#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dgj s GLU 2 N 0.00 0.86 -0.02 0.03 -1.05 -0.94 -5.04 118.70 112.54 1dgj s GLU 2 Ca 0.00 -0.08 -0.17 0.00 -0.15 0.00 0.00 54.97 54.57 1dgj s GLU 2 Cb 0.00 0.39 -0.05 0.00 -0.44 0.00 0.00 34.13 34.03 1dgj s GLU 2 CO 0.00 -0.26 0.48 0.95 0.95 0.00 0.00 175.26 177.38 1dgj s THR 3 N -1.54 4.99 -0.11 1.83 -4.23 -1.26 -2.02 115.64 113.30 1dgj s THR 3 Ca -0.11 1.00 0.02 0.00 -1.18 0.00 0.00 61.69 61.42 1dgj s THR 3 Cb -0.03 -3.81 0.01 0.00 1.34 0.00 0.00 72.50 70.02 1dgj s THR 3 CO 0.05 0.49 -0.16 -0.75 -0.54 0.00 0.00 174.62 173.70 1dgj s LYS 4 N -0.52 2.31 -0.31 3.99 2.20 0.72 -4.91 119.74 123.22 1dgj s LYS 4 Ca 0.26 -0.60 -0.18 0.00 -0.36 0.00 0.00 55.97 55.09 1dgj s LYS 4 Cb -0.17 -1.94 -0.01 0.00 -1.51 0.00 0.00 37.83 34.20 1dgj s LYS 4 CO 0.14 -0.04 0.52 0.99 -0.36 0.00 0.00 175.35 176.60 1dgj s THR 5 N 0.92 5.03 -0.01 3.43 2.01 -1.26 -0.29 115.64 125.47 1dgj s THR 5 Ca -0.08 0.58 0.03 0.00 0.31 0.00 0.00 61.69 62.53 1dgj s THR 5 Cb -0.15 -3.92 -0.00 0.00 0.01 0.00 0.00 72.50 68.44 1dgj s THR 5 CO -0.01 -0.10 -0.09 -1.48 -0.69 0.00 0.00 174.62 172.25 1dgj s LEU 6 N 2.39 1.95 -0.69 4.42 0.05 -0.01 0.11 118.68 126.91 1dgj s LEU 6 Ca 0.20 -0.17 -0.27 0.00 0.05 0.00 0.00 54.13 53.94 1dgj s LEU 6 Cb -0.15 -0.49 0.03 0.00 -2.05 0.00 0.00 46.19 43.53 1dgj s LEU 6 CO 0.12 0.10 1.29 -0.63 -0.55 0.00 0.00 176.35 176.67 1dgj s ILE 7 N -0.11 3.78 -0.34 1.48 1.01 -0.57 -1.79 121.20 124.66 1dgj s ILE 7 Ca 0.02 0.54 -0.13 0.00 0.00 0.00 0.00 60.65 61.08 1dgj s ILE 7 Cb -0.05 -4.81 -0.02 0.00 0.01 0.00 0.00 42.46 37.59 1dgj s ILE 7 CO -0.00 -1.66 0.24 -0.69 0.00 0.00 0.00 174.94 172.82 1dgj s VAL 8 N 5.69 5.25 -1.36 2.92 1.01 0.64 -1.23 120.40 133.32 1dgj s VAL 8 Ca 0.39 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 1dgj s VAL 8 Cb -0.08 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1dgj s VAL 8 CO 0.18 -0.01 0.78 0.59 0.00 0.00 0.00 175.10 176.64 1dgj n ASN 9 N 5.10 -2.16 0.00 3.32 3.02 -0.68 -2.44 115.26 121.42 1dgj n ASN 9 Ca -0.13 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 1dgj n ASN 9 Cb 0.50 -4.03 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 1dgj n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dgj n GLY 10 N -1.62 1.56 3.20 7.41 0.00 -1.26 -4.95 105.19 109.53 1dgj n GLY 10 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1dgj n GLY 10 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dgj s MET 11 N -0.46 2.22 0.64 1.61 -1.94 -1.02 -5.09 119.30 115.26 1dgj s MET 11 Ca 0.00 -0.75 -0.17 0.00 -1.71 0.00 0.00 55.69 53.05 1dgj s MET 11 Cb 0.00 -1.87 -0.01 0.00 2.01 0.00 0.00 34.83 34.96 1dgj s MET 11 CO 0.00 0.29 1.21 0.00 -0.01 0.00 0.00 175.02 176.51 1dgj s ALA 12 N -0.00 2.40 -0.19 3.03 0.00 -1.26 -0.26 121.76 125.47 1dgj s ALA 12 Ca -0.05 0.95 -0.08 0.00 0.00 0.00 0.00 51.96 52.78 1dgj s ALA 12 Cb -0.13 -3.46 0.08 0.00 0.00 0.00 0.00 23.12 19.62 1dgj s ALA 12 CO 0.03 -1.42 0.42 1.03 0.00 0.00 0.00 175.76 175.82 1dgj s ARG 13 N -3.57 0.34 -0.27 0.00 1.81 -0.74 -4.80 118.95 111.72 1dgj s ARG 13 Ca 0.76 0.99 -0.16 0.00 -1.72 0.00 0.00 55.73 55.59 1dgj s ARG 13 Cb -0.30 0.25 -0.03 0.00 -0.45 0.00 0.00 34.95 34.42 1dgj s ARG 13 CO 0.38 -0.23 0.45 1.03 -0.68 0.00 0.00 175.30 176.25 1dgj s ARG 14 N 2.33 4.02 -0.08 3.54 0.52 -1.26 -0.83 118.95 127.19 1dgj s ARG 14 Ca -0.04 0.16 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 1dgj s ARG 14 Cb -0.11 -3.66 -0.02 0.00 0.52 0.00 0.00 34.95 31.67 1dgj s ARG 14 CO -0.13 -0.33 -0.11 -0.51 0.02 0.00 0.00 175.30 174.24 1dgj s LEU 15 N 2.20 2.92 -0.73 2.53 1.43 0.61 -4.91 118.68 122.72 1dgj s LEU 15 Ca 0.18 -0.16 -0.20 0.00 -1.03 0.00 0.00 54.13 52.92 1dgj s LEU 15 Cb -0.16 -1.63 0.10 0.00 0.03 0.00 0.00 46.19 44.53 1dgj s LEU 15 CO 0.10 0.29 0.94 -0.22 0.23 0.00 0.00 176.35 177.69 1dgj s LEU 16 N -0.42 4.92 0.52 1.79 0.20 -1.26 -0.20 118.68 124.23 1dgj s LEU 16 Ca 0.05 -1.47 0.01 0.00 0.69 0.00 0.00 54.13 53.41 1dgj s LEU 16 Cb -0.12 -2.38 -0.01 0.00 -0.43 0.00 0.00 46.19 43.26 1dgj s LEU 16 CO 0.02 -1.22 0.01 0.68 -0.29 0.00 0.00 176.35 175.55 1dgj s VAL 17 N 3.17 1.12 -0.12 1.68 -7.23 -0.86 -4.97 120.40 113.18 1dgj s VAL 17 Ca 0.22 -1.99 -0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1dgj s VAL 17 Cb -0.15 -2.10 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 1dgj s VAL 17 CO 0.03 0.00 -0.09 -0.55 -0.31 0.00 0.00 175.10 174.18 1dgj s SER 18 N -3.90 4.37 0.46 4.85 0.15 -1.26 -2.21 113.70 116.15 1dgj s SER 18 Ca 0.04 -0.20 0.19 0.00 0.70 0.00 0.00 55.95 56.69 1dgj s SER 18 Cb 0.01 -1.52 1.05 0.00 -1.71 0.00 0.00 66.02 63.85 1dgj s SER 18 CO 0.02 0.22 1.53 -0.65 1.20 0.00 0.00 173.24 175.56 1dgj h PRO 19 N 6.33 0.00 -0.09 5.44 0.11 -1.92 0.38 132.00 142.25 1dgj h PRO 19 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1dgj h PRO 19 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1dgj h PRO 19 CO 0.57 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.45 1dgj n ASN 20 N -2.38 2.95 -4.77 -2.05 3.02 -1.26 -0.88 115.26 109.89 1dgj n ASN 20 Ca -0.01 -1.96 -0.35 0.00 -0.03 0.00 0.00 54.58 52.22 1dgj n ASN 20 Cb 0.35 -0.04 0.01 0.00 -0.61 0.00 0.00 39.78 39.48 1dgj n ASN 20 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1dgj s ASP 21 N -1.92 5.67 -0.04 6.41 1.01 0.12 -4.68 116.67 123.24 1dgj s ASP 21 Ca 0.30 2.22 -0.18 0.00 0.71 0.00 0.00 52.55 55.61 1dgj s ASP 21 Cb 0.20 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 1dgj s ASP 21 CO 0.30 -1.26 0.49 -0.76 0.21 0.00 0.00 175.17 174.15 1dgj s LEU 22 N -3.79 4.40 0.35 1.23 1.43 -1.26 0.59 118.68 121.63 1dgj s LEU 22 Ca 0.73 0.98 0.13 0.00 -1.03 0.00 0.00 54.13 54.94 1dgj s LEU 22 Cb -0.25 -2.72 0.97 0.00 0.03 0.00 0.00 46.19 44.22 1dgj s LEU 22 CO 0.28 0.16 1.75 0.25 0.23 0.00 0.00 176.35 179.03 1dgj h LEU 23 N 5.60 0.58 -0.94 1.79 5.85 -0.92 -0.03 115.31 127.24 1dgj h LEU 23 Ca -0.46 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 1dgj h LEU 23 Cb 1.20 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1dgj h LEU 23 CO 0.68 0.11 0.45 1.62 -0.34 0.00 0.00 178.44 180.96 1dgj h VAL 24 N 0.51 1.25 -0.19 1.05 3.04 -1.31 -0.41 116.25 120.19 1dgj h VAL 24 Ca 0.62 -0.66 -0.18 0.00 -1.01 0.00 0.00 66.70 65.47 1dgj h VAL 24 Cb 1.33 0.12 -0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1dgj h VAL 24 CO -0.39 0.29 -0.62 0.44 -1.01 0.00 0.00 177.57 176.29 1dgj h ASP 25 N 1.20 0.75 0.44 3.17 3.32 -1.32 -2.07 116.42 121.90 1dgj h ASP 25 Ca 0.30 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 1dgj h ASP 25 Cb 0.06 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1dgj h ASP 25 CO -0.04 1.18 -0.21 0.58 -1.72 0.00 0.00 179.24 179.03 1dgj h VAL 26 N 0.49 0.57 -0.51 -1.35 2.07 -0.90 0.30 116.25 116.92 1dgj h VAL 26 Ca -0.01 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.45 1dgj h VAL 26 Cb 1.20 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1dgj h VAL 26 CO 0.12 0.02 0.34 -0.07 0.02 0.00 0.00 177.57 178.01 1dgj h LEU 27 N -0.66 0.43 0.00 2.57 3.38 -1.08 -0.84 115.31 119.11 1dgj h LEU 27 Ca -0.06 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1dgj h LEU 27 Cb 0.49 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1dgj h LEU 27 CO 0.10 0.28 -0.27 0.03 0.09 0.00 0.00 178.44 178.67 1dgj h ARG 28 N 0.49 0.00 -0.11 1.13 3.08 -1.22 -0.97 114.38 116.78 1dgj h ARG 28 Ca 0.22 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.14 1dgj h ARG 28 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1dgj h ARG 28 CO -0.06 0.16 -0.49 0.77 -1.07 0.00 0.00 179.97 179.28 1dgj h SER 29 N -1.00 0.30 0.00 7.04 0.02 -0.39 -1.22 113.55 118.30 1dgj h SER 29 Ca -0.03 -0.15 -0.32 0.00 -0.84 0.00 0.00 61.79 60.46 1dgj h SER 29 Cb 0.37 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.76 1dgj h SER 29 CO -0.02 0.75 -2.20 0.00 -1.14 0.00 0.00 176.83 174.22 1dgj n GLN 30 N -3.96 1.02 0.00 3.45 6.02 -0.34 -4.58 117.38 118.99 1dgj n GLN 30 Ca -0.02 0.03 0.08 0.00 -0.01 0.00 0.00 57.00 57.08 1dgj n GLN 30 Cb 0.54 -1.44 0.06 0.00 1.02 0.00 0.00 30.24 30.42 1dgj n GLN 30 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1dgj n LEU 31 N -2.77 2.27 -3.50 1.08 4.77 -1.10 -4.99 117.00 112.76 1dgj n LEU 31 Ca -0.31 -0.96 -0.25 0.00 -0.03 0.00 0.00 56.01 54.47 1dgj n LEU 31 Cb 1.02 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.10 1dgj n LEU 31 CO 0.33 0.41 -0.05 1.67 -1.33 0.00 0.00 177.39 178.42 1dgj n GLN 32 N 0.76 -3.04 -1.80 3.23 7.27 -0.46 -4.86 117.38 118.48 1dgj n GLN 32 Ca 0.09 0.39 -0.36 0.00 0.07 0.00 0.00 57.00 57.19 1dgj n GLN 32 Cb 0.41 -5.06 -0.02 0.00 2.41 0.00 0.00 30.24 27.97 1dgj n GLN 32 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1dgj n LEU 33 N -3.72 7.67 0.00 1.69 4.77 -0.39 -4.81 117.00 122.22 1dgj n LEU 33 Ca 0.01 -4.62 0.00 0.00 -0.03 0.00 0.00 56.01 51.37 1dgj n LEU 33 Cb 0.52 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 1dgj n LEU 33 CO 0.55 1.98 0.46 0.35 -1.33 0.00 0.00 177.39 179.40 1dgj n THR 34 N 1.69 0.82 0.22 -5.08 -2.24 -1.26 -2.01 114.28 106.41 1dgj n THR 34 Ca 0.60 0.44 0.07 0.00 -2.27 0.00 0.00 64.05 62.89 1dgj n THR 34 Cb 0.33 -1.44 0.49 0.00 -2.10 0.00 0.00 70.33 67.61 1dgj n THR 34 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1dgj h SER 35 N 0.00 0.00 -3.32 3.42 4.64 -1.87 -3.39 113.55 113.03 1dgj h SER 35 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1dgj h SER 35 Cb 0.48 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.51 1dgj h SER 35 CO 0.00 0.27 1.02 -0.69 -0.87 0.00 0.00 176.83 176.56 1dgj s VAL 36 N -4.13 3.98 0.33 0.95 1.01 -0.85 -4.72 120.40 116.98 1dgj s VAL 36 Ca -0.02 0.96 -0.00 0.00 0.00 0.00 0.00 61.98 62.92 1dgj s VAL 36 Cb 0.13 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 1dgj s VAL 36 CO 0.67 -0.99 0.54 -0.54 0.00 0.00 0.00 175.10 174.77 1dgj s LYS 37 N 4.91 3.50 -0.36 2.72 -0.14 -1.19 -4.92 119.74 124.27 1dgj s LYS 37 Ca 0.53 -0.30 -0.01 0.00 -1.36 0.00 0.00 55.97 54.84 1dgj s LYS 37 Cb -0.10 -2.67 0.09 0.00 -1.68 0.00 0.00 37.83 33.47 1dgj s LYS 37 CO 0.30 0.17 0.10 0.08 -0.76 0.00 0.00 175.35 175.25 1dgj s VAL 38 N -2.26 2.91 0.00 3.17 1.01 -1.26 -2.88 120.40 121.09 1dgj s VAL 38 Ca 0.40 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.43 1dgj s VAL 38 Cb -0.10 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1dgj s VAL 38 CO 0.35 -0.50 0.00 0.61 0.00 0.00 0.00 175.10 175.56 1dgj n GLY 39 N 4.51 0.73 0.22 4.51 0.00 -1.26 -4.77 105.19 109.13 1dgj n GLY 39 Ca -0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 1dgj n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj n GLY 41 N 0.06 0.52 0.30 0.00 0.00 -1.26 -4.39 105.19 100.42 1dgj n GLY 41 Ca -0.02 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.66 1dgj n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgj n LYS 42 N -2.53 0.56 -1.24 1.61 5.02 -1.26 -4.90 118.16 115.42 1dgj n LYS 42 Ca -0.02 -1.51 -0.08 0.00 -2.02 0.00 0.00 58.31 54.68 1dgj n LYS 42 Cb 0.10 -0.86 -0.04 0.00 -0.02 0.00 0.00 35.03 34.22 1dgj n LYS 42 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dgj n GLY 43 N -0.50 1.01 0.13 0.72 0.00 -1.26 -4.93 105.19 100.36 1dgj n GLY 43 Ca 0.05 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 1dgj n GLY 43 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dgj n GLN 44 N -2.61 0.68 0.20 1.61 6.02 -1.26 -4.56 117.38 117.46 1dgj n GLN 44 Ca -0.08 0.19 0.11 0.00 -0.01 0.00 0.00 57.00 57.21 1dgj n GLN 44 Cb 0.29 -1.58 0.14 0.00 1.02 0.00 0.00 30.24 30.11 1dgj n GLN 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dgj n GLY 46 N 1.12 0.58 0.15 0.00 0.00 -0.76 -1.86 105.19 104.42 1dgj n GLY 46 Ca 0.03 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1dgj n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj h ALA 47 N 0.00 1.00 -0.45 4.61 0.00 -1.85 -2.79 119.26 119.78 1dgj h ALA 47 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1dgj h ALA 47 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1dgj h ALA 47 CO 0.15 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1dgj n THR 49 N 0.38 0.20 -4.24 0.00 -1.04 -1.05 -2.66 114.28 105.87 1dgj n THR 49 Ca 0.22 -0.04 -0.14 0.00 -2.04 0.00 0.00 64.05 62.06 1dgj n THR 49 Cb 0.85 -1.49 -0.10 0.00 -1.82 0.00 0.00 70.33 67.78 1dgj n THR 49 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1dgj s VAL 50 N 2.05 0.73 -0.35 12.58 -7.23 -0.06 -4.67 120.40 123.45 1dgj s VAL 50 Ca 0.86 -1.99 -0.10 0.00 -1.81 0.00 0.00 61.98 58.94 1dgj s VAL 50 Cb -0.77 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.08 1dgj s VAL 50 CO 0.46 -0.49 0.18 -0.63 -0.31 0.00 0.00 175.10 174.31 1dgj s ILE 51 N -3.62 4.56 -0.33 -0.62 1.01 -0.64 -1.15 121.20 120.41 1dgj s ILE 51 Ca 0.23 -0.69 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 1dgj s ILE 51 Cb 0.06 -3.46 0.04 0.00 0.01 0.00 0.00 42.46 39.11 1dgj s ILE 51 CO 0.04 -0.11 0.09 -0.22 0.00 0.00 0.00 174.94 174.74 1dgj s LEU 52 N 1.57 4.24 -1.27 2.97 2.96 0.89 -0.68 118.68 129.36 1dgj s LEU 52 Ca 0.03 -1.14 -0.05 0.00 -0.22 0.00 0.00 54.13 52.74 1dgj s LEU 52 Cb -0.18 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 1dgj s LEU 52 CO 0.06 -0.31 0.68 0.47 -1.32 0.00 0.00 176.35 175.94 1dgj n ASP 53 N 4.79 -2.38 0.00 3.68 8.00 -0.28 -1.76 116.55 128.59 1dgj n ASP 53 Ca -0.13 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1dgj n ASP 53 Cb 0.45 -3.80 0.00 0.00 -0.02 0.00 0.00 41.12 37.75 1dgj n ASP 53 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dgj n GLY 54 N -1.65 2.56 3.80 0.44 0.00 -1.26 -4.98 105.19 104.09 1dgj n GLY 54 Ca -0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 1dgj n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgj s LYS 55 N 0.00 4.08 -0.37 1.61 -0.14 -0.72 -5.05 119.74 119.15 1dgj s LYS 55 Ca 0.00 0.43 -0.25 0.00 -1.36 0.00 0.00 55.97 54.79 1dgj s LYS 55 Cb 0.00 -3.29 0.01 0.00 -1.68 0.00 0.00 37.83 32.87 1dgj s LYS 55 CO 0.00 0.52 0.88 0.08 -0.76 0.00 0.00 175.35 176.07 1dgj s VAL 56 N -0.53 4.63 0.25 3.17 1.01 -1.26 -0.08 120.40 127.59 1dgj s VAL 56 Ca 0.24 1.10 0.05 0.00 0.00 0.00 0.00 61.98 63.37 1dgj s VAL 56 Cb -0.16 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 1dgj s VAL 56 CO 0.12 -0.50 -0.03 0.68 0.00 0.00 0.00 175.10 175.37 1dgj s VAL 57 N 3.35 1.32 -0.52 2.92 -7.23 -0.30 -4.97 120.40 114.97 1dgj s VAL 57 Ca 0.36 -2.08 -0.14 0.00 -1.81 0.00 0.00 61.98 58.31 1dgj s VAL 57 Cb -0.12 -2.36 0.13 0.00 0.56 0.00 0.00 36.38 34.58 1dgj s VAL 57 CO 0.18 -0.34 0.46 -0.13 -0.31 0.00 0.00 175.10 174.96 1dgj s ARG 58 N -3.79 2.85 0.25 4.82 0.52 -1.26 -0.88 118.95 121.46 1dgj s ARG 58 Ca 0.28 -1.72 0.10 0.00 -0.52 0.00 0.00 55.73 53.87 1dgj s ARG 58 Cb 0.05 -4.20 0.55 0.00 0.52 0.00 0.00 34.95 31.86 1dgj s ARG 58 CO 0.10 -1.29 1.18 0.00 0.02 0.00 0.00 175.30 175.31 1dgj n ALA 59 N 5.16 0.63 0.23 2.13 0.00 -1.09 -1.71 120.51 125.86 1dgj n ALA 59 Ca -0.12 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.53 1dgj n ALA 59 Cb 0.40 -0.75 0.17 0.00 0.00 0.00 0.00 19.45 19.27 1dgj n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dgj n ILE 61 N -3.03 2.46 -4.04 0.00 -5.35 -0.69 -4.91 119.36 103.78 1dgj n ILE 61 Ca 0.04 -2.43 -0.33 0.00 -0.27 0.00 0.00 62.75 59.75 1dgj n ILE 61 Cb 0.53 -0.30 -0.15 0.00 -1.74 0.00 0.00 39.64 37.97 1dgj n ILE 61 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1dgj s ILE 62 N -3.10 2.46 0.40 7.28 -1.09 -1.24 -5.05 121.20 120.85 1dgj s ILE 62 Ca 0.44 -1.01 -0.23 0.00 -2.23 0.00 0.00 60.65 57.61 1dgj s ILE 62 Cb 0.38 -2.17 -0.10 0.00 -1.58 0.00 0.00 42.46 38.99 1dgj s ILE 62 CO 0.03 0.35 0.97 -0.54 -1.23 0.00 0.00 174.94 174.52 1dgj s LYS 63 N 1.29 4.30 0.48 2.79 -0.14 -1.26 -0.69 119.74 126.51 1dgj s LYS 63 Ca 0.02 1.26 0.16 0.00 -1.36 0.00 0.00 55.97 56.05 1dgj s LYS 63 Cb -0.15 -2.42 1.14 0.00 -1.68 0.00 0.00 37.83 34.72 1dgj s LYS 63 CO -0.08 0.02 2.05 0.52 -0.76 0.00 0.00 175.35 177.10 1dgj h MET 64 N 2.37 0.00 0.00 1.68 2.86 0.18 -1.88 114.93 120.14 1dgj h MET 64 Ca -0.48 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.14 1dgj h MET 64 Cb 1.19 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 1dgj h MET 64 CO 0.62 0.12 -0.09 0.66 1.06 0.00 0.00 176.91 179.28 1dgj h SER 65 N 0.00 0.00 -0.12 1.22 4.64 -1.28 -1.67 113.55 116.35 1dgj h SER 65 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dgj h SER 65 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1dgj h SER 65 CO 0.02 0.09 0.00 0.54 -0.87 0.00 0.00 176.83 176.61 1dgj n ARG 