06 -0.42 0.25 0.00 0.12 0.00 0.00 56.93 56.94 2ddj s PHE 50 Cb -0.15 -0.84 0.48 0.00 -0.57 0.00 0.00 43.02 41.95 2ddj s PHE 50 CO -0.12 0.12 1.40 0.72 -0.10 0.00 0.00 175.22 177.24 2ddj n HIS 51 N 1.33 0.00 -3.73 0.36 8.25 -1.26 -0.40 115.22 119.78 2ddj n HIS 51 Ca -0.20 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.18 2ddj n HIS 51 Cb 0.54 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 2ddj n HIS 51 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2ddj s SER 52 N -2.49 -0.34 0.09 0.41 1.04 -1.26 -4.86 113.70 106.29 2ddj s SER 52 Ca 0.22 -0.44 -0.30 0.00 0.48 0.00 0.00 55.95 55.92 2ddj s SER 52 Cb 0.19 0.68 -0.15 0.00 0.10 0.00 0.00 66.02 66.84 2ddj s SER 52 CO 0.54 -1.21 1.64 -0.09 0.98 0.00 0.00 173.24 175.10 2ddj h ARG 53 N 2.02 -0.61 -0.23 4.02 9.65 -1.98 -2.70 114.38 124.55 2ddj h ARG 53 Ca -0.24 0.04 0.02 0.00 -1.10 0.00 0.00 59.98 58.70 2ddj h ARG 53 Cb 1.27 0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 29.95 2ddj h ARG 53 CO 0.29 -0.40 -0.19 1.49 2.80 0.00 0.00 179.97 183.95 2ddj h GLU 54 N -0.63 -0.07 -0.43 0.20 4.81 -1.98 -0.48 114.58 116.00 2ddj h GLU 54 Ca -0.03 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 2ddj h GLU 54 Cb 0.54 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2ddj h GLU 54 CO 0.01 -0.05 0.29 0.66 -0.73 0.00 0.00 179.01 179.19 2ddj h SER 55 N -0.08 0.41 -0.20 1.04 4.64 -1.96 0.10 113.55 117.51 2ddj h SER 55 Ca 0.04 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 2ddj h SER 55 Cb 0.17 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2ddj h SER 55 CO -0.25 0.29 -0.04 0.00 -0.87 0.00 0.00 176.83 175.95 2ddj h GLU 57 N 0.10 0.56 -0.54 0.00 5.08 -0.12 -0.12 114.58 119.55 2ddj h GLU 57 Ca 0.05 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ddj h GLU 57 Cb 0.48 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2ddj h GLU 57 CO 0.02 0.43 0.33 0.22 -1.00 0.00 0.00 179.01 179.00 2ddj h ASP 58 N 0.57 0.65 0.89 1.42 3.58 -0.79 -3.15 116.42 119.59 2ddj h ASP 58 Ca 0.15 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 2ddj h ASP 58 Cb 0.04 -0.16 0.01 0.00 1.72 0.00 0.00 39.33 40.93 2ddj h ASP 58 CO -0.02 0.52 -0.43 0.00 -2.88 0.00 0.00 179.24 176.43 2ddj h ALA 59 N 1.16 -1.24 -2.69 -0.78 0.00 -0.20 -3.45 119.26 112.06 2ddj h ALA 59 Ca 0.19 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2ddj h ALA 59 Cb -0.01 0.46 -0.13 0.00 0.00 0.00 0.00 17.79 18.11 2ddj h ALA 59 CO -0.04 -1.16 -0.16 0.00 0.00 0.00 0.00 179.25 177.90 2ddj s PRO 61 N -3.83 3.09 0.00 0.00 0.04 -1.26 -3.74 135.00 129.30 2ddj s PRO 61 Ca 0.04 0.27 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2ddj s PRO 61 Cb 0.03 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.35 2ddj s PRO 61 CO -0.11 -2.22 0.00 0.28 0.04 0.00 0.00 177.00 174.99 2ddj n VAL 62 N 6.79 0.00 -4.25 -0.36 0.31 -1.26 -5.06 118.33 114.50 2ddj n VAL 62 Ca 0.11 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.22 2ddj n VAL 62 Cb 0.50 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.36 2ddj n VAL 62 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2ddj s VAL 63 N -2.19 3.67 0.10 2.52 1.01 -1.26 -5.07 120.40 119.18 2ddj s VAL 63 Ca 0.00 -1.80 -0.36 0.00 0.00 0.00 0.00 61.98 59.82 2ddj s VAL 63 Cb 0.00 -2.97 -0.15 0.00 0.00 0.00 0.00 36.38 33.26 2ddj s VAL 63 CO 0.00 -0.37 1.47 -0.67 0.00 0.00 0.00 175.10 175.54 2ddj n ASP 64 N -0.96 2.35 -4.56 3.32 2.03 -1.26 -4.81 116.55 112.67 2ddj n ASP 64 Ca -0.07 1.10 -0.33 0.00 0.52 0.00 0.00 54.79 56.01 2ddj n ASP 64 Cb 0.59 -1.30 -0.04 0.00 -0.72 0.00 0.00 41.12 39.65 2ddj n ASP 64 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2ddj s HIS 65 N 0.89 1.99 -0.28 -0.67 3.76 -1.26 -4.77 115.29 114.96 2ddj s HIS 65 Ca 0.83 0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 55.96 2ddj s HIS 65 Cb -0.83 -4.26 -0.09 0.00 1.11 0.00 0.00 32.58 28.51 2ddj s HIS 65 CO 0.44 -1.92 0.95 1.58 -0.85 0.00 0.00 174.74 174.93 2ddj n HIS 66 N 12.15 0.00 -0.07 1.40 -0.00 -1.26 -4.81 115.22 122.62 2ddj n HIS 66 Ca 0.32 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.50 2ddj n HIS 66 Cb 0.49 -0.31 0.00 0.00 -0.12 0.00 0.00 29.99 30.05 2ddj n HIS 66 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2ddj n HIS 67 N 3.11 0.00 -0.86 1.57 8.25 -1.26 -4.89 115.22 121.14 2ddj n HIS 67 Ca 0.19 -0.50 -0.31 0.00 -0.26 0.00 0.00 57.72 56.84 2ddj n HIS 67 Cb 0.21 -0.34 0.15 0.00 1.12 0.00 0.00 29.99 31.13 2ddj n HIS 67 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2ddj s HIS 68 N 0.75 1.86 1.14 4.41 -3.43 -1.26 -4.60 115.29 114.16 2ddj s HIS 68 Ca 0.00 1.73 -0.16 0.00 -0.80 0.00 0.00 55.06 55.84 2ddj s HIS 68 Cb 0.00 -3.28 0.19 0.00 -1.43 0.00 0.00 32.58 28.05 2ddj s HIS 68 CO 0.00 -2.57 0.47 1.58 -2.00 0.00 0.00 174.74 172.22 2ddj n HIS 69 N -4.01 -1.34 -0.85 0.38 -0.00 -1.26 -5.01 115.22 103.13 2ddj n HIS 69 Ca 0.11 0.01 0.00 0.00 0.46 0.00 0.00 57.72 58.31 2ddj n HIS 69 Cb 0.52 -1.63 0.00 0.00 -0.12 0.00 0.00 29.99 28.76 2ddj n HIS 69 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38