66 N -3.55 1.77 -3.71 4.77 3.00 -0.71 -4.85 116.66 113.37 1dgj n ARG 66 Ca -0.02 -1.14 -0.36 0.00 -0.01 0.00 0.00 57.85 56.32 1dgj n ARG 66 Cb 0.22 -1.44 -0.10 0.00 0.00 0.00 0.00 32.46 31.15 1dgj n ARG 66 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1dgj s VAL 67 N -1.86 5.22 0.78 1.55 1.01 -0.63 -5.01 120.40 121.46 1dgj s VAL 67 Ca 0.35 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 1dgj s VAL 67 Cb 0.19 -3.42 0.06 0.00 0.00 0.00 0.00 36.38 33.21 1dgj s VAL 67 CO 0.29 0.36 1.10 0.00 0.00 0.00 0.00 175.10 176.85 1dgj s ALA 68 N 0.99 2.20 0.31 5.51 0.00 -1.26 -5.00 121.76 124.51 1dgj s ALA 68 Ca 0.07 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.05 1dgj s ALA 68 Cb -0.13 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 1dgj s ALA 68 CO 0.04 -1.83 1.17 -1.21 0.00 0.00 0.00 175.76 173.93 1dgj s GLU 69 N -4.84 4.49 -0.72 0.00 0.41 -1.26 -2.66 118.70 114.12 1dgj s GLU 69 Ca 0.62 1.94 0.00 0.00 -0.41 0.00 0.00 54.97 57.12 1dgj s GLU 69 Cb -0.18 -3.09 0.00 0.00 -1.78 0.00 0.00 34.13 29.08 1dgj s GLU 69 CO 0.56 0.03 0.00 0.09 -0.49 0.00 0.00 175.26 175.44 1dgj n ASN 70 N 0.94 -5.25 -4.76 -0.19 3.02 0.12 -4.95 115.26 104.18 1dgj n ASN 70 Ca -0.00 0.17 -0.40 0.00 -0.03 0.00 0.00 54.58 54.32 1dgj n ASN 70 Cb 0.44 -3.35 0.02 0.00 -0.61 0.00 0.00 39.78 36.29 1dgj n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dgj n ALA 71 N 1.13 1.97 -2.85 5.41 0.00 -1.09 -4.43 120.51 120.65 1dgj n ALA 71 Ca -0.07 0.22 -0.37 0.00 0.00 0.00 0.00 53.44 53.23 1dgj n ALA 71 Cb 0.46 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.46 1dgj n ALA 71 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1dgj s SER 72 N -0.55 6.38 -0.05 0.00 1.04 -1.26 -1.51 113.70 117.75 1dgj s SER 72 Ca 0.63 0.46 0.04 0.00 0.48 0.00 0.00 55.95 57.56 1dgj s SER 72 Cb -0.44 -2.08 -0.00 0.00 0.10 0.00 0.00 66.02 63.60 1dgj s SER 72 CO 0.56 0.38 -0.17 -0.69 0.98 0.00 0.00 173.24 174.30 1dgj s VAL 73 N -0.85 1.42 -0.14 5.02 1.01 -0.36 -1.13 120.40 125.37 1dgj s VAL 73 Ca 0.14 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1dgj s VAL 73 Cb -0.12 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.06 1dgj s VAL 73 CO 0.04 0.41 -0.17 -0.89 0.00 0.00 0.00 175.10 174.48 1dgj s THR 74 N 0.08 1.73 0.50 3.92 2.01 0.14 -1.68 115.64 122.34 1dgj s THR 74 Ca -0.05 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.22 1dgj s THR 74 Cb -0.12 -1.57 0.03 0.00 0.01 0.00 0.00 72.50 70.85 1dgj s THR 74 CO 0.02 0.49 0.22 0.35 -0.69 0.00 0.00 174.62 175.01 1dgj n THR 75 N 4.37 0.00 -0.11 -0.82 -2.24 -1.26 -1.62 114.28 112.60 1dgj n THR 75 Ca -0.19 -2.16 0.04 0.00 -2.27 0.00 0.00 64.05 59.47 1dgj n THR 75 Cb 0.51 0.17 0.36 0.00 -2.10 0.00 0.00 70.33 69.27 1dgj n THR 75 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1dgj h LEU 76 N 0.00 0.62 -1.48 3.22 5.85 -1.91 -0.96 115.31 120.65 1dgj h LEU 76 Ca -0.36 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1dgj h LEU 76 Cb 1.21 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.09 1dgj h LEU 76 CO 0.58 0.43 0.00 -0.33 -0.34 0.00 0.00 178.44 178.79 1dgj h GLU 77 N 0.73 0.00 -0.02 1.25 3.07 -1.83 0.43 114.58 118.20 1dgj h GLU 77 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1dgj h GLU 77 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1dgj h GLU 77 CO -0.06 0.00 -0.27 0.41 -1.40 0.00 0.00 179.01 177.69 1dgj n GLY 78 N -0.84 0.03 0.12 -3.84 0.00 -0.37 -4.34 105.19 95.96 1dgj n GLY 78 Ca -0.01 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 1dgj n GLY 78 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1dgj n ILE 79 N 0.08 1.52 -3.64 -0.61 5.41 0.12 -4.95 119.36 117.29 1dgj n ILE 79 Ca 0.12 -0.66 -0.03 0.00 1.00 0.00 0.00 62.75 63.18 1dgj n ILE 79 Cb 0.45 -1.24 -0.06 0.00 -0.71 0.00 0.00 39.64 38.08 1dgj n ILE 79 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1dgj s GLY 80 N -6.05 0.22 0.39 7.39 0.00 -1.12 -4.38 107.32 103.77 1dgj s GLY 80 Ca -0.25 3.20 0.08 0.00 0.00 0.00 0.00 44.72 47.74 1dgj s GLY 80 CO 0.69 1.60 0.24 0.00 0.00 0.00 0.00 173.10 175.63 1dgj s ALA 81 N -0.39 3.73 0.63 3.20 0.00 -0.99 -4.68 121.76 123.27 1dgj s ALA 81 Ca 0.08 -1.94 0.30 0.00 0.00 0.00 0.00 51.96 50.39 1dgj s ALA 81 Cb -0.03 -0.72 1.59 0.00 0.00 0.00 0.00 23.12 23.96 1dgj s ALA 81 CO -0.12 -0.12 1.94 -1.00 0.00 0.00 0.00 175.76 176.46 1dgj h PRO 82 N 1.32 0.00 0.00 0.00 0.13 -1.94 -2.13 132.00 129.39 1dgj h PRO 82 Ca -0.43 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.55 1dgj h PRO 82 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1dgj h PRO 82 CO 0.64 0.00 -1.95 -0.25 -0.23 0.00 0.00 178.00 176.21 1dgj n ASP 83 N -3.27 0.23 -3.64 1.44 8.00 -1.26 -4.60 116.55 113.45 1dgj n ASP 83 Ca 0.02 0.10 -0.27 0.00 0.71 0.00 0.00 54.79 55.34 1dgj n ASP 83 Cb 0.46 1.19 -0.11 0.00 -0.02 0.00 0.00 41.12 42.65 1dgj n ASP 83 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dgj s LEU 85 N -1.02 4.48 0.43 0.00 1.43 -1.12 -2.34 118.68 120.55 1dgj s LEU 85 Ca 0.30 2.06 -0.18 0.00 -1.03 0.00 0.00 54.13 55.28 1dgj s LEU 85 Cb 0.02 -3.78 -0.09 0.00 0.03 0.00 0.00 46.19 42.36 1dgj s LEU 85 CO -0.16 -0.09 0.90 -2.28 0.23 0.00 0.00 176.35 174.95 1dgj s HIS 86 N -1.33 3.38 0.56 0.29 5.65 -1.26 -4.93 115.29 117.64 1dgj s HIS 86 Ca 0.47 1.44 0.25 0.00 0.25 0.00 0.00 55.06 57.47 1dgj s HIS 86 Cb -0.26 -2.74 1.53 0.00 -1.18 0.00 0.00 32.58 29.93 1dgj s HIS 86 CO 0.33 -0.14 2.13 -1.35 -0.65 0.00 0.00 174.74 175.06 1dgj h PRO 87 N 1.64 0.00 -0.41 2.88 0.11 -1.94 -1.77 132.00 132.52 1dgj h PRO 87 Ca -0.48 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 1dgj h PRO 87 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1dgj h PRO 87 CO 0.62 0.00 -0.21 1.25 -0.21 0.00 0.00 178.00 179.45 1dgj h LEU 88 N 0.00 0.81 -0.25 2.35 5.85 -1.92 -1.49 115.31 120.67 1dgj h LEU 88 Ca 0.07 -0.29 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 1dgj h LEU 88 Cb 0.34 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1dgj h LEU 88 CO -0.00 1.00 -0.23 1.56 -0.34 0.00 0.00 178.44 180.44 1dgj h GLN 89 N 0.70 0.59 -0.52 1.25 4.20 -1.69 -2.13 115.11 117.51 1dgj h GLN 89 Ca 0.10 -0.30 0.03 0.00 0.06 0.00 0.00 58.65 58.54 1dgj h GLN 89 Cb 0.72 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.47 1dgj h GLN 89 CO 0.06 0.89 0.29 0.45 -0.67 0.00 0.00 178.83 179.85 1dgj h HIS 90 N 0.30 0.53 -0.74 2.96 3.86 -1.28 -1.66 115.15 119.12 1dgj h HIS 90 Ca 0.04 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1dgj h HIS 90 Cb 0.78 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 29.05 1dgj h HIS 90 CO 0.07 0.29 0.32 0.00 0.86 0.00 0.00 177.93 179.47 1dgj h ALA 91 N 1.25 0.96 -0.30 2.45 0.00 -1.23 -0.96 119.26 121.43 1dgj h ALA 91 Ca 0.22 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1dgj h ALA 91 Cb 0.07 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1dgj h ALA 91 CO -0.12 0.56 0.09 2.35 0.00 0.00 0.00 179.25 182.12 1dgj h TRP 92 N 1.05 0.15 -0.15 0.00 2.91 -0.76 -0.74 115.95 118.41 1dgj h TRP 92 Ca 0.25 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.28 1dgj h TRP 92 Cb 0.17 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.79 1dgj h TRP 92 CO 0.01 0.06 0.05 0.82 -1.03 0.00 0.00 178.44 178.35 1dgj h ILE 93 N 0.21 1.17 0.00 2.65 2.04 -1.08 -0.70 117.51 121.80 1dgj h ILE 93 Ca 0.14 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1dgj h ILE 93 Cb 0.13 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1dgj h ILE 93 CO -0.16 0.16 0.00 1.56 0.00 0.00 0.00 178.15 179.71 1dgj h GLN 94 N 0.07 0.00 -0.00 2.37 1.08 -0.86 -2.64 115.11 115.12 1dgj h GLN 94 Ca 0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1dgj h GLN 94 Cb 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 1dgj h GLN 94 CO -0.00 0.00 -0.72 0.72 -0.95 0.00 0.00 178.83 177.88 1dgj n HIS 95 N -2.60 0.00 -2.21 2.96 8.25 -0.31 -4.93 115.22 116.38 1dgj n HIS 95 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 1dgj n HIS 95 Cb 0.19 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.29 1dgj n HIS 95 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dgj n GLY 96 N 1.39 -0.08 0.00 -1.41 0.00 -0.73 -4.90 105.19 99.46 1dgj n GLY 96 Ca 0.05 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.72 1dgj n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj n ALA 97 N -1.54 1.73 -3.32 4.61 0.00 -0.35 -4.47 120.51 117.17 1dgj n ALA 97 Ca -0.13 -0.05 -0.38 0.00 0.00 0.00 0.00 53.44 52.87 1dgj n ALA 97 Cb 0.60 -1.26 -0.12 0.00 0.00 0.00 0.00 19.45 18.68 1dgj n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dgj s ALA 98 N -3.00 3.12 0.00 0.00 0.00 -1.26 -4.85 121.76 115.77 1dgj s ALA 98 Ca 0.08 -1.96 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1dgj s ALA 98 Cb 0.10 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.83 1dgj s ALA 98 CO 0.29 -1.48 0.00 1.04 0.00 0.00 0.00 175.76 175.61 1dgj n GLN 99 N 4.81 0.00 0.22 0.00 6.02 -1.26 -4.63 117.38 122.54 1dgj n GLN 99 Ca -0.11 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 56.99 1dgj n GLN 99 Cb 0.44 -0.02 0.41 0.00 1.02 0.00 0.00 30.24 32.09 1dgj n GLN 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dgj n GLY 101 N 0.37 0.29 0.21 0.00 0.00 -1.26 -4.68 105.19 100.11 1dgj n GLY 101 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1dgj n GLY 101 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1dgj h PHE 102 N 0.00 0.00 -0.02 1.61 3.04 -1.90 -2.98 116.94 116.69 1dgj h PHE 102 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1dgj h PHE 102 Cb 0.42 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.93 1dgj h PHE 102 CO 0.27 0.27 -0.23 0.00 -2.02 0.00 0.00 178.31 176.59 1dgj h THR 104 N 3.29 0.71 -0.11 0.00 2.02 -1.86 -2.03 112.91 114.93 1dgj h THR 104 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1dgj h THR 104 Cb 0.81 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 1dgj h THR 104 CO 0.00 0.00 -0.11 -0.65 0.37 0.00 0.00 175.52 175.13 1dgj h PRO 105 N -0.09 -0.13 -0.96 6.66 0.11 -1.83 -0.99 132.00 134.77 1dgj h PRO 105 Ca 0.09 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.26 1dgj h PRO 105 Cb 0.22 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.30 1dgj h PRO 105 CO -0.21 -0.09 0.62 0.78 -0.21 0.00 0.00 178.00 178.89 1dgj h GLY 106 N -0.14 1.43 1.31 -0.55 0.00 -1.69 -0.73 103.07 102.69 1dgj h GLY 106 Ca 0.08 -0.46 -0.14 0.00 0.00 0.00 0.00 47.33 46.80 1dgj h GLY 106 CO -0.19 0.36 -0.37 0.74 0.00 0.00 0.00 176.54 177.08 1dgj h PHE 107 N 1.16 0.90 -0.13 5.60 -1.00 -0.96 -1.97 116.94 120.55 1dgj h PHE 107 Ca 0.40 -0.26 -0.22 0.00 2.81 0.00 0.00 57.97 60.70 1dgj h PHE 107 Cb 0.08 -0.20 0.01 0.00 3.61 0.00 0.00 35.95 39.46 1dgj h PHE 107 CO -0.01 1.02 -0.76 0.82 -1.61 0.00 0.00 178.31 177.76 1dgj h ILE 108 N 0.63 1.29 -0.11 -0.55 2.04 -0.81 -0.87 117.51 119.13 1dgj h ILE 108 Ca 0.06 -1.98 -0.01 0.00 1.00 0.00 0.00 64.86 63.93 1dgj h ILE 108 Cb 0.92 2.07 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1dgj h ILE 108 CO 0.08 0.62 0.03 0.58 0.00 0.00 0.00 178.15 179.46 1dgj h VAL 109 N 0.45 1.20 -0.91 1.67 2.07 -1.18 -0.74 116.25 118.82 1dgj h VAL 109 Ca -0.06 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 66.88 1dgj h VAL 109 Cb 1.40 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 32.51 1dgj h VAL 109 CO 0.16 0.18 0.59 -1.28 0.02 0.00 0.00 177.57 177.24 1dgj h SER 110 N -0.02 0.96 -0.35 0.57 0.87 -1.37 -2.37 113.55 111.84 1dgj h SER 110 Ca 0.04 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.44 1dgj h SER 110 Cb 0.26 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 1dgj h SER 110 CO 0.00 0.65 -0.37 0.00 -0.53 0.00 0.00 176.83 176.57 1dgj h ALA 111 N 1.48 0.52 -0.82 6.23 0.00 -0.94 -2.78 119.26 122.96 1dgj h ALA 111 Ca 0.37 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1dgj h ALA 111 Cb 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1dgj h ALA 111 CO -0.12 0.62 0.46 -0.22 0.00 0.00 0.00 179.25 179.99 1dgj h LYS 112 N 0.68 1.12 -0.24 0.00 3.11 -0.67 -2.04 116.57 118.53 1dgj h LYS 112 Ca 0.05 -0.12 -0.09 0.00 -2.81 0.00 0.00 60.65 57.69 1dgj h LYS 112 Cb 0.97 -0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 31.95 1dgj h LYS 112 CO 0.09 0.81 -0.24 0.00 -2.81 0.00 0.00 179.45 177.31 1dgj h ALA 113 N 1.37 1.14 -0.50 5.00 0.00 -1.35 -2.75 119.26 122.17 1dgj h ALA 113 Ca 0.29 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1dgj h ALA 113 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1dgj h ALA 113 CO -0.05 0.54 0.08 1.25 0.00 0.00 0.00 179.25 181.07 1dgj h LEU 114 N 0.41 0.80 -1.24 0.00 5.85 -1.11 -3.03 115.31 116.99 1dgj h LEU 114 Ca 0.06 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1dgj h LEU 114 Cb 0.64 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1dgj h LEU 114 CO 0.05 0.86 0.00 -0.07 -0.34 0.00 0.00 178.44 178.93 1dgj h LEU 115 N 0.71 0.00 -1.02 2.25 3.38 -1.12 -1.07 115.31 118.44 1dgj h LEU 115 Ca 0.15 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 1dgj h LEU 115 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1dgj h LEU 115 CO 0.01 0.00 -0.40 0.44 0.09 0.00 0.00 178.44 178.58 1dgj h ASP 116 N 0.00 0.00 0.00 -0.43 3.32 -1.37 -3.22 116.42 114.72 1dgj h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dgj h ASP 116 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1dgj h ASP 116 CO 0.00 0.40 -1.87 -0.62 -1.72 0.00 0.00 179.24 175.43 1dgj n GLU 117 N -3.67 0.60 -3.35 3.56 1.02 -0.91 -4.87 120.64 113.03 1dgj n GLU 117 Ca -0.01 -0.18 -0.14 0.00 -0.02 0.00 0.00 57.16 56.81 1dgj n GLU 117 Cb 0.49 -1.47 -0.07 0.00 -0.02 0.00 0.00 31.44 30.37 1dgj n GLU 117 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1dgj s ASN 118 N -4.24 0.94 0.35 1.62 3.04 -0.45 -4.99 114.94 111.20 1dgj s ASN 118 Ca -0.07 -1.16 0.26 0.00 0.04 0.00 0.00 52.86 51.93 1dgj s ASN 118 Cb 0.13 0.74 1.23 0.00 -1.54 0.00 0.00 41.25 41.81 1dgj s ASN 118 CO 0.83 -0.29 1.78 -0.37 -3.04 0.00 0.00 177.10 176.01 1dgj h VAL 119 N 5.48 0.00 -2.12 -5.21 -1.51 -1.85 -3.34 116.25 107.71 1dgj h VAL 119 Ca -0.01 -0.14 -0.57 0.00 -1.23 0.00 0.00 66.70 64.75 1dgj h VAL 119 Cb 1.08 0.82 -0.39 0.00 -2.13 0.00 0.00 31.29 30.67 1dgj h VAL 119 CO 0.23 0.00 -1.07 0.00 -1.23 0.00 0.00 177.57 175.50 1dgj n ALA 120 N -1.83 2.57 -2.38 5.19 0.00 -1.26 -4.76 120.51 118.02 1dgj n ALA 120 Ca 0.00 -3.30 -0.31 0.00 0.00 0.00 0.00 53.44 49.84 1dgj n ALA 120 Cb 0.14 -0.79 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 1dgj n ALA 120 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1dgj s PRO 121 N -0.77 3.76 0.64 0.00 0.04 -1.25 -5.09 135.00 132.33 1dgj s PRO 121 Ca 0.34 0.26 -0.07 0.00 0.04 0.00 0.00 61.00 61.57 1dgj s PRO 121 Cb 0.13 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 32.11 1dgj s PRO 121 CO -0.14 0.21 0.97 -1.54 0.04 0.00 0.00 177.00 176.54 1dgj s SER 122 N -2.74 5.36 0.27 6.66 1.04 -1.26 -4.89 113.70 118.14 1dgj s SER 122 Ca 0.48 0.72 -0.00 0.00 0.48 0.00 0.00 55.95 57.62 1dgj s SER 122 Cb -0.11 -1.59 0.52 0.00 0.10 0.00 0.00 66.02 64.94 1dgj s SER 122 CO 0.25 -1.25 1.82 0.03 0.98 0.00 0.00 173.24 175.07 1dgj h ARG 123 N -0.37 0.87 -0.65 4.02 3.08 -1.98 0.35 114.38 119.69 1dgj h ARG 123 Ca -0.45 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.51 1dgj h ARG 123 Cb 1.27 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 1dgj h ARG 123 CO 0.61 0.57 0.26 0.93 -1.07 0.00 0.00 179.97 181.28 1dgj h GLU 124 N 0.89 0.95 -0.05 0.04 4.39 -1.99 -0.09 114.58 118.72 1dgj h GLU 124 Ca 0.47 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 60.02 1dgj h GLU 124 Cb 0.49 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1dgj h GLU 124 CO -0.28 0.78 0.01 -0.44 -1.16 0.00 0.00 179.01 177.92 1dgj h ASP 125 N 0.94 0.01 -0.34 1.42 3.45 -1.31 -0.99 116.42 119.60 1dgj h ASP 125 Ca 0.22 0.01 0.02 0.00 0.43 0.00 0.00 57.03 57.70 1dgj h ASP 125 Cb 0.18 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 38.93 1dgj h ASP 125 CO -0.02 0.01 0.19 0.58 -1.57 0.00 0.00 179.24 178.44 1dgj h VAL 126 N 0.04 1.03 -0.62 -1.35 2.07 -0.88 -1.15 116.25 115.39 1dgj h VAL 126 Ca 0.02 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.47 1dgj h VAL 126 Cb 0.01 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 1dgj h VAL 126 CO -0.03 0.07 0.33 0.03 0.02 0.00 0.00 177.57 177.99 1dgj h ARG 127 N 0.39 0.59 -0.74 1.57 3.08 -0.63 -1.64 114.38 117.00 1dgj h ARG 127 Ca 0.13 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1dgj h ARG 127 Cb 0.01 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1dgj h ARG 127 CO -0.07 0.39 0.26 -0.44 -1.07 0.00 0.00 179.97 179.05 1dgj h ASP 128 N 0.61 1.05 -0.37 7.04 3.45 -0.80 -0.83 116.42 126.57 1dgj h ASP 128 Ca 0.28 -0.18 -0.00 0.00 0.43 0.00 0.00 57.03 57.56 1dgj h ASP 128 Cb 0.19 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.67 1dgj h ASP 128 CO -0.19 0.95 0.22 -0.25 -1.57 0.00 0.00 179.24 178.40 1dgj h TRP 129 N 1.09 0.50 -0.37 4.55 2.91 -0.39 0.17 115.95 124.42 1dgj h TRP 129 Ca 0.25 -0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.15 1dgj h TRP 129 Cb 0.26 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.73 1dgj h TRP 129 CO 0.02 0.37 -0.20 0.74 -1.03 0.00 0.00 178.44 178.34 1dgj h PHE 130 N 0.48 0.79 0.33 2.65 0.05 -1.15 -1.29 116.94 118.81 1dgj h PHE 130 Ca 0.13 -0.17 -0.02 0.00 3.82 0.00 0.00 57.97 61.74 1dgj h PHE 130 Cb 0.02 -0.19 0.00 0.00 2.00 0.00 0.00 35.95 37.78 1dgj h PHE 130 CO -0.03 0.85 -0.16 0.37 -0.18 0.00 0.00 178.31 179.16 1dgj h GLN 131 N 0.62 -0.43 -0.28 1.51 5.75 -0.71 -1.19 115.11 120.38 1dgj h GLN 131 Ca 0.09 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1dgj h GLN 131 Cb 0.69 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.32 1dgj h GLN 131 CO 0.05 -0.20 0.11 0.87 -2.65 0.00 0.00 178.83 177.01 1dgj h LYS 132 N -0.59 0.39 -0.44 1.69 1.57 -0.64 -2.65 116.57 115.90 1dgj h LYS 132 Ca -0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1dgj h LYS 132 Cb 0.43 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1dgj h LYS 132 CO 0.07 0.33 0.00 0.72 -0.57 0.00 0.00 179.45 180.01 1dgj n HIS 133 N -4.42 0.59 -3.72 -1.35 8.25 -0.49 -4.95 115.22 109.12 1dgj n HIS 133 Ca 0.01 -0.29 -0.26 0.00 -0.26 0.00 0.00 57.72 56.92 1dgj n HIS 133 Cb 0.13 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.30 1dgj n HIS 133 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1dgj n HIS 134 N 0.82 -2.53 -2.85 4.41 8.25 -0.55 -4.71 115.22 118.06 1dgj n HIS 134 Ca 0.15 0.95 -0.43 0.00 -0.26 0.00 0.00 57.72 58.14 1dgj n HIS 134 Cb 0.38 -4.57 -0.04 0.00 1.12 0.00 0.00 29.99 26.89 1dgj n HIS 134 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1dgj s ASN 135 N -3.47 6.27 -0.02 0.41 0.01 -0.64 -1.83 114.94 115.66 1dgj s ASN 135 Ca 0.53 -1.18 -0.06 0.00 -0.71 0.00 0.00 52.86 51.44 1dgj s ASN 135 Cb -0.25 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 38.94 1dgj s ASN 135 CO 0.78 -1.39 0.23 -0.63 -1.51 0.00 0.00 177.10 174.58 1dgj s ILE 136 N 3.90 5.36 -0.03 0.60 -1.09 -0.78 -4.66 121.20 124.50 1dgj s ILE 136 Ca 0.25 0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.76 1dgj s ILE 136 Cb -0.14 -3.54 0.03 0.00 -1.58 0.00 0.00 42.46 37.23 1dgj s ILE 136 CO 0.06 0.40 0.04 0.00 -1.23 0.00 0.00 174.94 174.20 1dgj n ARG 138 N 4.71 0.58 -0.13 0.00 3.00 -1.26 -4.65 116.66 118.91 1dgj n ARG 138 Ca -0.16 -0.40 -0.26 0.00 -0.00 0.00 0.00 57.85 57.03 1dgj n ARG 138 Cb 0.50 -1.49 -0.09 0.00 0.00 0.00 0.00 32.46 31.38 1dgj n ARG 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1dgj h THR 140 N -1.00 1.11 0.00 0.00 1.35 -1.82 -3.27 112.91 109.28 1dgj h THR 140 Ca -0.57 -1.86 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 1dgj h THR 140 Cb 1.50 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 1dgj h THR 140 CO -0.35 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 1dgj n GLY 141 N 0.35 0.65 4.70 5.82 0.00 -1.26 -3.04 105.19 112.42 1dgj n GLY 141 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1dgj n GLY 141 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dgj n TYR 142 N -2.67 0.00 -0.30 1.61 4.02 -1.26 -4.73 117.16 113.83 1dgj n TYR 142 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.94 1dgj n TYR 142 Cb 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 39.34 39.45 1dgj n TYR 142 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1dgj h LYS 143 N 0.00 0.01 -0.52 -0.72 3.64 -1.93 0.19 116.57 117.25 1dgj h LYS 143 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1dgj h LYS 143 Cb 0.00 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1dgj h LYS 143 CO 0.00 0.01 0.33 -1.35 -2.27 0.00 0.00 179.45 176.17 1dgj h PRO 144 N 0.01 0.69 -0.14 1.90 0.11 -1.85 -1.15 132.00 131.57 1dgj h PRO 144 Ca 0.43 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.49 1dgj h PRO 144 Cb 0.69 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 1dgj h PRO 144 CO -0.87 0.47 0.08 -0.07 -0.21 0.00 0.00 178.00 177.40 1dgj h LEU 145 N 0.71 0.18 -0.18 2.35 4.07 -0.95 -0.95 115.31 120.54 1dgj h LEU 145 Ca 0.19 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 1dgj h LEU 145 Cb -0.06 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 1dgj h LEU 145 CO -0.04 0.21 0.02 0.58 -1.08 0.00 0.00 178.44 178.13 1dgj h VAL 146 N 0.14 1.23 -0.76 1.22 2.07 -1.14 -1.65 116.25 117.36 1dgj h VAL 146 Ca 0.05 -0.76 0.16 0.00 0.82 0.00 0.00 66.70 66.97 1dgj h VAL 146 Cb 0.07 1.39 -0.11 0.00 -1.52 0.00 0.00 31.29 31.12 1dgj h VAL 146 CO -0.01 0.23 0.24 0.44 0.02 0.00 0.00 177.57 178.49 1dgj h ASP 147 N 0.08 0.12 -0.59 0.57 3.45 -1.14 -0.70 116.42 118.22 1dgj h ASP 147 Ca 0.05 0.14 -0.08 0.00 0.43 0.00 0.00 57.03 57.57 1dgj h ASP 147 Cb 0.33 0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.23 1dgj h ASP 147 CO 0.00 0.01 0.05 0.00 -1.57 0.00 0.00 179.24 177.73 1dgj h ALA 148 N 1.60 0.93 -0.20 3.45 0.00 -0.79 -2.82 119.26 121.44 1dgj h ALA 148 Ca 0.43 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1dgj h ALA 148 Cb 0.72 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1dgj h ALA 148 CO -0.48 0.65 -0.02 0.28 0.00 0.00 0.00 179.25 179.68 1dgj h VAL 149 N 0.96 1.27 -0.99 0.00 2.07 -0.29 -2.47 116.25 116.80 1dgj h VAL 149 Ca 0.18 -0.93 0.10 0.00 0.82 0.00 0.00 66.70 66.88 1dgj h VAL 149 Cb 0.48 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 31.65 1dgj h VAL 149 CO 0.02 0.28 0.63 0.24 0.02 0.00 0.00 177.57 178.76 1dgj h MET 150 N 0.11 0.99 -0.14 1.57 2.07 -1.12 -1.27 114.93 117.14 1dgj h MET 150 Ca 0.05 -0.06 -0.07 0.00 -2.07 0.00 0.00 59.70 57.55 1dgj h MET 150 Cb 0.43 -0.22 -0.00 0.00 -1.87 0.00 0.00 31.60 29.94 1dgj h MET 150 CO 0.01 0.65 -0.19 -0.44 1.07 0.00 0.00 176.91 178.02 1dgj h ASP 151 N 1.02 0.40 -0.37 1.22 3.32 -1.42 -2.75 116.42 117.84 1dgj h ASP 151 Ca 0.47 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1dgj h ASP 151 Cb 0.41 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1dgj h ASP 151 CO -0.23 0.84 0.25 0.00 -1.72 0.00 0.00 179.24 178.38 1dgj h ALA 152 N 0.58 1.74 -0.21 3.45 0.00 -1.09 -1.76 119.26 121.96 1dgj h ALA 152 Ca 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1dgj h ALA 152 Cb 0.74 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1dgj h ALA 152 CO 0.04 0.24 0.07 0.00 0.00 0.00 0.00 179.25 179.61 1dgj h ALA 153 N 1.77 0.28 -0.50 0.00 0.00 -1.17 -0.38 119.26 119.25 1dgj h ALA 153 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1dgj h ALA 153 Cb -0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1dgj h ALA 153 CO -0.03 -0.10 0.28 0.00 0.00 0.00 0.00 179.25 179.39 1dgj h ALA 154 N 0.89 1.54 -0.23 0.00 0.00 -1.11 -1.49 119.26 118.87 1dgj h ALA 154 Ca 0.07 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1dgj h ALA 154 Cb 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1dgj h ALA 154 CO -0.00 0.38 -0.54 0.82 0.00 0.00 0.00 179.25 179.91 1dgj h ILE 155 N 0.69 1.30 0.00 0.00 2.04 -0.96 0.38 117.51 120.97 1dgj h ILE 155 Ca 0.18 -1.76 -0.03 0.00 1.00 0.00 0.00 64.86 64.25 1dgj h ILE 155 Cb 0.02 1.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.79 1dgj h ILE 155 CO -0.03 0.56 -0.16 -0.07 0.00 0.00 0.00 178.15 178.45 1dgj h LEU 156 N 0.53 0.00 -0.17 1.44 3.38 -0.65 -1.98 115.31 117.86 1dgj h LEU 156 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1dgj h LEU 156 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1dgj h LEU 156 CO 0.11 0.16 -0.16 0.54 0.09 0.00 0.00 178.44 179.17 1dgj n ARG 157 N -3.26 0.47 -1.11 1.13 1.74 -0.60 -4.91 116.66 110.12 1dgj n ARG 157 Ca 0.01 -0.17 -0.04 0.00 -0.77 0.00 0.00 57.85 56.88 1dgj n ARG 157 Cb 0.43 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 1dgj n ARG 157 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dgj n GLY 158 N 1.36 0.68 0.07 -0.13 0.00 -0.75 -4.93 105.19 101.49 1dgj n GLY 158 Ca 0.12 -0.77 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 1dgj n GLY 158 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dgj h GLU 159 N 0.09 0.00 -4.68 1.61 5.08 -0.46 -3.47 114.58 112.75 1dgj h GLU 159 Ca -0.08 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 57.99 1dgj h GLU 159 Cb 0.27 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.31 1dgj h GLU 159 CO 0.11 0.66 -0.74 0.15 -1.00 0.00 0.00 179.01 178.19 1dgj s LYS 160 N -2.63 0.59 0.22 2.33 1.02 -1.11 -4.96 119.74 115.18 1dgj s LYS 160 Ca -0.03 -0.82 0.05 0.00 0.02 0.00 0.00 55.97 55.19 1dgj s LYS 160 Cb 0.09 -0.36 -0.03 0.00 -0.52 0.00 0.00 37.83 37.00 1dgj s LYS 160 CO 0.82 0.06 0.30 -0.08 -0.92 0.00 0.00 175.35 175.54 1dgj s THR 161 N -1.50 5.11 0.10 2.17 -1.32 -1.26 -4.02 115.64 114.93 1dgj s THR 161 Ca -0.08 -0.98 -0.23 0.00 -1.21 0.00 0.00 61.69 59.19 1dgj s THR 161 Cb -0.09 -3.73 -0.12 0.00 -1.51 0.00 0.00 72.50 67.05 1dgj s THR 161 CO 0.00 -0.26 1.72 0.58 -2.21 0.00 0.00 174.62 174.45 1dgj h VAL 162 N 1.38 0.86 -0.22 5.08 2.07 -1.99 -2.39 116.25 121.04 1dgj h VAL 162 Ca -0.50 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.08 1dgj h VAL 162 Cb 1.22 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1dgj h VAL 162 CO 0.63 0.00 0.37 -0.33 0.02 0.00 0.00 177.57 178.26 1dgj h GLU 163 N -0.11 0.00 0.02 1.57 5.08 -1.95 -1.39 114.58 117.81 1dgj h GLU 163 Ca 0.02 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.17 1dgj h GLU 163 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1dgj h GLU 163 CO -0.05 0.00 -0.94 1.49 -1.00 0.00 0.00 179.01 178.51 1dgj h GLU 164 N 0.00 0.19 -0.03 2.33 4.81 -1.83 -3.27 114.58 116.79 1dgj h GLU 164 Ca 0.10 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1dgj h GLU 164 Cb 0.84 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1dgj h GLU 164 CO -0.00 1.00 -0.04 0.44 -0.73 0.00 0.00 179.01 179.68 1dgj n ILE 165 N -3.61 0.00 -3.06 2.32 -5.35 -0.55 -4.97 119.36 104.14 1dgj n ILE 165 Ca -0.04 -0.47 -0.33 0.00 -0.27 0.00 0.00 62.75 61.64 1dgj n ILE 165 Cb 0.85 1.44 -0.06 0.00 -1.74 0.00 0.00 39.64 40.13 1dgj n ILE 165 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1dgj s SER 166 N -2.04 6.88 0.31 7.28 0.01 -1.04 -4.91 113.70 120.18 1dgj s SER 166 Ca 0.27 1.40 -0.29 0.00 1.31 0.00 0.00 55.95 58.64 1dgj s SER 166 Cb 0.20 -2.42 -0.10 0.00 0.21 0.00 0.00 66.02 63.91 1dgj s SER 166 CO 0.33 -0.18 1.42 0.12 0.41 0.00 0.00 173.24 175.33 1dgj s PHE 167 N -1.92 2.91 -0.04 2.43 5.36 -1.26 -5.02 117.98 120.44 1dgj s PHE 167 Ca 0.53 1.17 0.06 0.00 -0.96 0.00 0.00 56.93 57.73 1dgj s PHE 167 Cb -0.12 -3.84 -0.01 0.00 -0.34 0.00 0.00 43.02 38.72 1dgj s PHE 167 CO 0.18 -2.53 -0.22 0.15 -1.46 0.00 0.00 175.22 171.33 1dgj s LYS 168 N -1.25 2.17 0.13 10.12 1.02 -1.26 -5.09 119.74 125.58 1dgj s LYS 168 Ca 0.55 -0.80 -0.31 0.00 0.02 0.00 0.00 55.97 55.42 1dgj s LYS 168 Cb -0.43 -1.90 -0.10 0.00 -0.52 0.00 0.00 37.83 34.88 1dgj s LYS 168 CO 0.51 0.37 1.79 -1.64 -0.92 0.00 0.00 175.35 175.46 1dgj s MET 169 N -0.19 4.14 0.81 1.68 -1.94 -1.26 -4.99 119.30 117.56 1dgj s MET 169 Ca -0.01 2.56 -0.11 0.00 -1.71 0.00 0.00 55.69 56.42 1dgj s MET 169 Cb -0.12 -3.50 0.08 0.00 2.01 0.00 0.00 34.83 33.30 1dgj s MET 169 CO 0.02 -0.81 1.09 -1.25 -0.01 0.00 0.00 175.02 174.07 1dgj s PRO 170 N 2.44 1.95 0.34 2.03 0.04 -1.26 -4.90 135.00 135.64 1dgj s PRO 170 Ca 0.79 0.69 0.25 0.00 0.04 0.00 0.00 61.00 62.77 1dgj s PRO 170 Cb -0.46 -1.90 1.23 0.00 0.04 0.00 0.00 34.50 33.41 1dgj s PRO 170 CO 0.35 -1.73 1.75 0.00 0.04 0.00 0.00 177.00 177.41 1dgj h ALA 171 N -1.17 1.00 -0.14 8.56 0.00 -1.98 -2.29 119.26 123.24 1dgj h ALA 171 Ca -0.47 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1dgj h ALA 171 Cb 1.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1dgj h ALA 171 CO 0.58 0.00 -0.09 0.22 0.00 0.00 0.00 179.25 179.96 1dgj h ASP 172 N 0.00 0.32 0.00 0.00 3.58 -2.02 -3.47 116.42 114.84 1dgj h ASP 172 Ca 0.00 -0.43 0.00 0.00 0.42 0.00 0.00 57.03 57.02 1dgj h ASP 172 Cb 0.14 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.10 1dgj h ASP 172 CO 0.00 0.69 0.00 0.61 -2.88 0.00 0.00 179.24 177.66 1dgj n GLY 173 N 0.06 1.27 3.71 -0.78 0.00 -0.86 -5.03 105.19 103.56 1dgj n GLY 173 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1dgj n GLY 173 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dgj s ARG 174 N -0.59 4.56 0.00 1.61 0.52 -1.26 -4.93 118.95 118.86 1dgj s ARG 174 Ca 0.00 1.38 0.12 0.00 -0.52 0.00 0.00 55.73 56.71 1dgj s ARG 174 Cb 0.00 -3.45 0.10 0.00 0.52 0.00 0.00 34.95 32.12 1dgj s ARG 174 CO 0.00 -0.01 0.88 0.44 0.02 0.00 0.00 175.30 176.63 1dgj n ILE 175 N 3.77 0.02 -2.47 1.52 -5.35 -1.26 -4.78 119.36 110.81 1dgj n ILE 175 Ca 0.05 -0.51 -0.43 0.00 -0.27 0.00 0.00 62.75 61.59 1dgj n ILE 175 Cb 0.51 1.23 -0.02 0.00 -1.74 0.00 0.00 39.64 39.62 1dgj n ILE 175 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 1dgj s TRP 176 N -0.98 2.80 0.00 4.28 -0.11 -1.26 -2.66 118.94 121.00 1dgj s TRP 176 Ca 0.14 0.94 0.00 0.00 1.22 0.00 0.00 56.10 58.40 1dgj s TRP 176 Cb 0.10 -3.86 0.00 0.00 -1.50 0.00 0.00 33.47 28.21 1dgj s TRP 176 CO 0.15 -1.49 0.00 0.41 -4.62 0.00 0.00 176.95 171.39 1dgj n GLY 177 N 4.20 0.59 3.64 5.86 0.00 -0.08 -4.98 105.19 114.42 1dgj n GLY 177 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 1dgj n GLY 177 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dgj n SER 178 N 0.00 0.58 -1.42 1.61 3.41 -1.09 -4.42 113.62 112.29 1dgj n SER 178 Ca 0.00 -1.71 -0.09 0.00 -0.26 0.00 0.00 58.87 56.81 1dgj n SER 178 Cb 0.00 -0.81 0.19 0.00 -0.26 0.00 0.00 64.21 63.33 1dgj n SER 178 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1dgj n SER 179 N -3.44 2.84 -4.70 4.04 7.64 -1.26 -1.78 113.62 116.95 1dgj n SER 179 Ca 0.16 -3.76 -0.42 0.00 1.01 0.00 0.00 58.87 55.85 1dgj n SER 179 Cb 0.55 -0.68 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 1dgj n SER 179 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1dgj s ILE 180 N -3.32 2.42 0.75 0.44 2.07 -1.26 -4.80 121.20 117.50 1dgj s ILE 180 Ca 0.48 0.14 -0.15 0.00 -1.41 0.00 0.00 60.65 59.70 1dgj s ILE 180 Cb 0.42 -3.09 0.01 0.00 0.13 0.00 0.00 42.46 39.93 1dgj s ILE 180 CO 0.02 0.01 0.84 -0.81 -1.91 0.00 0.00 174.94 173.08 1dgj n PRO 181 N 4.86 0.35 -2.62 3.50 -0.04 -1.26 -4.92 135.00 134.87 1dgj n PRO 181 Ca 0.16 0.17 -0.35 0.00 -0.04 0.00 0.00 63.50 63.45 1dgj n PRO 181 Cb 0.37 -2.12 -0.05 0.00 -0.04 0.00 0.00 33.50 31.67 1dgj n PRO 181 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1dgj s ARG 182 N -3.30 4.04 0.28 0.54 1.70 -1.26 -4.95 118.95 116.00 1dgj s ARG 182 Ca 0.70 1.34 0.01 0.00 -0.47 0.00 0.00 55.73 57.31 1dgj s ARG 182 Cb -0.33 -2.27 0.68 0.00 -0.57 0.00 0.00 34.95 32.46 1dgj s ARG 182 CO 0.54 -0.22 1.65 -1.35 -1.08 0.00 0.00 175.30 174.84 1dgj h PRO 183 N 1.98 0.21 0.00 3.89 0.11 -1.93 0.00 132.00 136.26 1dgj h PRO 183 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1dgj h PRO 183 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1dgj h PRO 183 CO 0.61 0.14 0.00 -1.13 -0.21 0.00 0.00 178.00 177.41 1dgj n SER 184 N -5.22 0.00 0.09 -2.05 3.41 -1.26 -4.33 113.62 104.26 1dgj n SER 184 Ca 0.21 -0.99 -0.15 0.00 -0.26 0.00 0.00 58.87 57.67 1dgj n SER 184 Cb 0.66 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.52 1dgj n SER 184 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dgj h ALA 185 N 3.96 -0.90 -0.51 7.33 0.00 -1.34 -2.05 119.26 125.76 1dgj h ALA 185 Ca 0.00 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.92 1dgj h ALA 185 Cb 0.00 0.87 -0.08 0.00 0.00 0.00 0.00 17.79 18.58 1dgj h ALA 185 CO 0.00 -1.08 0.03 0.28 0.00 0.00 0.00 179.25 178.48 1dgj h VAL 186 N -0.69 0.63 -0.35 0.00 2.07 -1.81 0.23 116.25 116.33 1dgj h VAL 186 Ca 0.01 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 1dgj h VAL 186 Cb 0.73 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1dgj h VAL 186 CO -0.31 0.03 0.09 0.00 0.02 0.00 0.00 177.57 177.39 1dgj h ALA 187 N 1.44 1.50 0.08 1.67 0.00 -1.83 -2.25 119.26 119.88 1dgj h ALA 187 Ca 0.26 -0.14 -0.25 0.00 0.00 0.00 0.00 54.91 54.78 1dgj h ALA 187 Cb 0.38 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1dgj h ALA 187 CO -0.40 0.37 -1.02 0.87 0.00 0.00 0.00 179.25 179.08 1dgj h LYS 188 N 0.50 0.55 0.00 0.00 1.57 -0.42 -0.58 116.57 118.19 1dgj h LYS 188 Ca 0.12 -0.70 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 1dgj h LYS 188 Cb 0.19 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1dgj h LYS 188 CO -0.00 1.30 0.00 1.33 -0.57 0.00 0.00 179.45 181.50 1dgj n VAL 189 N -3.94 0.04 0.19 0.50 0.24 0.67 -3.11 118.33 112.92 1dgj n VAL 189 Ca -0.13 0.01 0.06 0.00 -2.04 0.00 0.00 64.34 62.24 1dgj n VAL 189 Cb 0.88 -0.54 -0.08 0.00 -1.47 0.00 0.00 33.84 32.62 1dgj n VAL 189 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1dgj n THR 190 N -1.15 0.00 -1.11 3.34 -2.24 -0.86 -4.91 114.28 107.35 1dgj n THR 190 Ca 0.18 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1dgj n THR 190 Cb 0.16 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1dgj n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dgj n GLY 191 N 1.63 0.54 0.08 3.38 0.00 -1.03 -4.66 105.19 105.13 1dgj n GLY 191 Ca -0.01 -0.86 0.05 0.00 0.00 0.00 0.00 46.02 45.21 1dgj n GLY 191 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dgj n LEU 192 N 0.00 0.52 -4.68 0.99 4.77 -0.35 -4.33 117.00 113.92 1dgj n LEU 192 Ca 0.00 0.22 -0.46 0.00 -0.03 0.00 0.00 56.01 55.73 1dgj n LEU 192 Cb 0.14 0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1dgj n LEU 192 CO 0.00 0.04 1.37 0.00 -1.33 0.00 0.00 177.39 177.47 1dgj n ALA 193 N -2.33 1.32 -2.57 -1.18 0.00 -0.44 -4.92 120.51 110.38 1dgj n ALA 193 Ca -0.08 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.32 1dgj n ALA 193 Cb 0.71 -2.46 -0.10 0.00 0.00 0.00 0.00 19.45 17.61 1dgj n ALA 193 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1dgj s GLU 194 N 2.52 3.80 0.50 0.00 2.12 -1.26 -5.00 118.70 121.38 1dgj s GLU 194 Ca 0.85 -0.27 0.01 0.00 0.36 0.00 0.00 54.97 55.92 1dgj s GLU 194 Cb -0.65 -3.72 0.02 0.00 0.26 0.00 0.00 34.13 30.04 1dgj s GLU 194 CO 0.43 -0.35 0.71 -0.06 -0.54 0.00 0.00 175.26 175.45 1dgj s PHE 195 N 1.94 3.00 0.21 5.30 0.40 -1.26 -4.21 117.98 123.36 1dgj s PHE 195 Ca 0.11 0.05 -0.14 0.00 -0.60 0.00 0.00 56.93 56.35 1dgj s PHE 195 Cb -0.16 -2.54 0.23 0.00 0.51 0.00 0.00 43.02 41.06 1dgj s PHE 195 CO 0.11 -0.62 1.62 0.78 0.70 0.00 0.00 175.22 177.81 1dgj h GLY 196 N 0.26 0.41 0.99 4.36 0.00 -1.91 -1.60 103.07 105.58 1dgj h GLY 196 Ca -0.44 0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1dgj h GLY 196 CO 0.54 -0.24 0.32 0.00 0.00 0.00 0.00 176.54 177.16 1dgj h ALA 197 N 1.58 0.78 -0.89 3.60 0.00 -1.95 -2.96 119.26 119.42 1dgj h ALA 197 Ca 0.30 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.22 1dgj h ALA 197 Cb 0.47 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 1dgj h ALA 197 CO -0.65 0.31 0.52 -0.44 0.00 0.00 0.00 179.25 178.98 1dgj h ASP 198 N 0.82 0.72 -0.30 0.00 3.45 -1.68 -0.99 116.42 118.44 1dgj h ASP 198 Ca 0.21 0.06 0.09 0.00 0.43 0.00 0.00 57.03 57.82 1dgj h ASP 198 Cb 0.07 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 1dgj h ASP 198 CO -0.03 0.36 0.22 0.00 -1.57 0.00 0.00 179.24 178.23 1dgj h ALA 199 N 1.52 2.22 -0.66 3.45 0.00 -1.30 -1.96 119.26 122.53 1dgj h ALA 199 Ca 0.46 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.50 1dgj h ALA 199 Cb 0.51 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1dgj h ALA 199 CO -0.29 -0.38 0.45 0.00 0.00 0.00 0.00 179.25 179.03 1dgj h ALA 200 N 1.83 2.20 0.00 0.00 0.00 -1.23 0.13 119.26 122.19 1dgj h ALA 200 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1dgj h ALA 200 Cb 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1dgj h ALA 200 CO -0.00 -0.37 0.00 -0.07 0.00 0.00 0.00 179.25 178.80 1dgj h LEU 201 N 0.30 0.00 -3.09 0.00 3.38 -1.50 -3.28 115.31 111.12 1dgj h LEU 201 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1dgj h LEU 201 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1dgj h LEU 201 CO -0.08 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.99 1dgj n ARG 202 N -3.00 3.19 -2.38 1.13 1.74 0.41 -5.02 116.66 112.74 1dgj n ARG 202 Ca 0.03 -2.59 -0.25 0.00 -0.77 0.00 0.00 57.85 54.27 1dgj n ARG 202 Cb 0.46 -1.66 0.05 0.00 -1.02 0.00 0.00 32.46 30.28 1dgj n ARG 202 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1dgj s MET 203 N -1.86 2.60 1.24 5.56 -1.94 -1.01 -5.06 119.30 118.82 1dgj s MET 203 Ca 0.39 -0.21 -0.17 0.00 -1.71 0.00 0.00 55.69 53.99 1dgj s MET 203 Cb 0.26 -2.27 0.30 0.00 2.01 0.00 0.00 34.83 35.13 1dgj s MET 203 CO 0.17 -0.89 1.01 -1.25 -0.01 0.00 0.00 175.02 174.05 1dgj s PRO 204 N -5.04 -1.51 0.07 2.03 0.04 -1.26 -4.95 135.00 124.38 1dgj s PRO 204 Ca 0.56 0.44 -0.36 0.00 0.04 0.00 0.00 61.00 61.68 1dgj s PRO 204 Cb -0.11 -1.52 -0.20 0.00 0.04 0.00 0.00 34.50 32.72 1dgj s PRO 204 CO 0.44 -4.01 1.59 0.93 0.04 0.00 0.00 177.00 175.99 1dgj h GLU 205 N -2.81 -1.13 0.00 4.56 5.08 -2.01 -3.06 114.58 115.22 1dgj h GLU 205 Ca -0.54 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1dgj h GLU 205 Cb 1.33 0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.84 1dgj h GLU 205 CO 0.43 -0.75 0.00 0.27 -1.00 0.00 0.00 179.01 177.96 1dgj n ASN 206 N -5.60 0.00 -4.75 1.42 2.04 -1.26 -4.81 115.26 102.30 1dgj n ASN 206 Ca -0.15 -0.08 -0.41 0.00 -0.44 0.00 0.00 54.58 53.49 1dgj n ASN 206 Cb 0.47 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.71 1dgj n ASN 206 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 1dgj s THR 207 N -2.00 2.24 0.21 5.53 2.01 -1.16 -4.53 115.64 117.93 1dgj s THR 207 Ca 0.02 0.20 0.05 0.00 0.31 0.00 0.00 61.69 62.27 1dgj s THR 207 Cb 0.01 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 1dgj s THR 207 CO 0.02 0.03 0.26 -0.76 -0.69 0.00 0.00 174.62 173.48 1dgj s LEU 208 N -0.52 4.11 -0.11 4.42 1.02 0.58 -4.90 118.68 123.28 1dgj s LEU 208 Ca 0.62 -0.02 0.03 0.00 0.02 0.00 0.00 54.13 54.78 1dgj s LEU 208 Cb -0.46 -2.67 0.01 0.00 0.02 0.00 0.00 46.19 43.09 1dgj s LEU 208 CO 0.47 -0.01 -0.21 -1.00 0.02 0.00 0.00 176.35 175.63 1dgj s HIS 209 N -1.92 2.40 0.31 0.29 3.76 -0.18 -1.65 115.29 118.30 1dgj s HIS 209 Ca 0.33 -1.08 -0.00 0.00 -0.15 0.00 0.00 55.06 54.16 1dgj s HIS 209 Cb -0.09 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 31.92 1dgj s HIS 209 CO 0.27 -0.48 0.51 -0.51 -0.85 0.00 0.00 174.74 173.68 1dgj s LEU 210 N 0.64 4.07 -0.11 0.89 1.43 -0.56 -1.46 118.68 123.58 1dgj s LEU 210 Ca -0.12 0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 1dgj s LEU 210 Cb -0.16 -3.30 0.03 0.00 0.03 0.00 0.00 46.19 42.78 1dgj s LEU 210 CO 0.03 -0.23 0.32 0.00 0.23 0.00 0.00 176.35 176.70 1dgj s ALA 211 N -2.19 -0.79 -0.01 4.21 0.00 -0.85 -4.52 121.76 117.61 1dgj s ALA 211 Ca 0.40 0.84 -0.05 0.00 0.00 0.00 0.00 51.96 53.15 1dgj s ALA 211 Cb -0.10 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 1dgj s ALA 211 CO 0.34 -0.16 0.21 -0.51 0.00 0.00 0.00 175.76 175.64 1dgj s LEU 212 N 0.01 4.37 -0.51 0.00 1.43 -1.26 -0.84 118.68 121.87 1dgj s LEU 212 Ca -0.01 0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 53.44 1dgj s LEU 212 Cb -0.03 -2.58 0.13 0.00 0.03 0.00 0.00 46.19 43.75 1dgj s LEU 212 CO 0.01 0.27 0.39 0.00 0.23 0.00 0.00 176.35 177.25 1dgj s ALA 213 N -1.28 3.47 0.19 4.21 0.00 -0.31 -4.88 121.76 123.16 1dgj s ALA 213 Ca 0.26 -2.66 -0.08 0.00 0.00 0.00 0.00 51.96 49.48 1dgj s ALA 213 Cb -0.13 -2.88 -0.06 0.00 0.00 0.00 0.00 23.12 20.05 1dgj s ALA 213 CO 0.16 -1.96 0.47 -0.65 0.00 0.00 0.00 175.76 173.78 1dgj s GLN 214 N 1.16 3.72 0.33 0.00 -0.21 -1.26 -1.41 119.66 121.99 1dgj s GLN 214 Ca 0.08 0.12 -0.28 0.00 0.02 0.00 0.00 55.36 55.29 1dgj s GLN 214 Cb -0.25 -2.74 -0.09 0.00 1.00 0.00 0.00 33.01 30.93 1dgj s GLN 214 CO -0.01 0.39 1.15 0.00 -2.12 0.00 0.00 175.29 174.69 1dgj s ALA 215 N -1.74 3.32 -0.89 6.09 0.00 0.85 -4.88 121.76 124.51 1dgj s ALA 215 Ca 0.44 0.95 0.11 0.00 0.00 0.00 0.00 51.96 53.46 1dgj s ALA 215 Cb -0.12 -3.36 0.30 0.00 0.00 0.00 0.00 23.12 19.95 1dgj s ALA 215 CO 0.23 -0.34 1.25 1.63 0.00 0.00 0.00 175.76 178.53 1dgj n LYS 216 N 0.70 2.88 -4.33 0.00 4.76 -1.26 -1.21 118.16 119.70 1dgj n LYS 216 Ca 0.01 -2.06 -0.23 0.00 -2.87 0.00 0.00 58.31 53.16 1dgj n LYS 216 Cb 0.45 -1.28 -0.12 0.00 -1.84 0.00 0.00 35.03 32.25 1dgj n LYS 216 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1dgj s VAL 217 N -1.04 1.86 0.09 -0.18 -7.23 -1.26 -4.99 120.40 107.65 1dgj s VAL 217 Ca 0.23 -1.82 0.08 0.00 -1.81 0.00 0.00 61.98 58.66 1dgj s VAL 217 Cb 0.12 -1.80 -0.21 0.00 0.56 0.00 0.00 36.38 35.05 1dgj s VAL 217 CO 0.15 -0.21 1.16 0.28 -0.31 0.00 0.00 175.10 176.18 1dgj h SER 218 N 3.50 0.00 -3.23 4.85 0.02 -1.91 -3.25 113.55 113.52 1dgj h SER 218 Ca -0.44 -0.01 -0.18 0.00 -0.84 0.00 0.00 61.79 60.33 1dgj h SER 218 Cb 1.20 -0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.44 1dgj h SER 218 CO 0.47 1.00 -0.45 -2.28 -1.14 0.00 0.00 176.83 174.44 1dgj s HIS 219 N -2.69 -0.42 -0.06 3.45 2.46 -1.26 -2.32 115.29 114.46 1dgj s HIS 219 Ca -0.00 0.94 -0.31 0.00 0.47 0.00 0.00 55.06 56.16 1dgj s HIS 219 Cb 0.10 0.09 0.12 0.00 -0.13 0.00 0.00 32.58 32.76 1dgj s HIS 219 CO 0.82 -0.28 1.13 0.00 -2.47 0.00 0.00 174.74 173.94 1dgj s ALA 220 N 1.49 -2.01 -0.01 1.58 0.00 -1.10 -2.10 121.76 119.61 1dgj s ALA 220 Ca -0.08 1.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.86 1dgj s ALA 220 Cb -0.10 0.21 -0.05 0.00 0.00 0.00 0.00 23.12 23.18 1dgj s ALA 220 CO -0.10 -0.78 0.29 -0.51 0.00 0.00 0.00 175.76 174.66 1dgj s LEU 221 N -2.54 4.39 -0.48 0.00 1.43 -0.68 -0.70 118.68 120.10 1dgj s LEU 221 Ca 0.10 0.66 -0.18 0.00 -1.03 0.00 0.00 54.13 53.68 1dgj s LEU 221 Cb 0.00 -2.58 0.05 0.00 0.03 0.00 0.00 46.19 43.69 1dgj s LEU 221 CO -0.05 0.29 0.55 -0.63 0.23 0.00 0.00 176.35 176.74 1dgj s ILE 222 N -1.22 4.97 -0.02 -0.59 1.01 -0.02 -2.13 121.20 123.20 1dgj s ILE 222 Ca 0.25 -0.52 0.12 0.00 0.00 0.00 0.00 60.65 60.49 1dgj s ILE 222 Cb -0.14 -4.21 -0.12 0.00 0.01 0.00 0.00 42.46 38.00 1dgj s ILE 222 CO 0.13 -0.68 1.17 0.11 0.00 0.00 0.00 174.94 175.68 1dgj h LYS 223 N 8.90 0.00 0.00 2.79 1.79 -0.80 -3.45 116.57 125.79 1dgj h LYS 223 Ca -0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 1dgj h LYS 223 Cb 1.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 1dgj h LYS 223 CO 0.91 0.67 0.00 0.41 -1.08 0.00 0.00 179.45 180.36 1dgj n GLY 224 N 1.35 0.82 3.06 3.86 0.00 -0.95 -4.95 105.19 108.38 1dgj n GLY 224 Ca -0.03 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 1dgj n GLY 224 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dgj s ILE 225 N -2.00 1.56 -0.42 -0.61 1.01 -1.26 -0.28 121.20 119.19 1dgj s ILE 225 Ca 0.00 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.91 1dgj s ILE 225 Cb 0.00 -1.43 0.09 0.00 0.01 0.00 0.00 42.46 41.13 1dgj s ILE 225 CO 0.00 0.45 0.26 -0.62 0.00 0.00 0.00 174.94 175.03 1dgj s ASP 226 N 1.08 5.55 0.11 3.58 2.15 0.53 -4.93 116.67 124.73 1dgj s ASP 226 Ca -0.04 -1.67 0.24 0.00 0.43 0.00 0.00 52.55 51.51 1dgj s ASP 226 Cb -0.14 -1.95 0.41 0.00 -0.30 0.00 0.00 42.92 40.93 1dgj s ASP 226 CO -0.03 -0.56 1.37 0.35 -0.17 0.00 0.00 175.17 176.12 1dgj n THR 227 N 4.85 0.32 -0.32 1.71 -2.24 -1.26 -2.47 114.28 114.86 1dgj n THR 227 Ca -0.08 -0.24 -0.08 0.00 -2.27 0.00 0.00 64.05 61.38 1dgj n THR 227 Cb 0.42 -0.11 -0.08 0.00 -2.10 0.00 0.00 70.33 68.46 1dgj n THR 227 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1dgj n SER 228 N -2.03 -0.80 -0.02 3.42 3.41 -1.26 -1.98 113.62 114.35 1dgj n SER 228 Ca 0.04 1.35 -0.01 0.00 -0.26 0.00 0.00 58.87 59.98 1dgj n SER 228 Cb 0.42 -0.18 0.26 0.00 -0.26 0.00 0.00 64.21 64.46 1dgj n SER 228 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1dgj h GLU 229 N 0.00 0.58 -0.25 4.33 5.08 -1.82 -2.88 114.58 119.62 1dgj h GLU 229 Ca 0.12 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1dgj h GLU 229 Cb 0.31 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1dgj h GLU 229 CO -0.71 0.62 -0.44 0.00 -1.00 0.00 0.00 179.01 177.48 1dgj h ALA 230 N 1.43 0.77 -0.78 3.43 0.00 -1.57 -3.00 119.26 119.54 1dgj h ALA 230 Ca 0.11 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1dgj h ALA 230 Cb 0.39 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1dgj h ALA 230 CO 0.02 0.66 0.44 0.93 0.00 0.00 0.00 179.25 181.30 1dgj h GLU 231 N 0.50 1.08 0.00 0.00 5.08 -1.19 -2.37 114.58 117.69 1dgj h GLU 231 Ca 0.04 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1dgj h GLU 231 Cb 0.96 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 1dgj h GLU 231 CO 0.09 0.79 -0.05 0.87 -1.00 0.00 0.00 179.01 179.70 1dgj h LYS 232 N 1.08 0.00 -6.96 2.33 1.57 -1.46 -3.45 116.57 109.68 1dgj h LYS 232 Ca 0.28 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.52 1dgj h LYS 232 Cb 0.01 0.00 0.19 0.00 0.08 0.00 0.00 32.23 32.51 1dgj h LYS 232 CO -0.05 0.05 -0.09 -1.33 -0.57 0.00 0.00 179.45 177.46 1dgj n MET 233 N -3.19 0.04 -2.14 3.15 2.81 -0.89 -4.92 117.12 111.98 1dgj n MET 233 Ca 0.00 0.08 -0.42 0.00 -1.81 0.00 0.00 57.70 55.54 1dgj n MET 233 Cb 0.31 -2.13 -0.03 0.00 -0.71 0.00 0.00 33.22 30.67 1dgj n MET 233 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1dgj s PRO 234 N -3.69 4.23 0.00 0.03 0.04 -1.26 -3.40 135.00 130.96 1dgj s PRO 234 Ca 0.67 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.75 1dgj s PRO 234 Cb -0.28 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.54 1dgj s PRO 234 CO 0.57 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 177.33 1dgj n GLY 235 N 3.83 2.48 3.65 0.56 0.00 -1.26 -4.85 105.19 109.61 1dgj n GLY 235 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1dgj n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dgj s VAL 236 N -2.37 3.47 0.02 1.61 1.01 -1.22 -1.65 120.40 121.28 1dgj s VAL 236 Ca 0.00 0.56 0.08 0.00 0.00 0.00 0.00 61.98 62.62 1dgj s VAL 236 Cb 0.00 -3.40 -0.23 0.00 0.00 0.00 0.00 36.38 32.75 1dgj s VAL 236 CO 0.00 -0.09 0.90 0.22 0.00 0.00 0.00 175.10 176.13 1dgj h TYR 237 N 10.24 0.08 -1.19 5.22 5.03 0.94 -3.48 116.97 133.81 1dgj h TYR 237 Ca -0.40 -0.06 0.25 0.00 2.58 0.00 0.00 58.73 61.10 1dgj h TYR 237 Cb 1.19 -0.00 -0.24 0.00 1.55 0.00 0.00 36.73 39.23 1dgj h TYR 237 CO 0.91 1.08 0.90 0.21 -1.32 0.00 0.00 178.16 179.93 1dgj s LYS 238 N -2.64 0.15 -0.15 1.82 2.20 -1.16 -5.02 119.74 114.95 1dgj s LYS 238 Ca -0.04 -0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.56 1dgj s LYS 238 Cb 0.08 0.07 0.03 0.00 -1.51 0.00 0.00 37.83 36.50 1dgj s LYS 238 CO 0.83 -0.06 -0.11 0.08 -0.36 0.00 0.00 175.35 175.73 1dgj s VAL 239 N -1.58 1.39 0.09 4.02 1.01 -1.26 -0.58 120.40 123.48 1dgj s VAL 239 Ca 0.09 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.51 1dgj s VAL 239 Cb -0.01 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1dgj s VAL 239 CO -0.05 0.37 0.11 -0.76 0.00 0.00 0.00 175.10 174.77 1dgj s LEU 240 N 1.55 3.90 0.00 3.92 1.43 0.39 -4.94 118.68 124.93 1dgj s LEU 240 Ca 0.04 0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1dgj s LEU 240 Cb -0.13 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.53 1dgj s LEU 240 CO -0.10 0.16 0.03 0.35 0.23 0.00 0.00 176.35 177.02 1dgj n THR 241 N 0.31 0.00 0.25 5.49 -2.24 -1.26 -0.25 114.28 116.58 1dgj n THR 241 Ca -0.08 -0.28 0.16 0.00 -2.27 0.00 0.00 64.05 61.58 1dgj n THR 241 Cb 0.52 0.12 0.88 0.00 -2.10 0.00 0.00 70.33 69.76 1dgj n THR 241 CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 1dgj h HIS 242 N 1.10 0.00 0.00 4.78 2.07 -1.80 -0.55 115.15 120.75 1dgj h HIS 242 Ca -0.03 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.47 1dgj h HIS 242 Cb 0.14 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.12 1dgj h HIS 242 CO 0.00 0.00 -0.08 0.87 -3.07 0.00 0.00 177.93 175.65 1dgj h LYS 243 N 0.00 0.00 -0.01 5.12 1.57 -1.95 -2.69 116.57 118.62 1dgj h LYS 243 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1dgj h LYS 243 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1dgj h LYS 243 CO -0.00 0.08 -0.01 -0.25 -0.57 0.00 0.00 179.45 178.71 1dgj n ASP 244 N -3.40 1.14 -4.72 0.86 8.00 -0.21 -4.87 116.55 113.34 1dgj n ASP 244 Ca -0.01 -1.36 -0.41 0.00 0.71 0.00 0.00 54.79 53.72 1dgj n ASP 244 Cb 0.24 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.30 1dgj n ASP 244 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1dgj s VAL 245 N -2.01 4.84 -0.03 2.53 1.01 -1.02 -4.90 120.40 120.82 1dgj s VAL 245 Ca 0.40 1.78 0.05 0.00 0.00 0.00 0.00 61.98 64.21 1dgj s VAL 245 Cb 0.21 -4.19 -0.24 0.00 0.00 0.00 0.00 36.38 32.16 1dgj s VAL 245 CO 0.35 0.25 0.70 0.11 0.00 0.00 0.00 175.10 176.51 1dgj h LYS 246 N 6.37 0.10 0.00 2.72 1.57 -1.82 -3.48 116.57 122.04 1dgj h LYS 246 Ca -0.42 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1dgj h LYS 246 Cb 1.21 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1dgj h LYS 246 CO 0.74 0.80 0.00 0.41 -0.57 0.00 0.00 179.45 180.83 1dgj n GLY 247 N 1.65 0.65 0.09 3.86 0.00 -1.13 -4.68 105.19 105.63 1dgj n GLY 247 Ca -0.18 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.21 1dgj n GLY 247 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgj n LYS 248 N 0.00 0.11 -2.79 1.61 5.02 -0.71 -4.79 118.16 116.61 1dgj n LYS 248 Ca 0.00 0.44 -0.20 0.00 -2.02 0.00 0.00 58.31 56.53 1dgj n LYS 248 Cb 0.00 -1.75 0.02 0.00 -0.02 0.00 0.00 35.03 33.28 1dgj n LYS 248 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1dgj n ASN 249 N -1.97 -5.67 -4.14 4.39 5.15 -0.59 -4.95 115.26 107.48 1dgj n ASN 249 Ca 0.01 -0.20 -0.12 0.00 -0.60 0.00 0.00 54.58 53.68 1dgj n ASN 249 Cb 0.14 -4.56 -0.11 0.00 -0.53 0.00 0.00 39.78 34.73 1dgj n ASN 249 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1dgj s ARG 250 N -5.42 0.76 -0.18 1.20 1.81 -1.26 -1.17 118.95 114.69 1dgj s ARG 250 Ca 0.20 -1.15 0.00 0.00 -1.72 0.00 0.00 55.73 53.07 1dgj s ARG 250 Cb -0.09 -0.29 0.01 0.00 -0.45 0.00 0.00 34.95 34.13 1dgj s ARG 250 CO 0.25 0.02 -0.17 0.42 -0.68 0.00 0.00 175.30 175.14 1dgj s ILE 251 N -2.80 2.35 0.24 1.52 1.01 0.02 -3.66 121.20 119.89 1dgj s ILE 251 Ca 0.05 -0.85 -0.20 0.00 0.00 0.00 0.00 60.65 59.65 1dgj s ILE 251 Cb -0.00 -2.00 -0.08 0.00 0.01 0.00 0.00 42.46 40.38 1dgj s ILE 251 CO -0.02 0.52 0.75 0.28 0.00 0.00 0.00 174.94 176.46 1dgj s THR 252 N 1.22 4.54 -1.82 2.92 -1.32 -0.98 -4.25 115.64 115.94 1dgj s THR 252 Ca 0.03 1.32 0.29 0.00 -1.21 0.00 0.00 61.69 62.11 1dgj s THR 252 Cb -0.14 -3.85 0.72 0.00 -1.51 0.00 0.00 72.50 67.72 1dgj s THR 252 CO -0.09 0.17 2.03 0.61 -2.21 0.00 0.00 174.62 175.13 1dgj n GLY 253 N 0.61 -1.00 5.00 6.08 0.00 -0.27 -4.72 105.19 110.90 1dgj n GLY 253 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1dgj n GLY 253 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dgj n LEU 254 N -1.09 0.00 -2.12 0.99 4.77 -1.26 -3.68 117.00 114.60 1dgj n LEU 254 Ca 0.19 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.98 1dgj n LEU 254 Cb 0.14 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.43 1dgj n LEU 254 CO 0.18 0.00 1.20 2.30 -1.33 0.00 0.00 177.39 179.74 1dgj n ILE 255 N 0.00 3.04 -1.68 -0.08 -5.35 -1.26 -5.01 119.36 109.02 1dgj n ILE 255 Ca 0.00 -1.76 -0.49 0.00 -0.27 0.00 0.00 62.75 60.23 1dgj n ILE 255 Cb 0.00 -0.47 -0.05 0.00 -1.74 0.00 0.00 39.64 37.38 1dgj n ILE 255 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1dgj n THR 256 N -0.85 0.37 -1.68 7.28 -1.04 -1.24 -4.88 114.28 112.24 1dgj n THR 256 Ca 0.53 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 62.06 1dgj n THR 256 Cb 1.56 -1.66 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 1dgj n THR 256 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1dgj n PHE 257 N 5.44 1.97 -0.29 -1.42 0.99 -1.26 -4.90 117.46 117.99 1dgj n PHE 257 Ca 0.21 0.54 0.08 0.00 -0.00 0.00 0.00 57.45 58.29 1dgj n PHE 257 Cb 0.27 -2.36 0.31 0.00 -1.00 0.00 0.00 39.48 36.70 1dgj n PHE 257 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 1dgj h PRO 258 N 2.17 0.83 -0.81 -1.08 0.13 -1.98 -2.38 132.00 128.87 1dgj h PRO 258 Ca -0.46 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1dgj h PRO 258 Cb 1.30 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1dgj h PRO 258 CO 0.60 0.55 0.00 0.25 -0.23 0.00 0.00 178.00 179.18 1dgj n THR 259 N -4.55 1.22 -2.71 1.56 -2.24 -1.26 -4.88 114.28 101.42 1dgj n THR 259 Ca 0.16 -0.62 -0.40 0.00 -2.27 0.00 0.00 64.05 60.92 1dgj n THR 259 Cb 0.34 -0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.12 1dgj n THR 259 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1dgj s ASN 260 N -0.35 7.58 0.30 3.42 3.84 -0.90 -4.74 114.94 124.10 1dgj s ASN 260 Ca 0.24 1.96 0.01 0.00 0.21 0.00 0.00 52.86 55.28 1dgj s ASN 260 Cb 0.18 -2.61 0.48 0.00 -0.55 0.00 0.00 41.25 38.76 1dgj s ASN 260 CO 0.07 0.09 1.86 0.11 -2.79 0.00 0.00 177.10 176.44 1dgj h LYS 261 N 4.35 0.74 0.00 0.43 6.56 -0.73 -3.44 116.57 124.47 1dgj h LYS 261 Ca -0.45 -0.14 0.00 0.00 -1.06 0.00 0.00 60.65 59.00 1dgj h LYS 261 Cb 1.20 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1dgj h LYS 261 CO 0.69 0.67 0.00 0.41 -2.06 0.00 0.00 179.45 179.15 1dgj n GLY 262 N -0.92 0.18 0.00 3.86 0.00 -1.26 -4.99 105.19 102.06 1dgj n GLY 262 Ca 0.03 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1dgj n GLY 262 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dgj n ASP 263 N -1.43 0.72 -0.16 1.61 5.75 -1.26 -5.03 116.55 116.76 1dgj n ASP 263 Ca 0.00 -1.02 -0.02 0.00 -0.01 0.00 0.00 54.79 53.73 1dgj n ASP 263 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 1dgj n ASP 263 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dgj n GLY 264 N -0.01 0.54 0.26 6.12 0.00 -1.26 -4.79 105.19 106.04 1dgj n GLY 264 Ca 0.00 -0.94 0.09 0.00 0.00 0.00 0.00 46.02 45.17 1dgj n GLY 264 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dgj n TRP 265 N -2.94 0.21 0.08 1.61 7.02 -1.26 -1.11 117.44 121.06 1dgj n TRP 265 Ca -0.02 -0.95 -0.04 0.00 -1.02 0.00 0.00 57.50 55.47 1dgj n TRP 265 Cb 0.07 -0.18 -0.07 0.00 -2.42 0.00 0.00 31.31 28.70 1dgj n TRP 265 CO 0.00 0.00 0.00 1.05 -2.02 0.00 0.00 177.69 176.72 1dgj h GLU 266 N 0.42 0.00 -6.27 -0.99 -0.00 -1.92 -3.44 114.58 102.39 1dgj h GLU 266 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 59.36 58.81 1dgj h GLU 266 Cb 1.08 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.82 1dgj h GLU 266 CO 0.05 0.79 1.13 0.50 -0.00 0.00 0.00 179.01 181.47 1dgj s ARG 267 N -2.79 4.07 0.49 1.06 3.52 -1.26 -4.94 118.95 119.10 1dgj s ARG 267 Ca 0.02 2.15 -0.09 0.00 -0.13 0.00 0.00 55.73 57.68 1dgj s ARG 267 Cb 0.09 -4.03 -0.05 0.00 -1.56 0.00 0.00 34.95 29.40 1dgj s ARG 267 CO 0.80 -0.98 0.85 -1.25 -0.81 0.00 0.00 175.30 173.90 1dgj s PRO 268 N 4.28 3.65 -0.11 5.12 0.05 -1.26 -0.80 135.00 145.93 1dgj s PRO 268 Ca 0.76 0.44 -0.27 0.00 0.05 0.00 0.00 61.00 61.99 1dgj s PRO 268 Cb -0.33 -2.30 -0.27 0.00 0.05 0.00 0.00 34.50 31.65 1dgj s PRO 268 CO 0.31 -0.24 0.84 0.82 0.05 0.00 0.00 177.00 178.78 1dgj h ILE 269 N 0.40 1.70 -3.15 0.56 2.04 -1.45 -3.43 117.51 114.17 1dgj h ILE 269 Ca -0.46 -2.33 -0.56 0.00 1.00 0.00 0.00 64.86 62.50 1dgj h ILE 269 Cb 1.20 3.27 -0.36 0.00 -0.74 0.00 0.00 36.82 40.18 1dgj h ILE 269 CO 0.62 0.62 -0.82 -0.76 0.00 0.00 0.00 178.15 177.82 1dgj s LEU 270 N -8.18 1.40 0.34 1.44 1.43 -1.26 -4.87 118.68 108.98 1dgj s LEU 270 Ca -0.17 -0.38 -0.27 0.00 -1.03 0.00 0.00 54.13 52.27 1dgj s LEU 270 Cb -0.02 -0.99 -0.12 0.00 0.03 0.00 0.00 46.19 45.09 1dgj s LEU 270 CO 0.73 -0.09 1.11 0.59 0.23 0.00 0.00 176.35 178.92 1dgj n ASN 271 N 4.87 1.83 -0.02 2.29 5.03 -1.10 -4.63 115.26 123.53 1dgj n ASN 271 Ca -0.14 1.15 -0.02 0.00 0.87 0.00 0.00 54.58 56.44 1dgj n ASN 271 Cb 0.50 -1.38 -0.01 0.00 -1.02 0.00 0.00 39.78 37.87 1dgj n ASN 271 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 1dgj n ASP 272 N 0.86 3.78 0.00 6.41 3.85 -1.26 -4.57 116.55 125.62 1dgj n ASP 272 Ca 0.08 -0.02 0.00 0.00 -0.71 0.00 0.00 54.79 54.14 1dgj n ASP 272 Cb 0.35 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.09 1dgj n ASP 272 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 1dgj n SER 273 N -2.58 3.67 -3.88 -1.12 3.41 -1.26 -4.81 113.62 107.05 1dgj n SER 273 Ca -0.05 -0.06 -0.10 0.00 -0.26 0.00 0.00 58.87 58.40 1dgj n SER 273 Cb 0.56 0.85 -0.09 0.00 -0.26 0.00 0.00 64.21 65.28 1dgj n SER 273 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1dgj s LYS 274 N -1.59 0.68 -0.25 4.33 1.02 -1.26 -0.84 119.74 121.83 1dgj s LYS 274 Ca 0.00 -0.73 -0.07 0.00 0.02 0.00 0.00 55.97 55.19 1dgj s LYS 274 Cb 0.00 0.28 -0.03 0.00 -0.52 0.00 0.00 37.83 37.56 1dgj s LYS 274 CO 0.00 -0.19 0.06 0.42 -0.92 0.00 0.00 175.35 174.72 1dgj s ILE 275 N -2.80 4.26 -0.13 2.17 1.01 0.12 -4.87 121.20 120.96 1dgj s ILE 275 Ca -0.03 -0.20 0.19 0.00 0.00 0.00 0.00 60.65 60.60 1dgj s ILE 275 Cb -0.00 -2.99 -0.21 0.00 0.01 0.00 0.00 42.46 39.26 1dgj s ILE 275 CO -0.05 0.34 0.54 0.49 0.00 0.00 0.00 174.94 176.25 1dgj n PHE 276 N 4.92 0.46 -3.60 3.97 3.01 -1.26 -2.72 117.46 122.24 1dgj n PHE 276 Ca -0.16 0.15 -0.16 0.00 1.01 0.00 0.00 57.45 58.29 1dgj n PHE 276 Cb 0.51 -0.91 -0.06 0.00 -0.01 0.00 0.00 39.48 39.01 1dgj n PHE 276 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 1dgj s GLN 277 N -2.98 0.95 0.15 -1.08 -2.07 -0.98 -4.56 119.66 109.09 1dgj s GLN 277 Ca -0.06 0.02 -0.34 0.00 -1.82 0.00 0.00 55.36 53.15 1dgj s GLN 277 Cb 0.09 0.44 -0.14 0.00 -1.09 0.00 0.00 33.01 32.31 1dgj s GLN 277 CO 0.84 -0.30 1.53 0.98 -1.32 0.00 0.00 175.29 177.01 1dgj n TYR 278 N 0.87 2.13 0.00 9.60 4.19 -1.23 -1.74 117.16 130.99 1dgj n TYR 278 Ca -0.19 0.34 0.00 0.00 3.31 0.00 0.00 57.90 61.36 1dgj n TYR 278 Cb 0.58 -2.50 0.00 0.00 0.49 0.00 0.00 39.34 37.90 1dgj n TYR 278 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1dgj n GLY 279 N 3.20 2.15 3.68 2.98 0.00 -0.35 -4.80 105.19 112.05 1dgj n GLY 279 Ca 0.17 0.00 -0.61 0.00 0.00 0.00 0.00 46.02 45.58 1dgj n GLY 279 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dgj n ASP 280 N 0.00 1.50 -4.62 1.61 8.00 -0.71 -4.20 116.55 118.12 1dgj n ASP 280 Ca 0.00 1.14 -0.43 0.00 0.71 0.00 0.00 54.79 56.21 1dgj n ASP 280 Cb 0.00 -1.02 -0.02 0.00 -0.02 0.00 0.00 41.12 40.06 1dgj n ASP 280 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dgj s ALA 281 N 2.40 3.38 -0.95 2.24 0.00 -1.26 -0.11 121.76 127.45 1dgj s ALA 281 Ca 0.98 -0.22 0.20 0.00 0.00 0.00 0.00 51.96 52.92 1dgj s ALA 281 Cb -1.24 -3.74 -0.22 0.00 0.00 0.00 0.00 23.12 17.92 1dgj s ALA 281 CO 0.68 -1.75 0.86 1.28 0.00 0.00 0.00 175.76 176.83 1dgj n LEU 282 N 7.18 0.95 -3.57 0.00 4.77 -0.50 -2.69 117.00 123.14 1dgj n LEU 282 Ca 0.12 -0.50 -0.11 0.00 -0.03 0.00 0.00 56.01 55.48 1dgj n LEU 282 Cb 0.48 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.51 1dgj n LEU 282 CO 0.63 0.24 0.73 0.00 -1.33 0.00 0.00 177.39 177.66 1dgj s ALA 283 N -2.91 -1.92 -0.17 -1.18 0.00 -1.24 -4.39 121.76 109.95 1dgj s ALA 283 Ca 0.08 1.57 -0.01 0.00 0.00 0.00 0.00 51.96 53.60 1dgj s ALA 283 Cb 0.15 -0.66 -0.00 0.00 0.00 0.00 0.00 23.12 22.61 1dgj s ALA 283 CO 0.83 -0.31 -0.13 0.42 0.00 0.00 0.00 175.76 176.57 1dgj s ILE 284 N -1.05 2.82 -0.13 0.00 1.01 0.66 -1.17 121.20 123.34 1dgj s ILE 284 Ca -0.03 -0.70 -0.10 0.00 0.00 0.00 0.00 60.65 59.82 1dgj s ILE 284 Cb -0.01 -2.22 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1dgj s ILE 284 CO 0.02 0.49 0.22 -0.69 0.00 0.00 0.00 174.94 174.99 1dgj s VAL 285 N 1.01 5.36 -0.22 2.92 1.01 -0.02 -0.46 120.40 130.01 1dgj s VAL 285 Ca -0.01 0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.33 1dgj s VAL 285 Cb -0.15 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.71 1dgj s VAL 285 CO -0.02 0.52 -0.07 0.00 0.00 0.00 0.00 175.10 175.53 1dgj n ALA 287 N 4.76 0.55 0.84 0.00 0.00 -0.53 0.14 120.51 126.27 1dgj n ALA 287 Ca -0.19 -2.05 0.14 0.00 0.00 0.00 0.00 53.44 51.34 1dgj n ALA 287 Cb 0.50 1.36 0.53 0.00 0.00 0.00 0.00 19.45 21.85 1dgj n ALA 287 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1dgj n ASP 288 N -1.51 0.32 -3.69 0.00 5.75 -0.66 -1.01 116.55 115.76 1dgj n ASP 288 Ca -0.07 0.53 -0.10 0.00 -0.01 0.00 0.00 54.79 55.15 1dgj n ASP 288 Cb 0.60 -0.62 -0.03 0.00 -1.03 0.00 0.00 41.12 40.05 1dgj n ASP 288 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1dgj s SER 289 N -3.60 -0.34 0.04 -1.12 1.04 -1.26 -4.77 113.70 103.69 1dgj s SER 289 Ca 0.13 -0.39 -0.23 0.00 0.48 0.00 0.00 55.95 55.94 1dgj s SER 289 Cb 0.16 0.62 -0.15 0.00 0.10 0.00 0.00 66.02 66.75 1dgj s SER 289 CO 0.55 -1.10 1.45 -0.08 0.98 0.00 0.00 173.24 175.04 1dgj h GLU 290 N 2.10 0.15 -0.81 4.02 4.81 -1.90 -1.82 114.58 121.14 1dgj h GLU 290 Ca -0.28 -0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.00 1dgj h GLU 290 Cb 1.27 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.57 1dgj h GLU 290 CO 0.34 0.43 0.45 0.00 -0.73 0.00 0.00 179.01 179.51 1dgj h ALA 291 N 0.71 1.15 -0.28 2.92 0.00 -1.97 0.48 119.26 122.27 1dgj h ALA 291 Ca 0.02 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1dgj h ALA 291 Cb 0.37 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1dgj h ALA 291 CO 0.01 0.06 -0.36 -0.91 0.00 0.00 0.00 179.25 178.05 1dgj h ASN 292 N 0.74 0.66 -0.20 0.00 2.35 -1.87 -2.62 115.58 114.65 1dgj h ASN 292 Ca 0.39 -0.28 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 1dgj h ASN 292 Cb 0.39 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1dgj h ASN 292 CO -0.26 0.96 -0.35 0.00 -1.65 0.00 0.00 177.43 176.13 1dgj h ALA 293 N 1.08 0.31 -0.56 -0.83 0.00 -0.47 -2.74 119.26 116.05 1dgj h ALA 293 Ca 0.05 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1dgj h ALA 293 Cb 0.86 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1dgj h ALA 293 CO 0.07 0.37 0.35 0.00 0.00 0.00 0.00 179.25 180.04 1dgj h ARG 294 N 0.26 0.75 0.00 0.00 3.08 -0.96 -1.73 114.38 115.79 1dgj h ARG 294 Ca 0.01 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1dgj h ARG 294 Cb 0.95 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1dgj h ARG 294 CO 0.08 0.53 -0.19 0.00 -1.07 0.00 0.00 179.97 179.32 1dgj h ALA 295 N 1.18 1.60 0.00 0.04 0.00 -1.47 -2.83 119.26 117.78 1dgj h ALA 295 Ca 0.20 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1dgj h ALA 295 Cb -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1dgj h ALA 295 CO -0.04 0.24 -0.91 0.00 0.00 0.00 0.00 179.25 178.54 1dgj h ALA 296 N 1.81 0.65 -0.31 0.00 0.00 -1.15 -3.35 119.26 116.91 1dgj h ALA 296 Ca -0.00 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 1dgj h ALA 296 Cb 0.36 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1dgj h ALA 296 CO 0.03 0.43 -0.30 0.00 0.00 0.00 0.00 179.25 179.41 1dgj h ALA 297 N 1.71 0.89 0.00 0.00 0.00 -1.07 -2.80 119.26 117.98 1dgj h ALA 297 Ca -0.06 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1dgj h ALA 297 Cb 1.27 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1dgj h ALA 297 CO 0.03 0.63 -0.17 0.93 0.00 0.00 0.00 179.25 180.67 1dgj h GLU 298 N 0.56 0.00 0.00 0.00 5.08 -1.67 -2.58 114.58 115.97 1dgj h GLU 298 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1dgj h GLU 298 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1dgj h GLU 298 CO 0.07 0.17 0.00 1.63 -1.00 0.00 0.00 179.01 179.87 1dgj n LYS 299 N -3.84 0.99 -3.31 2.33 4.01 -1.06 -4.79 118.16 112.49 1dgj n LYS 299 Ca -0.02 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.39 1dgj n LYS 299 Cb 0.26 -1.18 -0.07 0.00 -0.51 0.00 0.00 35.03 33.53 1dgj n LYS 299 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1dgj s VAL 300 N -2.00 5.15 -0.16 -0.18 1.01 -0.97 -4.05 120.40 119.20 1dgj s VAL 300 Ca 0.17 0.84 -0.08 0.00 0.00 0.00 0.00 61.98 62.91 1dgj s VAL 300 Cb 0.08 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1dgj s VAL 300 CO 0.13 0.21 0.12 -0.54 0.00 0.00 0.00 175.10 175.03 1dgj s LYS 301 N 1.46 3.80 -0.03 2.72 1.02 -1.03 -4.97 119.74 122.70 1dgj s LYS 301 Ca 0.22 -0.20 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1dgj s LYS 301 Cb -0.15 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.84 1dgj s LYS 301 CO 0.09 0.52 -0.02 -0.06 -0.92 0.00 0.00 175.35 174.96 1dgj s PHE 302 N -0.30 3.05 -0.42 3.18 2.99 -1.26 -0.35 117.98 124.87 1dgj s PHE 302 Ca 0.11 0.09 -0.08 0.00 0.00 0.00 0.00 56.93 57.05 1dgj s PHE 302 Cb -0.12 -1.70 0.09 0.00 0.00 0.00 0.00 43.02 41.30 1dgj s PHE 302 CO 0.01 0.43 0.25 0.34 -0.00 0.00 0.00 175.22 176.25 1dgj s ASP 303 N -1.23 5.53 0.33 1.36 2.15 0.61 -4.99 116.67 120.43 1dgj s ASP 303 Ca 0.16 -1.68 0.09 0.00 0.43 0.00 0.00 52.55 51.56 1dgj s ASP 303 Cb -0.11 -1.95 -0.05 0.00 -0.30 0.00 0.00 42.92 40.51 1dgj s ASP 303 CO 0.06 -0.56 -0.01 -0.76 -0.17 0.00 0.00 175.17 173.74 1dgj s LEU 304 N 1.35 2.97 -0.33 -1.34 1.43 -1.26 -0.06 118.68 121.43 1dgj s LEU 304 Ca 0.04 -0.96 -0.00 0.00 -1.03 0.00 0.00 54.13 52.18 1dgj s LEU 304 Cb -0.23 -1.37 0.11 0.00 0.03 0.00 0.00 46.19 44.72 1dgj s LEU 304 CO 0.00 -0.19 0.12 -0.70 0.23 0.00 0.00 176.35 175.81 1dgj s GLU 305 N -3.69 0.84 0.08 1.70 2.12 -0.91 -4.90 118.70 113.94 1dgj s GLU 305 Ca 0.34 -1.26 -0.33 0.00 0.36 0.00 0.00 54.97 54.08 1dgj s GLU 305 Cb -0.01 -2.09 -0.12 0.00 0.26 0.00 0.00 34.13 32.16 1dgj s GLU 305 CO 0.19 -1.02 1.75 1.28 -0.54 0.00 0.00 175.26 176.93 1dgj n LEU 306 N 4.60 3.54 -4.90 2.70 4.77 -1.26 -1.69 117.00 124.77 1dgj n LEU 306 Ca 0.00 1.02 -0.21 0.00 -0.03 0.00 0.00 56.01 56.80 1dgj n LEU 306 Cb 0.41 -1.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 1dgj n LEU 306 CO 0.14 -0.05 -0.05 -0.76 -1.33 0.00 0.00 177.39 175.33 1dgj s LEU 307 N 2.36 3.84 0.67 2.23 1.43 -0.89 -4.94 118.68 123.38 1dgj s LEU 307 Ca 0.83 -0.29 -0.17 0.00 -1.03 0.00 0.00 54.13 53.47 1dgj s LEU 307 Cb -0.61 -2.47 -0.01 0.00 0.03 0.00 0.00 46.19 43.13 1dgj s LEU 307 CO 0.41 -0.27 1.16 -2.65 0.23 0.00 0.00 176.35 175.22 1dgj n PRO 308 N -1.41 0.87 -3.88 1.29 -0.02 -1.26 -4.67 135.00 125.91 1dgj n PRO 308 Ca -0.04 0.35 -0.35 0.00 -2.02 0.00 0.00 63.50 61.44 1dgj n PRO 308 Cb 0.59 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 1dgj n PRO 308 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1dgj s GLU 309 N -3.30 3.22 -0.67 -0.52 2.02 -1.26 -4.78 118.70 113.40 1dgj s GLU 309 Ca 0.79 -0.74 -0.15 0.00 0.02 0.00 0.00 54.97 54.89 1dgj s GLU 309 Cb -0.37 -3.09 0.17 0.00 0.10 0.00 0.00 34.13 30.93 1dgj s GLU 309 CO 0.44 -0.29 0.64 0.71 0.02 0.00 0.00 175.26 176.78 1dgj s TYR 310 N 1.46 3.46 -1.23 1.61 2.02 -1.26 -4.93 117.35 118.47 1dgj s TYR 310 Ca 0.04 -1.58 0.11 0.00 -0.37 0.00 0.00 57.07 55.27 1dgj s TYR 310 Cb -0.15 -3.83 0.45 0.00 -0.40 0.00 0.00 41.96 38.03 1dgj s TYR 310 CO -0.02 -1.03 1.29 -1.33 -1.57 0.00 0.00 175.55 172.89 1dgj n MET 311 N 4.78 2.74 -3.49 -0.62 2.81 -1.26 -0.18 117.12 121.90 1dgj n MET 311 Ca -0.01 -1.77 -0.14 0.00 -1.81 0.00 0.00 57.70 53.97 1dgj n MET 311 Cb 0.43 -1.67 -0.04 0.00 -0.71 0.00 0.00 33.22 31.23 1dgj n MET 311 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1dgj s SER 312 N -0.72 -0.56 0.18 7.83 1.04 -1.26 -4.73 113.70 115.48 1dgj s SER 312 Ca 0.32 0.33 -0.16 0.00 0.48 0.00 0.00 55.95 56.92 1dgj s SER 312 Cb 0.21 0.52 0.15 0.00 0.10 0.00 0.00 66.02 67.00 1dgj s SER 312 CO 0.15 -0.72 1.64 0.00 0.98 0.00 0.00 173.24 175.29 1dgj h ALA 313 N 2.46 0.26 -0.46 5.32 0.00 -1.93 -2.16 119.26 122.76 1dgj h ALA 313 Ca -0.28 0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.88 1dgj h ALA 313 Cb 1.22 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 1dgj h ALA 313 CO 0.37 -0.48 0.13 -1.35 0.00 0.00 0.00 179.25 177.92 1dgj h PRO 314 N -0.04 0.27 -0.74 0.00 0.11 -1.98 -1.60 132.00 128.02 1dgj h PRO 314 Ca 0.24 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.37 1dgj h PRO 314 Cb 0.41 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.40 1dgj h PRO 314 CO -0.53 0.18 0.46 0.93 -0.21 0.00 0.00 178.00 178.83 1dgj h GLU 315 N 0.28 0.85 0.00 1.05 5.08 -1.82 -0.77 114.58 119.25 1dgj h GLU 315 Ca 0.22 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1dgj h GLU 315 Cb 0.25 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1dgj h GLU 315 CO -0.26 0.56 0.00 0.00 -1.00 0.00 0.00 179.01 178.31 1dgj n ALA 316 N -2.33 1.98 0.22 3.43 0.00 -0.87 -2.93 120.51 120.01 1dgj n ALA 316 Ca 0.09 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.61 1dgj n ALA 316 Cb 0.12 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.15 1dgj n ALA 316 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1dgj n MET 317 N -1.76 0.52 -1.57 0.00 2.81 -0.39 -4.81 117.12 111.91 1dgj n MET 317 Ca 0.05 -0.00 -0.44 0.00 -1.81 0.00 0.00 57.70 55.50 1dgj n MET 317 Cb 0.28 -1.67 -0.01 0.00 -0.71 0.00 0.00 33.22 31.11 1dgj n MET 317 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dgj n ALA 318 N -2.09 -0.39 0.24 3.04 0.00 -0.62 -4.84 120.51 115.86 1dgj n ALA 318 Ca -0.00 0.34 0.17 0.00 0.00 0.00 0.00 53.44 53.95 1dgj n ALA 318 Cb 0.52 -1.99 0.88 0.00 0.00 0.00 0.00 19.45 18.86 1dgj n ALA 318 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1dgj h PRO 319 N 1.74 0.00 -0.01 0.00 0.13 -1.92 -2.00 132.00 129.94 1dgj h PRO 319 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1dgj h PRO 319 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1dgj h PRO 319 CO 0.59 0.00 -0.43 -0.40 -0.23 0.00 0.00 178.00 177.53 1dgj n ASP 320 N -3.70 1.20 -4.74 1.44 5.75 -1.26 -4.95 116.55 110.29 1dgj n ASP 320 Ca 0.00 -0.96 -0.42 0.00 -0.01 0.00 0.00 54.79 53.40 1dgj n ASP 320 Cb 0.26 0.33 -0.02 0.00 -1.03 0.00 0.00 41.12 40.66 1dgj n ASP 320 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dgj n ALA 321 N -0.71 2.60 -1.99 2.12 0.00 -0.75 -5.00 120.51 116.79 1dgj n ALA 321 Ca 0.10 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.60 1dgj n ALA 321 Cb 0.38 -2.48 -0.04 0.00 0.00 0.00 0.00 19.45 17.31 1dgj n ALA 321 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1dgj s ILE 322 N 0.25 4.61 0.01 0.00 -4.36 -1.26 -4.99 121.20 115.45 1dgj s ILE 322 Ca 0.66 1.03 -0.30 0.00 -0.26 0.00 0.00 60.65 61.78 1dgj s ILE 322 Cb -0.50 -3.69 -0.07 0.00 1.25 0.00 0.00 42.46 39.46 1dgj s ILE 322 CO 0.45 -0.51 1.57 -1.61 0.24 0.00 0.00 174.94 175.08 1dgj s GLU 323 N -3.72 4.22 0.17 0.37 2.02 -1.26 -4.87 118.70 115.62 1dgj s GLU 323 Ca 0.56 2.17 -0.12 0.00 0.02 0.00 0.00 54.97 57.60 1dgj s GLU 323 Cb -0.10 -3.70 0.06 0.00 0.10 0.00 0.00 34.13 30.48 1dgj s GLU 323 CO 0.27 -0.72 1.67 0.82 0.02 0.00 0.00 175.26 177.32 1dgj h ILE 324 N 5.07 1.25 -3.49 -1.63 2.04 -1.95 -3.34 117.51 115.46 1dgj h ILE 324 Ca -0.40 -0.90 -0.71 0.00 1.00 0.00 0.00 64.86 63.85 1dgj h ILE 324 Cb 1.19 0.74 -0.33 0.00 -0.74 0.00 0.00 36.82 37.68 1dgj h ILE 324 CO 0.93 0.33 -0.40 -1.00 0.00 0.00 0.00 178.15 178.02 1dgj s HIS 325 N -5.29 3.49 -0.07 1.37 3.76 -1.26 -5.06 115.29 112.23 1dgj s HIS 325 Ca -0.13 -2.40 -0.40 0.00 -0.15 0.00 0.00 55.06 51.99 1dgj s HIS 325 Cb 0.13 -3.31 -0.18 0.00 1.11 0.00 0.00 32.58 30.32 1dgj s HIS 325 CO 0.81 -0.93 1.35 -2.30 -0.85 0.00 0.00 174.74 172.82 1dgj n PRO 326 N 4.17 0.62 -0.49 8.40 -0.02 -1.26 -1.33 135.00 145.09 1dgj n PRO 326 Ca 0.02 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1dgj n PRO 326 Cb 0.40 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1dgj n PRO 326 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dgj n GLY 327 N 2.62 0.75 3.01 -1.23 0.00 -1.26 -5.04 105.19 104.05 1dgj n GLY 327 Ca 0.22 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 1dgj n GLY 327 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dgj s THR 328 N -2.25 -0.12 0.57 2.61 2.01 -0.44 -5.02 115.64 113.00 1dgj s THR 328 Ca 0.00 0.19 -0.20 0.00 0.31 0.00 0.00 61.69 61.99 1dgj s THR 328 Cb 0.00 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 1dgj s THR 328 CO 0.00 0.08 1.23 -2.84 -0.69 0.00 0.00 174.62 172.40 1dgj s PRO 329 N 1.52 3.09 0.62 4.92 0.02 -1.26 -4.44 135.00 139.48 1dgj s PRO 329 Ca -0.07 1.89 0.39 0.00 0.02 0.00 0.00 61.00 63.23 1dgj s PRO 329 Cb -0.11 -2.04 2.08 0.00 0.02 0.00 0.00 34.50 34.45 1dgj s PRO 329 CO -0.08 -1.12 2.27 -0.91 -0.33 0.00 0.00 177.00 176.82 1dgj h ASN 330 N 1.12 0.00 -3.86 2.53 2.35 -1.90 -3.20 115.58 112.62 1dgj h ASN 330 Ca -0.50 0.00 -0.77 0.00 -0.55 0.00 0.00 56.30 54.48 1dgj h ASN 330 Cb 1.29 0.00 -0.28 0.00 0.05 0.00 0.00 38.32 39.38 1dgj h ASN 330 CO 0.56 0.01 -0.02 -0.69 -1.65 0.00 0.00 177.43 175.65 1dgj s VAL 331 N -4.15 5.19 -2.45 2.81 1.01 -1.26 0.00 120.40 121.55 1dgj s VAL 331 Ca -0.04 -2.53 0.25 0.00 0.00 0.00 0.00 61.98 59.66 1dgj s VAL 331 Cb 0.13 -4.24 0.48 0.00 0.00 0.00 0.00 36.38 32.75 1dgj s VAL 331 CO 0.47 -0.99 1.62 0.00 0.00 0.00 0.00 175.10 176.20 1dgj n TYR 332 N 3.92 0.10 -3.71 5.22 0.18 -1.03 -4.91 117.16 116.93 1dgj n TYR 332 Ca 0.11 -0.05 -0.12 0.00 1.88 0.00 0.00 57.90 59.72 1dgj n TYR 332 Cb 0.45 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.30 1dgj n TYR 332 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 1dgj s TYR 333 N -1.90 -0.53 -0.08 -3.48 6.14 -1.24 0.04 117.35 116.30 1dgj s TYR 333 Ca 0.35 1.20 0.05 0.00 0.64 0.00 0.00 57.07 59.31 1dgj s TYR 333 Cb 0.20 0.21 -0.01 0.00 0.42 0.00 0.00 41.96 42.78 1dgj s TYR 333 CO 0.30 -0.28 -0.24 -0.51 0.64 0.00 0.00 175.55 175.47 1dgj s ASP 334 N 0.74 3.16 -0.11 4.32 1.01 -1.26 -2.12 116.67 122.42 1dgj s ASP 334 Ca -0.04 -0.52 0.03 0.00 0.71 0.00 0.00 52.55 52.73 1dgj s ASP 334 Cb -0.05 -1.20 0.00 0.00 1.01 0.00 0.00 42.92 42.68 1dgj s ASP 334 CO -0.05 0.20 -0.22 -1.58 0.21 0.00 0.00 175.17 173.72 1dgj s GLN 335 N 0.13 2.90 0.15 8.23 2.00 -0.76 -4.95 119.66 127.36 1dgj s GLN 335 Ca -0.12 -0.82 0.04 0.00 -2.00 0.00 0.00 55.36 52.45 1dgj s GLN 335 Cb -0.16 -2.25 -0.04 0.00 0.80 0.00 0.00 33.01 31.37 1dgj s GLN 335 CO 0.07 0.11 0.20 -0.51 -0.50 0.00 0.00 175.29 174.66 1dgj s LEU 336 N 0.51 4.06 -0.22 3.68 1.43 -1.25 0.34 118.68 127.23 1dgj s LEU 336 Ca -0.15 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1dgj s LEU 336 Cb -0.17 -2.66 0.09 0.00 0.03 0.00 0.00 46.19 43.49 1dgj s LEU 336 CO 0.06 0.07 0.20 -0.70 0.23 0.00 0.00 176.35 176.20 1dgj s GLU 337 N -3.13 0.19 -0.11 1.70 2.56 -0.90 -3.42 118.70 115.59 1dgj s GLU 337 Ca 0.33 0.03 -0.01 0.00 0.00 0.00 0.00 54.97 55.31 1dgj s GLU 337 Cb -0.11 -1.23 0.04 0.00 2.00 0.00 0.00 34.13 34.83 1dgj s GLU 337 CO 0.26 -0.75 -0.01 -1.21 -0.56 0.00 0.00 175.26 172.99 1dgj s GLU 338 N 2.28 0.82 -0.01 4.30 2.02 -0.65 -1.18 118.70 126.27 1dgj s GLU 338 Ca 0.07 -0.11 0.01 0.00 0.02 0.00 0.00 54.97 54.95 1dgj s GLU 338 Cb -0.16 -1.40 0.00 0.00 0.10 0.00 0.00 34.13 32.67 1dgj s GLU 338 CO -0.17 -0.39 -0.03 0.21 0.02 0.00 0.00 175.26 174.90 1dgj s LYS 339 N 1.88 0.31 2.93 1.61 2.20 -0.38 -4.84 119.74 123.45 1dgj s LYS 339 Ca 0.03 -0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 1dgj s LYS 339 Cb -0.14 -0.32 0.00 0.00 -1.51 0.00 0.00 37.83 35.86 1dgj s LYS 339 CO -0.06 0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.39 1dgj n GLY 340 N 3.12 0.08 3.93 5.54 0.00 -1.22 -0.15 105.19 116.48 1dgj n GLY 340 Ca -0.14 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.65 1dgj n GLY 340 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dgj s GLU 341 N 0.00 1.79 0.33 1.61 2.02 -1.26 -4.85 118.70 118.34 1dgj s GLU 341 Ca 0.00 -0.32 -0.29 0.00 0.02 0.00 0.00 54.97 54.39 1dgj s GLU 341 Cb 0.00 -2.09 -0.12 0.00 0.10 0.00 0.00 34.13 32.03 1dgj s GLU 341 CO 0.00 -1.56 1.47 -3.47 0.02 0.00 0.00 175.26 171.72 1dgj n ASP 342 N -3.15 3.50 0.01 -0.19 2.03 -1.26 -4.47 116.55 113.02 1dgj n ASP 342 Ca 0.10 1.19 0.12 0.00 0.52 0.00 0.00 54.79 56.72 1dgj n ASP 342 Cb 0.60 -1.57 0.22 0.00 -0.72 0.00 0.00 41.12 39.66 1dgj n ASP 342 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1dgj n THR 343 N 1.03 0.03 -0.30 5.18 -2.24 -1.26 -4.45 114.28 112.27 1dgj n THR 343 Ca 0.05 -0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.77 1dgj n THR 343 Cb 0.37 0.24 0.12 0.00 -2.10 0.00 0.00 70.33 68.96 1dgj n THR 343 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1dgj h VAL 344 N 0.00 1.25 0.00 2.28 3.04 -2.00 -2.22 116.25 118.60 1dgj h VAL 344 Ca 0.00 -0.64 -0.00 0.00 -1.01 0.00 0.00 66.70 65.05 1dgj h VAL 344 Cb 0.53 0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.93 1dgj h VAL 344 CO 0.00 0.28 -0.02 -0.65 -1.01 0.00 0.00 177.57 176.18 1dgj h PRO 345 N 1.18 0.00 0.05 4.17 0.11 -1.98 -0.99 132.00 134.54 1dgj h PRO 345 Ca 0.29 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.16 1dgj h PRO 345 Cb 0.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.14 1dgj h PRO 345 CO -0.05 0.02 -1.15 0.74 -0.21 0.00 0.00 178.00 177.35 1dgj h PHE 346 N 0.00 0.19 0.00 0.65 -1.00 -1.70 -3.07 116.94 112.02 1dgj h PHE 346 Ca -0.00 -0.14 -0.08 0.00 2.81 0.00 0.00 57.97 60.56 1dgj h PHE 346 Cb 0.17 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 1dgj h PHE 346 CO 0.00 1.12 -0.92 0.74 -1.61 0.00 0.00 178.31 177.64 1dgj h PHE 347 N 0.03 0.00 -0.00 -0.55 -1.00 -1.23 -3.31 116.94 110.88 1dgj h PHE 347 Ca -0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.70 1dgj h PHE 347 Cb 1.87 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.43 1dgj h PHE 347 CO 0.03 0.30 -0.35 0.09 -1.61 0.00 0.00 178.31 176.77 1dgj n ASN 348 N -2.91 0.50 -4.63 2.17 3.02 -0.45 -4.81 115.26 108.15 1dgj n ASN 348 Ca -0.02 -0.27 -0.42 0.00 -0.03 0.00 0.00 54.58 53.83 1dgj n ASN 348 Cb 0.68 0.08 -0.04 0.00 -0.61 0.00 0.00 39.78 39.90 1dgj n ASN 348 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1dgj s ASP 349 N -2.87 6.79 0.31 6.41 3.68 -1.16 -4.91 116.67 124.92 1dgj s ASP 349 Ca 0.15 0.87 0.22 0.00 2.13 0.00 0.00 52.55 55.92 1dgj s ASP 349 Cb 0.18 -2.45 1.15 0.00 -1.45 0.00 0.00 42.92 40.35 1dgj s ASP 349 CO 0.62 -0.66 1.67 -2.65 0.13 0.00 0.00 175.17 174.28 1dgj n PRO 350 N 6.32 0.15 0.13 4.34 -0.02 -1.26 -2.17 135.00 142.48 1dgj n PRO 350 Ca 0.06 0.61 0.12 0.00 -2.02 0.00 0.00 63.50 62.28 1dgj n PRO 350 Cb 0.48 -1.95 0.17 0.00 -0.02 0.00 0.00 33.50 32.17 1dgj n PRO 350 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dgj h ALA 351 N 2.03 0.76 -2.25 3.55 0.00 -1.95 -3.47 119.26 117.94 1dgj h ALA 351 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 1dgj h ALA 351 Cb 0.04 0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.87 1dgj h ALA 351 CO 0.00 0.00 0.06 -0.80 0.00 0.00 0.00 179.25 178.51 1dgj s ASN 352 N -5.19 6.04 -0.26 0.00 0.01 -0.92 -4.63 114.94 109.98 1dgj s ASN 352 Ca 0.05 0.72 -0.10 0.00 -0.71 0.00 0.00 52.86 52.82 1dgj s ASN 352 Cb 0.10 -1.98 -0.05 0.00 0.41 0.00 0.00 41.25 39.73 1dgj s ASN 352 CO 0.70 -0.68 0.15 -0.69 -1.51 0.00 0.00 177.10 175.08 1dgj s VAL 353 N -2.72 5.11 -0.10 1.60 1.01 0.92 -4.93 120.40 121.29 1dgj s VAL 353 Ca 0.48 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1dgj s VAL 353 Cb -0.10 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1dgj s VAL 353 CO 0.43 0.30 -0.08 -0.69 0.00 0.00 0.00 175.10 175.05 1dgj s VAL 354 N 1.51 3.53 -0.09 2.92 1.01 -1.26 -1.13 120.40 126.89 1dgj s VAL 354 Ca 0.07 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1dgj s VAL 354 Cb -0.15 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.77 1dgj s VAL 354 CO 0.08 0.56 -0.18 0.00 0.00 0.00 0.00 175.10 175.56 1dgj s ALA 355 N -0.34 1.77 0.13 5.51 0.00 -1.00 -5.01 121.76 122.83 1dgj s ALA 355 Ca 0.04 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.32 1dgj s ALA 355 Cb -0.13 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 1dgj s ALA 355 CO 0.02 0.16 -0.12 -2.00 0.00 0.00 0.00 175.76 173.83 1dgj s GLU 356 N 0.56 1.01 -0.19 0.00 2.12 -1.26 -1.56 118.70 119.39 1dgj s GLU 356 Ca -0.15 -1.32 -0.33 0.00 0.36 0.00 0.00 54.97 53.52 1dgj s GLU 356 Cb -0.17 -0.72 0.14 0.00 0.26 0.00 0.00 34.13 33.65 1dgj s GLU 356 CO 0.05 0.11 1.19 0.20 -0.54 0.00 0.00 175.26 176.27 1dgj s GLY 357 N -2.78 -0.24 -0.12 -1.50 0.00 -0.79 -5.01 107.32 96.88 1dgj s GLY 357 Ca 0.12 1.81 0.02 0.00 0.00 0.00 0.00 44.72 46.67 1dgj s GLY 357 CO 0.02 0.67 -0.18 -0.56 0.00 0.00 0.00 173.10 173.05 1dgj s SER 358 N -1.88 3.58 0.27 1.64 0.01 -1.26 -1.88 113.70 114.17 1dgj s SER 358 Ca 0.08 -0.45 0.06 0.00 1.31 0.00 0.00 55.95 56.95 1dgj s SER 358 Cb -0.01 -1.52 -0.06 0.00 0.21 0.00 0.00 66.02 64.64 1dgj s SER 358 CO -0.05 0.15 -0.04 -0.31 0.41 0.00 0.00 173.24 173.40 1dgj s TYR 359 N 0.44 1.84 -0.08 2.43 1.51 0.19 -4.84 117.35 118.83 1dgj s TYR 359 Ca -0.13 -0.77 -0.03 0.00 -1.01 0.00 0.00 57.07 55.13 1dgj s TYR 359 Cb -0.17 -1.06 0.04 0.00 -0.11 0.00 0.00 41.96 40.67 1dgj s TYR 359 CO 0.06 0.18 0.16 -0.47 -1.11 0.00 0.00 175.55 174.37 1dgj s TYR 360 N -3.13 -0.18 -0.14 2.71 6.14 0.93 -1.48 117.35 122.19 1dgj s TYR 360 Ca 0.29 0.58 -0.06 0.00 0.64 0.00 0.00 57.07 58.52 1dgj s TYR 360 Cb 0.04 -0.18 -0.04 0.00 0.42 0.00 0.00 41.96 42.21 1dgj s TYR 360 CO 0.11 -0.23 0.06 0.95 0.64 0.00 0.00 175.55 177.08 1dgj s THR 361 N 1.85 4.83 1.03 4.34 -4.23 -0.90 -1.41 115.64 121.16 1dgj s THR 361 Ca -0.02 -0.04 -0.17 0.00 -1.18 0.00 0.00 61.69 60.29 1dgj s THR 361 Cb -0.12 -3.11 0.22 0.00 1.34 0.00 0.00 72.50 70.83 1dgj s THR 361 CO -0.06 0.55 1.24 0.00 -0.54 0.00 0.00 174.62 175.81 1dgj s GLN 362 N -0.39 0.10 -1.32 3.99 0.00 -1.26 -2.30 119.66 118.48 1dgj s GLN 362 Ca 0.09 -0.25 -0.11 0.00 -0.00 0.00 0.00 55.36 55.10 1dgj s GLN 362 Cb -0.12 -1.77 0.14 0.00 0.00 0.00 0.00 33.01 31.26 1dgj s GLN 362 CO 0.02 -2.80 1.93 -2.13 0.00 0.00 0.00 175.29 172.30 1dgj n ARG 363 N -4.08 3.42 -1.92 9.60 0.63 -1.26 -3.95 116.66 119.11 1dgj n ARG 363 Ca 0.14 -3.33 -0.42 0.00 -0.92 0.00 0.00 57.85 53.32 1dgj n ARG 363 Cb 0.59 -3.03 -0.03 0.00 0.45 0.00 0.00 32.46 30.45 1dgj n ARG 363 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 1dgj s GLN 364 N 1.19 4.20 0.10 -0.14 0.74 -1.25 -1.68 119.66 122.82 1dgj s GLN 364 Ca 0.42 2.35 -0.27 0.00 0.05 0.00 0.00 55.36 57.90 1dgj s GLN 364 Cb 0.10 -3.54 -0.06 0.00 1.10 0.00 0.00 33.01 30.60 1dgj s GLN 364 CO -0.02 -0.72 0.85 -1.25 -0.55 0.00 0.00 175.29 173.60 1dgj s PRO 365 N 2.46 4.60 0.42 1.67 0.04 -1.26 -1.63 135.00 141.29 1dgj s PRO 365 Ca 0.74 1.25 0.08 0.00 0.04 0.00 0.00 61.00 63.11 1dgj s PRO 365 Cb -0.41 -3.35 0.90 0.00 0.04 0.00 0.00 34.50 31.69 1dgj s PRO 365 CO 0.32 0.32 2.05 0.45 0.04 0.00 0.00 177.00 180.18 1dgj h HIS 366 N 5.34 0.48 -6.49 0.56 3.86 -1.90 -3.48 115.15 113.53 1dgj h HIS 366 Ca -0.44 0.01 -0.49 0.00 -1.16 0.00 0.00 60.37 58.29 1dgj h HIS 366 Cb 1.21 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 29.51 1dgj h HIS 366 CO 0.65 0.29 -0.93 1.28 0.86 0.00 0.00 177.93 180.08 1dgj n LEU 367 N -4.48 -2.11 -4.78 2.43 4.77 -1.26 -4.93 117.00 106.64 1dgj n LEU 367 Ca 0.04 -1.07 -0.36 0.00 -0.03 0.00 0.00 56.01 54.59 1dgj n LEU 367 Cb 0.11 -2.17 -0.05 0.00 -2.33 0.00 0.00 43.42 38.97 1dgj n LEU 367 CO 0.35 0.51 0.69 -2.16 -1.33 0.00 0.00 177.39 175.45 1dgj s PRO 368 N -6.50 4.38 0.36 3.23 0.04 -1.26 -4.83 135.00 130.41 1dgj s PRO 368 Ca 0.26 1.40 0.05 0.00 0.04 0.00 0.00 61.00 62.74 1dgj s PRO 368 Cb -0.11 -2.64 0.68 0.00 0.04 0.00 0.00 34.50 32.47 1dgj s PRO 368 CO 0.90 0.07 1.96 0.82 0.04 0.00 0.00 177.00 180.78 1dgj h ILE 369 N 2.38 1.16 -3.63 0.56 1.08 -1.91 -3.39 117.51 113.76 1dgj h ILE 369 Ca -0.48 -0.51 -0.64 0.00 -0.39 0.00 0.00 64.86 62.85 1dgj h ILE 369 Cb 1.20 0.67 -0.15 0.00 -3.07 0.00 0.00 36.82 35.47 1dgj h ILE 369 CO 0.64 0.20 -0.10 -0.70 -0.69 0.00 0.00 178.15 177.50 1dgj s GLU 370 N -5.28 3.79 1.06 2.37 2.12 -1.26 -4.26 118.70 117.24 1dgj s GLU 370 Ca -0.08 -0.03 -0.12 0.00 0.36 0.00 0.00 54.97 55.09 1dgj s GLU 370 Cb 0.16 -3.74 0.22 0.00 0.26 0.00 0.00 34.13 31.03 1dgj s GLU 370 CO 0.76 -0.50 1.07 -1.25 -0.54 0.00 0.00 175.26 174.79 1dgj s PRO 371 N 2.29 -0.07 0.68 4.30 0.04 -1.26 -4.93 135.00 136.05 1dgj s PRO 371 Ca 0.18 0.82 -0.17 0.00 0.04 0.00 0.00 61.00 61.87 1dgj s PRO 371 Cb -0.16 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.73 1dgj s PRO 371 CO 0.12 -3.15 1.19 -3.47 0.04 0.00 0.00 177.00 171.73 1dgj n ASP 372 N -4.51 1.49 -3.56 6.66 4.64 -1.26 -4.86 116.55 115.16 1dgj n ASP 372 Ca 0.05 0.76 -0.11 0.00 -1.38 0.00 0.00 54.79 54.11 1dgj n ASP 372 Cb 0.55 -1.51 -0.05 0.00 -1.04 0.00 0.00 41.12 39.07 1dgj n ASP 372 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1dgj s VAL 373 N -1.59 0.00 -0.03 5.18 0.11 -1.26 -2.27 120.40 120.54 1dgj s VAL 373 Ca 0.79 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.54 1dgj s VAL 373 Cb -0.36 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.60 1dgj s VAL 373 CO 0.44 0.00 1.25 -0.83 -3.33 0.00 0.00 175.10 172.63 1dgj s GLY 374 N -1.24 -0.38 0.27 6.54 0.00 -0.67 -4.05 107.32 107.79 1dgj s GLY 374 Ca -0.02 0.78 -0.04 0.00 0.00 0.00 0.00 44.72 45.43 1dgj s GLY 374 CO 0.02 0.17 0.34 -2.52 0.00 0.00 0.00 173.10 171.11 1dgj s TYR 375 N -2.50 0.98 0.25 1.90 1.13 -0.58 -1.09 117.35 117.44 1dgj s TYR 375 Ca 0.13 -1.20 -0.20 0.00 -1.41 0.00 0.00 57.07 54.39 1dgj s TYR 375 Cb 0.04 -0.23 0.02 0.00 -1.10 0.00 0.00 41.96 40.69 1dgj s TYR 375 CO -0.04 -0.91 0.65 0.20 -2.51 0.00 0.00 175.55 172.94 1dgj s GLY 376 N -3.17 -0.07 0.17 5.49 0.00 -0.53 -0.44 107.32 108.77 1dgj s GLY 376 Ca 0.32 -0.28 -0.24 0.00 0.00 0.00 0.00 44.72 44.52 1dgj s GLY 376 CO 0.15 -0.16 0.98 -2.52 0.00 0.00 0.00 173.10 171.56 1dgj s TYR 377 N -3.91 -0.05 -0.20 1.90 -0.85 -0.41 -1.62 117.35 112.21 1dgj s TYR 377 Ca 0.11 -0.30 -0.15 0.00 -0.52 0.00 0.00 57.07 56.21 1dgj s TYR 377 Cb -0.04 0.67 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 1dgj s TYR 377 CO 0.04 -0.89 0.37 0.42 -1.52 0.00 0.00 175.55 173.96 1dgj s ILE 378 N -2.88 5.22 0.85 -3.49 -1.09 -1.26 -1.02 121.20 117.55 1dgj s ILE 378 Ca 0.15 0.64 -0.10 0.00 -2.23 0.00 0.00 60.65 59.11 1dgj s ILE 378 Cb -0.02 -3.70 0.11 0.00 -1.58 0.00 0.00 42.46 37.27 1dgj s ILE 378 CO 0.04 0.27 1.13 0.21 -1.23 0.00 0.00 174.94 175.36 1dgj s ASN 379 N 0.99 3.55 0.00 3.58 2.47 0.21 -4.89 114.94 120.85 1dgj s ASN 379 Ca 0.18 2.06 0.06 0.00 0.42 0.00 0.00 52.86 55.57 1dgj s ASN 379 Cb -0.14 -2.55 0.34 0.00 -1.45 0.00 0.00 41.25 37.44 1dgj s ASN 379 CO 0.07 -2.68 1.07 1.21 -3.72 0.00 0.00 177.10 173.05 1dgj n GLU 380 N -3.92 0.83 -0.23 0.43 4.07 -1.26 -1.78 120.64 118.78 1dgj n GLU 380 Ca 0.11 0.00 0.04 0.00 -0.06 0.00 0.00 57.16 57.24 1dgj n GLU 380 Cb 0.52 -1.11 0.05 0.00 -0.06 0.00 0.00 31.44 30.85 1dgj n GLU 380 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1dgj n GLN 381 N -0.61 0.80 -0.99 5.31 6.02 -1.26 -4.99 117.38 121.67 1dgj n GLN 381 Ca 0.04 -1.56 0.00 0.00 -0.01 0.00 0.00 57.00 55.47 1dgj n GLN 381 Cb 0.02 -0.92 0.00 0.00 1.02 0.00 0.00 30.24 30.36 1dgj n GLN 381 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dgj n GLY 382 N -0.58 0.67 3.86 1.08 0.00 -0.74 -5.04 105.19 104.45 1dgj n GLY 382 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1dgj n GLY 382 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dgj s GLN 383 N -0.09 3.90 -0.22 1.61 -0.21 -1.26 -4.76 119.66 118.64 1dgj s GLN 383 Ca 0.00 0.56 -0.20 0.00 0.02 0.00 0.00 55.36 55.74 1dgj s GLN 383 Cb 0.00 -2.43 -0.03 0.00 1.00 0.00 0.00 33.01 31.55 1dgj s GLN 383 CO 0.00 0.10 0.59 0.08 -2.12 0.00 0.00 175.29 173.94 1dgj s VAL 384 N -2.12 5.04 -0.19 1.09 1.01 0.13 0.64 120.40 126.01 1dgj s VAL 384 Ca 0.52 1.08 -0.05 0.00 0.00 0.00 0.00 61.98 63.53 1dgj s VAL 384 Cb -0.10 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1dgj s VAL 384 CO 0.23 0.10 0.01 -0.69 0.00 0.00 0.00 175.10 174.75 1dgj s VAL 385 N 2.04 4.17 -0.12 2.92 1.01 -0.18 -0.56 120.40 129.68 1dgj s VAL 385 Ca 0.26 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.02 1dgj s VAL 385 Cb -0.16 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.36 1dgj s VAL 385 CO 0.10 0.45 -0.21 -0.63 0.00 0.00 0.00 175.10 174.81 1dgj s ILE 386 N 0.71 1.88 -0.16 2.22 1.01 0.53 -1.29 121.20 126.11 1dgj s ILE 386 Ca 0.00 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.71 1dgj s ILE 386 Cb -0.14 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 1dgj s ILE 386 CO 0.02 0.52 0.05 -1.00 0.00 0.00 0.00 174.94 174.53 1dgj s HIS 387 N 0.70 3.25 0.09 3.97 3.76 0.41 -0.36 115.29 127.11 1dgj s HIS 387 Ca -0.11 0.11 -0.04 0.00 -0.15 0.00 0.00 55.06 54.86 1dgj s HIS 387 Cb -0.16 -2.00 0.02 0.00 1.11 0.00 0.00 32.58 31.54 1dgj s HIS 387 CO 0.02 0.25 0.22 -1.13 -0.85 0.00 0.00 174.74 173.25 1dgj n SER 388 N 3.13 -0.58 -0.51 1.40 3.41 -0.62 -1.52 113.62 118.33 1dgj n SER 388 Ca -0.17 -1.38 0.12 0.00 -0.26 0.00 0.00 58.87 57.17 1dgj n SER 388 Cb 0.53 0.96 0.45 0.00 -0.26 0.00 0.00 64.21 65.88 1dgj n SER 388 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1dgj n LYS 389 N -0.15 1.68 -1.36 4.33 5.02 -1.26 -0.41 118.16 126.01 1dgj n LYS 389 Ca -0.02 -1.02 -0.54 0.00 -2.02 0.00 0.00 58.31 54.72 1dgj n LYS 389 Cb 0.16 -1.43 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 1dgj n LYS 389 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1dgj n SER 390 N 0.23 0.07 -1.41 4.39 2.88 -1.26 -4.85 113.62 113.67 1dgj n SER 390 Ca 0.17 1.04 -0.04 0.00 -1.33 0.00 0.00 58.87 58.72 1dgj n SER 390 Cb 0.33 -0.82 0.24 0.00 -0.75 0.00 0.00 64.21 63.21 1dgj n SER 390 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1dgj n VAL 391 N 1.52 2.66 -2.73 2.46 0.24 -1.12 -4.55 118.33 116.81 1dgj n VAL 391 Ca 0.19 -2.17 -0.09 0.00 -2.04 0.00 0.00 64.34 60.23 1dgj n VAL 391 Cb 0.06 -0.33 0.09 0.00 -1.47 0.00 0.00 33.84 32.19 1dgj n VAL 391 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1dgj n ALA 392 N -0.76 -0.94 -0.33 2.33 0.00 -1.26 -1.06 120.51 118.50 1dgj n ALA 392 Ca 0.35 -1.40 0.10 0.00 0.00 0.00 0.00 53.44 52.50 1dgj n ALA 392 Cb 1.16 -1.28 0.31 0.00 0.00 0.00 0.00 19.45 19.65 1dgj n ALA 392 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1dgj h ILE 393 N 2.85 0.84 -0.06 0.00 3.07 -1.92 0.56 117.51 122.84 1dgj h ILE 393 Ca -0.11 -0.28 -0.23 0.00 1.55 0.00 0.00 64.86 65.78 1dgj h ILE 393 Cb 1.11 -0.07 0.01 0.00 -0.27 0.00 0.00 36.82 37.60 1dgj h ILE 393 CO 0.12 0.15 -0.88 0.45 -1.05 0.00 0.00 178.15 176.94 1dgj h HIS 394 N 0.83 0.86 -0.42 0.16 3.86 -1.95 -2.75 115.15 115.74 1dgj h HIS 394 Ca 0.50 -0.42 -0.12 0.00 -1.16 0.00 0.00 60.37 59.17 1dgj h HIS 394 Cb 0.68 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 1dgj h HIS 394 CO -0.00 1.24 -0.21 1.25 0.86 0.00 0.00 177.93 181.07 1dgj h LEU 395 N 0.38 0.91 -0.93 2.43 5.85 -1.75 -3.03 115.31 119.17 1dgj h LEU 395 Ca -0.08 -0.41 -0.11 0.00 0.84 0.00 0.00 57.88 58.13 1dgj h LEU 395 Cb 1.51 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 1dgj h LEU 395 CO 0.17 1.11 -0.52 0.45 -0.34 0.00 0.00 178.44 179.31 1dgj h HIS 396 N 0.70 0.04 -0.35 1.25 3.86 -0.98 -1.68 115.15 117.99 1dgj h HIS 396 Ca 0.09 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1dgj h HIS 396 Cb 0.78 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 29.22 1dgj h HIS 396 CO 0.06 0.55 0.18 0.00 0.86 0.00 0.00 177.93 179.57 1dgj h ALA 397 N 1.45 0.46 -0.24 2.45 0.00 -1.40 -1.70 119.26 120.28 1dgj h ALA 397 Ca -0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1dgj h ALA 397 Cb 0.93 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1dgj h ALA 397 CO 0.07 0.01 -0.19 -0.07 0.00 0.00 0.00 179.25 179.07 1dgj h LEU 398 N 0.44 0.41 -0.97 0.00 4.07 -1.40 -0.69 115.31 117.18 1dgj h LEU 398 Ca 0.12 -0.12 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 1dgj h LEU 398 Cb 0.10 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 41.72 1dgj h LEU 398 CO -0.02 0.62 -0.16 0.24 -1.08 0.00 0.00 178.44 178.04 1dgj h MET 399 N 0.38 0.00 0.00 1.13 2.86 -0.80 -3.35 114.93 115.16 1dgj h MET 399 Ca 0.07 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 1dgj h MET 399 Cb 0.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1dgj h MET 399 CO 0.04 0.16 -1.45 0.44 1.06 0.00 0.00 176.91 177.16 1dgj n ILE 400 N -3.25 0.24 -0.20 -1.22 -5.35 -0.68 -2.31 119.36 106.58 1dgj n ILE 400 Ca 0.01 -0.25 -0.02 0.00 -0.27 0.00 0.00 62.75 62.21 1dgj n ILE 400 Cb 0.43 -0.19 0.04 0.00 -1.74 0.00 0.00 39.64 38.19 1dgj n ILE 400 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1dgj h ALA 401 N 0.59 0.23 -0.88 -1.28 0.00 -1.26 -2.42 119.26 114.23 1dgj h ALA 401 Ca -0.09 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1dgj h ALA 401 Cb 0.87 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 1dgj h ALA 401 CO 0.01 -0.53 0.48 -1.35 0.00 0.00 0.00 179.25 177.86 1dgj h PRO 402 N -0.08 1.22 0.00 0.00 0.11 -1.80 0.50 132.00 131.96 1dgj h PRO 402 Ca 0.27 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1dgj h PRO 402 Cb 0.51 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.38 1dgj h PRO 402 CO -0.66 0.89 0.00 0.78 -0.21 0.00 0.00 178.00 178.81 1dgj h GLY 403 N 1.24 0.00 0.29 -0.55 0.00 -1.51 -1.76 103.07 100.78 1dgj h GLY 403 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1dgj h GLY 403 CO -0.05 0.00 -1.43 1.04 0.00 0.00 0.00 176.54 176.10 1dgj n LEU 404 N -2.50 0.45 -0.14 3.11 4.77 -0.89 -1.54 117.00 120.26 1dgj n LEU 404 Ca 0.02 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1dgj n LEU 404 Cb 0.28 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1dgj n LEU 404 CO 0.23 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1dgj n GLY 405 N 1.32 0.65 3.61 -0.72 0.00 -0.48 -2.84 105.19 106.73 1dgj n GLY 405 Ca -0.00 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.99 1dgj n GLY 405 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dgj s LEU 406 N -0.27 2.83 -0.08 0.99 1.43 0.05 -4.84 118.68 118.79 1dgj s LEU 406 Ca 0.00 -1.36 0.02 0.00 -1.03 0.00 0.00 54.13 51.76 1dgj s LEU 406 Cb 0.00 -0.87 0.01 0.00 0.03 0.00 0.00 46.19 45.36 1dgj s LEU 406 CO 0.00 -0.45 -0.15 -1.61 0.23 0.00 0.00 176.35 174.37 1dgj s GLU 407 N -3.72 2.01 -0.09 1.70 2.02 -1.26 -4.04 118.70 115.32 1dgj s GLU 407 Ca 0.35 -0.51 -0.14 0.00 0.02 0.00 0.00 54.97 54.69 1dgj s GLU 407 Cb 0.10 -1.64 -0.05 0.00 0.10 0.00 0.00 34.13 32.64 1dgj s GLU 407 CO 0.18 0.03 0.35 0.12 0.02 0.00 0.00 175.26 175.95 1dgj s PHE 408 N 0.69 3.58 -0.53 1.61 5.36 -1.26 -0.15 117.98 127.28 1dgj s PHE 408 Ca -0.14 0.77 0.16 0.00 -0.96 0.00 0.00 56.93 56.76 1dgj s PHE 408 Cb -0.16 -2.31 0.62 0.00 -0.34 0.00 0.00 43.02 40.83 1dgj s PHE 408 CO 0.04 0.42 1.53 -0.35 -1.46 0.00 0.00 175.22 175.40 1dgj n PRO 409 N 2.81 3.60 0.08 10.12 -0.04 -1.26 -4.97 135.00 145.33 1dgj n PRO 409 Ca -0.13 -2.83 -0.07 0.00 -0.04 0.00 0.00 63.50 60.43 1dgj n PRO 409 Cb 0.52 -1.88 -0.04 0.00 -0.04 0.00 0.00 33.50 32.06 1dgj n PRO 409 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1dgj h LYS 410 N 2.92 0.06 0.00 0.54 2.10 -1.91 -3.36 116.57 116.93 1dgj h LYS 410 Ca 0.00 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1dgj h LYS 410 Cb 1.48 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.84 1dgj h LYS 410 CO 0.26 0.93 -0.59 -0.25 -2.00 0.00 0.00 179.45 177.80 1dgj n ASP 411 N -3.52 0.68 -4.11 7.07 8.00 0.79 -4.72 116.55 120.74 1dgj n ASP 411 Ca -0.02 -0.68 -0.24 0.00 0.71 0.00 0.00 54.79 54.57 1dgj n ASP 411 Cb 0.85 1.05 -0.15 0.00 -0.02 0.00 0.00 41.12 42.85 1dgj n ASP 411 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1dgj s LEU 412 N -2.61 1.96 -0.04 0.64 2.96 -1.20 0.22 118.68 120.61 1dgj s LEU 412 Ca 0.03 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.68 1dgj s LEU 412 Cb 0.08 -0.80 0.01 0.00 0.50 0.00 0.00 46.19 45.98 1dgj s LEU 412 CO 0.43 0.16 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.86 1dgj s VAL 413 N -0.16 0.74 -0.06 1.68 1.01 0.28 -4.74 120.40 119.14 1dgj s VAL 413 Ca 0.02 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.74 1dgj s VAL 413 Cb -0.08 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 1dgj s VAL 413 CO 0.00 0.25 -0.18 -0.76 0.00 0.00 0.00 175.10 174.42 1dgj s LEU 414 N 0.49 2.51 -0.05 3.92 1.02 -1.26 -0.34 118.68 124.97 1dgj s LEU 414 Ca -0.08 -0.32 0.02 0.00 0.02 0.00 0.00 54.13 53.77 1dgj s LEU 414 Cb -0.12 -1.50 0.02 0.00 0.02 0.00 0.00 46.19 44.61 1dgj s LEU 414 CO 0.01 0.28 -0.07 -0.69 0.02 0.00 0.00 176.35 175.90 1dgj s VAL 415 N -0.37 0.76 -0.26 -1.59 1.01 0.51 -1.94 120.40 118.52 1dgj s VAL 415 Ca 0.03 -0.26 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 1dgj s VAL 415 Cb -0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 1dgj s VAL 415 CO 0.02 0.27 0.68 -1.58 0.00 0.00 0.00 175.10 174.50 1dgj s GLN 416 N 0.80 4.09 1.06 2.72 0.74 -1.11 -1.60 119.66 126.37 1dgj s GLN 416 Ca -0.13 0.61 -0.17 0.00 0.05 0.00 0.00 55.36 55.72 1dgj s GLN 416 Cb -0.15 -3.66 0.23 0.00 1.10 0.00 0.00 33.01 30.53 1dgj s GLN 416 CO 0.02 -0.47 1.22 -0.80 -0.55 0.00 0.00 175.29 174.71 1dgj s ASN 417 N 1.47 2.20 -0.01 6.67 0.02 0.45 -4.89 114.94 120.84 1dgj s ASN 417 Ca 0.28 0.45 -0.30 0.00 -1.02 0.00 0.00 52.86 52.28 1dgj s ASN 417 Cb -0.15 -0.61 -0.06 0.00 0.02 0.00 0.00 41.25 40.45 1dgj s ASN 417 CO 0.09 -3.32 1.56 -0.89 0.02 0.00 0.00 177.10 174.56 1dgj s THR 418 N -3.49 3.51 -0.17 1.60 2.01 -1.26 -4.80 115.64 113.05 1dgj s THR 418 Ca 0.72 0.81 -0.08 0.00 0.31 0.00 0.00 61.69 63.45 1dgj s THR 418 Cb -0.07 -3.52 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 1dgj s THR 418 CO 0.54 -0.03 0.12 -0.89 -0.69 0.00 0.00 174.62 173.68 1dgj s THR 419 N 3.13 5.37 -0.84 -0.82 2.01 -1.26 -4.26 115.64 118.97 1dgj s THR 419 Ca 0.70 0.17 -0.03 0.00 0.31 0.00 0.00 61.69 62.83 1dgj s THR 419 Cb -0.34 -3.40 0.20 0.00 0.01 0.00 0.00 72.50 68.98 1dgj s THR 419 CO 0.28 0.51 2.31 0.61 -0.69 0.00 0.00 174.62 177.65 1dgj n GLY 420 N 2.90 5.19 0.10 4.40 0.00 -1.26 -4.44 105.19 112.07 1dgj n GLY 420 Ca -0.18 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.62 1dgj n GLY 420 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dgj n GLY 421 N 0.46 -3.01 0.00 -0.02 0.00 -0.78 -3.99 105.19 97.85 1dgj n GLY 421 Ca 0.53 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1dgj n GLY 421 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dgj n THR 422 N -1.20 0.00 -1.24 2.61 -2.24 -1.26 -4.86 114.28 106.09 1dgj n THR 422 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1dgj n THR 422 Cb 0.01 -0.07 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 1dgj n THR 422 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1dgj n PHE 423 N -1.12 -0.04 0.00 4.78 3.01 -1.26 -2.60 117.46 120.23 1dgj n PHE 423 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1dgj n PHE 423 Cb 0.05 -2.59 0.00 0.00 -0.01 0.00 0.00 39.48 36.93 1dgj n PHE 423 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dgj n GLY 424 N 0.28 2.57 0.37 1.37 0.00 -1.26 -0.84 105.19 107.68 1dgj n GLY 424 Ca -0.10 -0.67 0.16 0.00 0.00 0.00 0.00 46.02 45.41 1dgj n GLY 424 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1dgj h TYR 425 N 0.00 0.00 -0.23 1.61 -0.00 -1.38 0.28 116.97 117.25 1dgj h TYR 425 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1dgj h TYR 425 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1dgj h TYR 425 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 1dgj n LYS 426 N -3.11 1.72 0.17 0.10 4.76 -1.26 -2.72 118.16 117.82 1dgj n LYS 426 Ca 0.04 -1.10 0.13 0.00 -2.87 0.00 0.00 58.31 54.51 1dgj n LYS 426 Cb 0.70 -1.34 0.45 0.00 -1.84 0.00 0.00 35.03 33.00 1dgj n LYS 426 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1dgj h PHE 427 N 2.04 0.00 -3.34 2.13 3.57 -0.78 -2.95 116.94 117.61 1dgj h PHE 427 Ca 0.00 0.00 -0.68 0.00 3.53 0.00 0.00 57.97 60.82 1dgj h PHE 427 Cb 0.46 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.05 1dgj h PHE 427 CO 0.15 0.00 -0.63 -1.12 -2.23 0.00 0.00 178.31 174.48 1dgj s SER 428 N -4.94 5.20 0.08 0.41 0.01 -1.10 -4.93 113.70 108.42 1dgj s SER 428 Ca 0.06 0.10 -0.31 0.00 1.31 0.00 0.00 55.95 57.11 1dgj s SER 428 Cb 0.09 -1.43 -0.07 0.00 0.21 0.00 0.00 66.02 64.83 1dgj s SER 428 CO 0.53 0.35 1.31 -2.84 0.41 0.00 0.00 173.24 173.01 1dgj s PRO 429 N -1.07 4.36 -0.05 12.44 0.02 -1.26 -4.93 135.00 144.50 1dgj s PRO 429 Ca 0.15 1.94 -0.06 0.00 0.02 0.00 0.00 61.00 63.04 1dgj s PRO 429 Cb -0.11 -3.33 -0.02 0.00 0.02 0.00 0.00 34.50 31.05 1dgj s PRO 429 CO 0.05 -0.38 -0.12 0.25 -0.33 0.00 0.00 177.00 176.46 1dgj n THR 430 N 4.04 0.66 -0.77 0.99 -2.24 -1.26 -4.90 114.28 110.80 1dgj n THR 430 Ca 0.11 0.30 0.04 0.00 -2.27 0.00 0.00 64.05 62.22 1dgj n THR 430 Cb 0.44 -1.73 0.05 0.00 -2.10 0.00 0.00 70.33 67.00 1dgj n THR 430 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 1dgj n MET 431 N -3.28 1.62 -0.19 -0.78 0.00 -1.26 -4.78 117.12 108.45 1dgj n MET 431 Ca -0.05 -1.73 -0.02 0.00 0.00 0.00 0.00 57.70 55.90 1dgj n MET 431 Cb 0.18 -1.07 0.19 0.00 0.00 0.00 0.00 33.22 32.51 1dgj n MET 431 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1dgj h GLU 432 N 0.00 0.94 0.13 3.17 3.07 -1.96 -1.84 114.58 118.09 1dgj h GLU 432 Ca 0.00 -0.14 -0.28 0.00 -0.50 0.00 0.00 59.36 58.44 1dgj h GLU 432 Cb 0.86 -0.17 0.02 0.00 -0.84 0.00 0.00 28.75 28.62 1dgj h GLU 432 CO 0.00 0.75 -1.23 0.00 -1.40 0.00 0.00 179.01 177.13 1dgj h ALA 433 N 1.38 0.08 -0.39 3.43 0.00 -1.97 -2.55 119.26 119.24 1dgj h ALA 433 Ca 0.22 -0.82 0.02 0.00 0.00 0.00 0.00 54.91 54.33 1dgj h ALA 433 Cb 0.14 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1dgj h ALA 433 CO -0.02 0.83 0.23 -0.07 0.00 0.00 0.00 179.25 180.21 1dgj h LEU 434 N 0.16 0.38 -0.39 0.00 3.38 -1.84 0.76 115.31 117.76 1dgj h LEU 434 Ca -0.16 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1dgj h LEU 434 Cb 1.92 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.58 1dgj h LEU 434 CO 0.22 0.27 0.00 0.58 0.09 0.00 0.00 178.44 179.60 1dgj h VAL 435 N 0.47 1.26 -0.83 1.22 2.07 -1.43 -1.88 116.25 117.13 1dgj h VAL 435 Ca 0.15 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 1dgj h VAL 435 Cb 0.00 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1dgj h VAL 435 CO -0.07 0.33 0.42 1.23 0.02 0.00 0.00 177.57 179.50 1dgj h GLY 436 N 0.51 1.26 0.97 2.17 0.00 -0.97 0.98 103.07 107.98 1dgj h GLY 436 Ca 0.11 -0.61 0.01 0.00 0.00 0.00 0.00 47.33 46.84 1dgj h GLY 436 CO 0.02 0.58 0.22 -2.08 0.00 0.00 0.00 176.54 175.28 1dgj h VAL 437 N 1.17 1.07 -0.54 4.60 2.07 0.73 -1.81 116.25 123.54 1dgj h VAL 437 Ca 0.29 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.60 1dgj h VAL 437 Cb 0.09 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1dgj h VAL 437 CO -0.04 0.08 0.13 0.00 0.02 0.00 0.00 177.57 177.76 1dgj h ALA 438 N 1.14 0.71 -0.42 1.67 0.00 -0.75 -2.36 119.26 119.25 1dgj h ALA 438 Ca 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1dgj h ALA 438 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1dgj h ALA 438 CO -0.04 0.41 0.23 0.28 0.00 0.00 0.00 179.25 180.12 1dgj h VAL 439 N 0.76 1.15 -0.54 0.00 2.07 -0.67 -2.08 116.25 116.95 1dgj h VAL 439 Ca 0.17 -0.39 -0.06 0.00 0.82 0.00 0.00 66.70 67.24 1dgj h VAL 439 Cb 0.34 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1dgj h VAL 439 CO 0.00 0.16 0.11 0.24 0.02 0.00 0.00 177.57 178.10 1dgj h MET 440 N 0.54 0.87 -0.61 1.57 2.86 -1.22 0.42 114.93 119.36 1dgj h MET 440 Ca 0.15 -0.22 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 1dgj h MET 440 Cb 0.05 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1dgj h MET 440 CO -0.02 0.84 0.00 0.00 1.06 0.00 0.00 176.91 178.79 1dgj h ALA 441 N 1.00 0.85 0.00 6.32 0.00 -1.35 -3.34 119.26 122.75 1dgj h ALA 441 Ca 0.17 -0.31 -0.36 0.00 0.00 0.00 0.00 54.91 54.41 1dgj h ALA 441 Cb 0.37 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 1dgj h ALA 441 CO 0.01 0.67 -2.25 0.25 0.00 0.00 0.00 179.25 177.92 1dgj n THR 442 N -4.18 1.45 -0.86 0.00 -2.24 -0.79 -4.99 114.28 102.67 1dgj n THR 442 Ca 0.03 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1dgj n THR 442 Cb 0.35 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 1dgj n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dgj n GLY 443 N 1.76 0.64 3.55 3.38 0.00 0.15 -5.04 105.19 109.62 1dgj n GLY 443 Ca -0.31 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1dgj n GLY 443 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dgj s ARG 444 N -0.14 1.92 0.24 1.61 0.52 -1.25 -4.69 118.95 117.17 1dgj s ARG 444 Ca 0.00 -1.69 -0.30 0.00 -0.52 0.00 0.00 55.73 53.22 1dgj s ARG 444 Cb 0.00 -1.89 -0.10 0.00 0.52 0.00 0.00 34.95 33.47 1dgj s ARG 444 CO 0.00 0.29 1.49 -2.14 0.02 0.00 0.00 175.30 174.96 1dgj s PRO 445 N -3.60 4.24 0.00 3.54 0.02 -1.26 -4.61 135.00 133.33 1dgj s PRO 445 Ca 0.31 2.35 0.06 0.00 0.02 0.00 0.00 61.00 63.75 1dgj s PRO 445 Cb -0.04 -3.11 -0.02 0.00 0.02 0.00 0.00 34.50 31.36 1dgj s PRO 445 CO 0.17 -0.49 -0.19 0.00 -0.33 0.00 0.00 177.00 176.17 1dgj s HIS 447 N -0.55 2.35 -0.16 0.00 2.46 -0.66 -1.45 115.29 117.28 1dgj s HIS 447 Ca 0.07 -1.29 -0.01 0.00 0.47 0.00 0.00 55.06 54.30 1dgj s HIS 447 Cb -0.08 -1.67 -0.01 0.00 -0.13 0.00 0.00 32.58 30.69 1dgj s HIS 447 CO 0.00 -0.66 -0.12 -1.17 -2.47 0.00 0.00 174.74 170.32 1dgj s LEU 448 N 1.27 2.66 -0.05 8.88 2.96 -0.25 -1.50 118.68 132.64 1dgj s LEU 448 Ca 0.01 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 1dgj s LEU 448 Cb -0.14 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 44.94 1dgj s LEU 448 CO -0.09 0.09 -0.12 -0.60 -1.32 0.00 0.00 176.35 174.32 1dgj s ARG 449 N 0.80 1.49 0.08 1.98 3.52 -1.26 -1.67 118.95 123.89 1dgj s ARG 449 Ca -0.04 -0.39 -0.11 0.00 -0.13 0.00 0.00 55.73 55.06 1dgj s ARG 449 Cb -0.15 -1.27 -0.06 0.00 -1.56 0.00 0.00 34.95 31.91 1dgj s ARG 449 CO 0.01 0.06 0.42 0.71 -0.81 0.00 0.00 175.30 175.69 1dgj s TYR 450 N 0.51 3.60 0.71 5.12 1.51 -0.96 -4.97 117.35 122.87 1dgj s TYR 450 Ca -0.11 0.83 -0.04 0.00 -1.01 0.00 0.00 57.07 56.75 1dgj s TYR 450 Cb -0.14 -2.19 0.10 0.00 -0.11 0.00 0.00 41.96 39.62 1dgj s TYR 450 CO 0.03 0.52 0.99 0.54 -1.11 0.00 0.00 175.55 176.51 1dgj s ASN 451 N -1.71 4.51 0.56 2.29 2.20 -1.26 -4.62 114.94 116.91 1dgj s ASN 451 Ca 0.33 -0.00 0.30 0.00 -0.94 0.00 0.00 52.86 52.55 1dgj s ASN 451 Cb -0.14 -0.52 1.64 0.00 -2.00 0.00 0.00 41.25 40.23 1dgj s ASN 451 CO 0.18 -1.75 2.14 0.22 -2.94 0.00 0.00 177.10 174.95 1dgj h TYR 452 N -0.56 0.00 0.00 1.54 5.03 -1.79 -1.76 116.97 119.44 1dgj h TYR 452 Ca -0.41 0.00 -0.09 0.00 2.58 0.00 0.00 58.73 60.82 1dgj h TYR 452 Cb 1.28 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.55 1dgj h TYR 452 CO -0.05 0.07 -0.42 1.49 -1.32 0.00 0.00 178.16 177.93 1dgj h GLU 453 N 0.00 0.00 0.02 1.82 4.81 -1.90 -1.94 114.58 117.39 1dgj h GLU 453 Ca -0.00 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 1dgj h GLU 453 Cb 0.24 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1dgj h GLU 453 CO 0.01 0.42 -1.30 1.96 -0.73 0.00 0.00 179.01 179.37 1dgj h GLN 454 N 0.00 0.04 -0.64 1.92 4.20 -1.68 0.75 115.11 119.70 1dgj h GLN 454 Ca -0.00 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 1dgj h GLN 454 Cb 0.85 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1dgj h GLN 454 CO 0.05 0.85 0.20 0.37 -0.67 0.00 0.00 178.83 179.64 1dgj h GLN 455 N 0.01 0.96 0.00 1.46 5.75 -1.23 0.22 115.11 122.28 1dgj h GLN 455 Ca -0.13 -0.19 -0.00 0.00 -0.15 0.00 0.00 58.65 58.18 1dgj h GLN 455 Cb 1.88 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 30.28 1dgj h GLN 455 CO 0.12 0.83 -0.00 1.96 -2.65 0.00 0.00 178.83 179.08 1dgj h GLN 456 N 0.93 -0.00 -0.01 1.69 1.08 -1.30 -3.33 115.11 114.17 1dgj h GLN 456 Ca 0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.41 1dgj h GLN 456 Cb 0.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 1dgj h GLN 456 CO -0.01 0.87 -0.14 0.27 -0.95 0.00 0.00 178.83 178.87 1dgj n ASN 457 N -4.67 0.98 -2.73 1.46 0.23 0.25 -4.38 115.26 106.40 1dgj n ASN 457 Ca -0.10 -0.99 -0.04 0.00 -0.53 0.00 0.00 54.58 52.92 1dgj n ASN 457 Cb 0.42 0.04 0.04 0.00 -2.08 0.00 0.00 39.78 38.21 1dgj n ASN 457 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dgj n TYR 458 N -0.51 1.43 -3.84 -2.53 -0.00 0.78 -4.42 117.16 108.07 1dgj n TYR 458 Ca 0.15 -2.25 -0.12 0.00 -0.00 0.00 0.00 57.90 55.68 1dgj n TYR 458 Cb 0.32 -0.26 -0.10 0.00 -0.00 0.00 0.00 39.34 39.31 1dgj n TYR 458 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 1dgj s THR 459 N -3.83 0.07 1.02 2.97 -4.23 -1.25 -4.87 115.64 105.52 1dgj s THR 459 Ca 0.30 -0.61 -0.13 0.00 -1.18 0.00 0.00 61.69 60.07 1dgj s THR 459 Cb 0.35 -0.49 0.13 0.00 1.34 0.00 0.00 72.50 73.83 1dgj s THR 459 CO -0.02 -0.33 0.65 0.61 -0.54 0.00 0.00 174.62 174.98 1dgj n GLY 460 N 1.43 -1.66 3.35 3.99 0.00 -1.26 -4.80 105.19 106.25 1dgj n GLY 460 Ca -0.22 -0.83 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 1dgj n GLY 460 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgj s LYS 461 N -4.02 1.42 0.32 1.61 -0.14 0.51 -4.57 119.74 114.86 1dgj s LYS 461 Ca 0.62 -1.75 -0.29 0.00 -1.36 0.00 0.00 55.97 53.19 1dgj s LYS 461 Cb -0.21 -0.57 -0.10 0.00 -1.68 0.00 0.00 37.83 35.27 1dgj s LYS 461 CO 0.64 -0.17 1.30 0.50 -0.76 0.00 0.00 175.35 176.86 1dgj s ARG 462 N -3.92 4.38 -0.12 1.68 3.52 -0.65 -1.53 118.95 122.31 1dgj s ARG 462 Ca 0.33 2.18 -0.23 0.00 -0.13 0.00 0.00 55.73 57.88 1dgj s ARG 462 Cb 0.07 -3.09 -0.03 0.00 -1.56 0.00 0.00 34.95 30.34 1dgj s ARG 462 CO 0.11 -0.17 0.70 -1.12 -0.81 0.00 0.00 175.30 174.01 1dgj s SER 463 N -0.44 6.89 0.42 -2.12 0.01 -1.26 -3.74 113.70 113.46 1dgj s SER 463 Ca 0.49 1.08 -0.26 0.00 1.31 0.00 0.00 55.95 58.58 1dgj s SER 463 Cb -0.39 -2.40 -0.09 0.00 0.21 0.00 0.00 66.02 63.36 1dgj s SER 463 CO 0.51 -0.20 1.34 -2.16 0.41 0.00 0.00 173.24 173.13 1dgj s PRO 464 N 1.32 3.89 -0.14 12.44 0.04 -1.24 -4.78 135.00 146.54 1dgj s PRO 464 Ca 0.35 2.23 -0.01 0.00 0.04 0.00 0.00 61.00 63.61 1dgj s PRO 464 Cb -0.17 -2.73 -0.01 0.00 0.04 0.00 0.00 34.50 31.63 1dgj s PRO 464 CO 0.15 -0.58 -0.12 -0.06 0.04 0.00 0.00 177.00 176.43 1dgj s PHE 465 N -1.25 2.84 -0.28 0.56 0.40 -0.97 -1.77 117.98 117.51 1dgj s PHE 465 Ca 0.58 -0.68 -0.09 0.00 -0.60 0.00 0.00 56.93 56.14 1dgj s PHE 465 Cb -0.40 -1.88 -0.02 0.00 0.51 0.00 0.00 43.02 41.23 1dgj s PHE 465 CO 0.51 -0.25 0.12 -1.58 0.70 0.00 0.00 175.22 174.72 1dgj s TRP 466 N 0.49 3.15 -0.06 0.36 0.52 -0.41 -2.12 118.94 120.88 1dgj s TRP 466 Ca -0.08 -0.41 0.04 0.00 0.02 0.00 0.00 56.10 55.67 1dgj s TRP 466 Cb -0.16 -2.31 0.00 0.00 -1.15 0.00 0.00 33.47 29.85 1dgj s TRP 466 CO 0.04 -0.37 -0.17 0.99 0.02 0.00 0.00 176.95 177.45 1dgj s THR 467 N 1.64 1.49 -0.16 2.01 2.01 -0.55 -1.19 115.64 120.89 1dgj s THR 467 Ca 0.06 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1dgj s THR 467 Cb -0.16 -1.29 0.03 0.00 0.01 0.00 0.00 72.50 71.09 1dgj s THR 467 CO 0.06 0.43 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.43 1dgj s THR 468 N 0.19 1.36 0.22 -0.82 2.01 -0.38 0.52 115.64 118.74 1dgj s THR 468 Ca -0.08 -0.64 -0.05 0.00 0.31 0.00 0.00 61.69 61.23 1dgj s THR 468 Cb -0.13 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 1dgj s THR 468 CO 0.03 0.30 0.26 0.00 -0.69 0.00 0.00 174.62 174.52 1dgj s MET 469 N 1.55 1.34 -0.12 4.92 0.23 -0.79 -0.68 119.30 125.74 1dgj s MET 469 Ca 0.03 -1.49 -0.29 0.00 -1.03 0.00 0.00 55.69 52.90 1dgj s MET 469 Cb -0.14 0.35 0.08 0.00 -1.53 0.00 0.00 34.83 33.58 1dgj s MET 469 CO -0.09 -0.49 0.73 -0.98 -2.03 0.00 0.00 175.02 172.16 1dgj s ARG 470 N -4.10 0.94 0.07 3.16 1.70 -0.05 -1.89 118.95 118.79 1dgj s ARG 470 Ca 0.33 0.45 0.04 0.00 -0.47 0.00 0.00 55.73 56.08 1dgj s ARG 470 Cb 0.04 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 1dgj s ARG 470 CO 0.11 -0.25 0.01 0.71 -1.08 0.00 0.00 175.30 174.80 1dgj s TYR 471 N -0.73 3.04 -0.21 5.89 2.02 -0.60 -1.52 117.35 125.23 1dgj s TYR 471 Ca -0.07 0.01 0.01 0.00 -0.37 0.00 0.00 57.07 56.65 1dgj s TYR 471 Cb -0.01 -1.58 0.05 0.00 -0.40 0.00 0.00 41.96 40.02 1dgj s TYR 471 CO 0.06 0.48 -0.08 0.00 -1.57 0.00 0.00 175.55 174.45 1dgj s ALA 472 N -1.27 1.96 0.31 3.71 0.00 -0.37 -2.37 121.76 123.72 1dgj s ALA 472 Ca 0.25 -1.26 0.10 0.00 0.00 0.00 0.00 51.96 51.04 1dgj s ALA 472 Cb -0.12 -1.35 -0.06 0.00 0.00 0.00 0.00 23.12 21.60 1dgj s ALA 472 CO 0.17 -1.00 -0.12 0.00 0.00 0.00 0.00 175.76 174.81 1dgj s ALA 473 N 1.41 2.75 0.72 0.00 0.00 -0.28 0.30 121.76 126.65 1dgj s ALA 473 Ca -0.04 -1.98 -0.03 0.00 0.00 0.00 0.00 51.96 49.91 1dgj s ALA 473 Cb -0.18 -0.07 0.11 0.00 0.00 0.00 0.00 23.12 22.99 1dgj s ALA 473 CO -0.07 0.11 1.00 0.16 0.00 0.00 0.00 175.76 176.96 1dgj s ASP 474 N -3.54 4.43 0.56 0.00 3.84 -0.65 -0.06 116.67 121.25 1dgj s ASP 474 Ca 0.31 -0.08 0.30 0.00 -0.00 0.00 0.00 52.55 53.08 1dgj s ASP 474 Cb 0.01 -0.39 1.64 0.00 -1.38 0.00 0.00 42.92 42.80 1dgj s ASP 474 CO 0.15 -1.80 2.15 -0.09 -0.00 0.00 0.00 175.17 175.57 1dgj h ARG 475 N -0.58 0.00 0.00 2.11 1.12 -1.92 -1.70 114.38 113.41 1dgj h ARG 475 Ca -0.40 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.47 1dgj h ARG 475 Cb 1.28 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.24 1dgj h ARG 475 CO 0.45 0.07 -0.08 1.04 -3.11 0.00 0.00 179.97 178.35 1dgj n GLN 476 N -3.62 0.14 0.00 0.20 6.02 -1.26 -4.94 117.38 113.91 1dgj n GLN 476 Ca -0.02 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1dgj n GLN 476 Cb 0.18 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 29.79 1dgj n GLN 476 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dgj n GLY 477 N 1.40 0.66 3.67 1.08 0.00 -0.64 -5.09 105.19 106.28 1dgj n GLY 477 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1dgj n GLY 477 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dgj s LYS 478 N -0.64 4.33 -0.06 1.61 2.20 -1.26 -4.79 119.74 121.13 1dgj s LYS 478 Ca 0.00 1.49 -0.30 0.00 -0.36 0.00 0.00 55.97 56.80 1dgj s LYS 478 Cb 0.00 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1dgj s LYS 478 CO 0.00 -0.50 1.27 0.42 -0.36 0.00 0.00 175.35 176.18 1dgj s ILE 479 N 2.65 4.10 -0.12 5.43 1.01 -1.26 -1.63 121.20 131.38 1dgj s ILE 479 Ca 0.50 1.43 0.14 0.00 0.00 0.00 0.00 60.65 62.71 1dgj s ILE 479 Cb -0.19 -3.92 -0.20 0.00 0.01 0.00 0.00 42.46 38.16 1dgj s ILE 479 CO 0.15 -0.02 0.12 0.18 0.00 0.00 0.00 174.94 175.36 1dgj n LEU 480 N 5.52 0.00 -3.70 2.97 4.77 0.15 -4.66 117.00 122.04 1dgj n LEU 480 Ca 0.12 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 1dgj n LEU 480 Cb 0.45 0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 41.78 1dgj n LEU 480 CO 0.56 0.28 0.19 0.00 -1.33 0.00 0.00 177.39 177.09 1dgj s ALA 481 N -2.53 -0.86 -0.18 -1.18 0.00 -1.09 -3.74 121.76 112.18 1dgj s ALA 481 Ca -0.07 -0.18 -0.10 0.00 0.00 0.00 0.00 51.96 51.61 1dgj s ALA 481 Cb 0.06 0.77 0.06 0.00 0.00 0.00 0.00 23.12 24.01 1dgj s ALA 481 CO 0.62 -0.71 0.44 1.41 0.00 0.00 0.00 175.76 177.52 1dgj s MET 482 N -3.84 0.42 -0.08 0.00 1.75 -1.00 -1.24 119.30 115.30 1dgj s MET 482 Ca 0.07 0.84 0.04 0.00 -1.25 0.00 0.00 55.69 55.39 1dgj s MET 482 Cb 0.01 0.00 -0.01 0.00 2.84 0.00 0.00 34.83 37.67 1dgj s MET 482 CO -0.07 -0.16 -0.22 -1.21 -0.65 0.00 0.00 175.02 172.70 1dgj s GLU 483 N 1.47 2.84 0.05 4.11 2.02 -0.58 -2.43 118.70 126.19 1dgj s GLU 483 Ca -0.09 -0.85 0.04 0.00 0.02 0.00 0.00 54.97 54.08 1dgj s GLU 483 Cb -0.08 -2.30 -0.03 0.00 0.10 0.00 0.00 34.13 31.82 1dgj s GLU 483 CO -0.13 0.31 -0.11 0.95 0.02 0.00 0.00 175.26 176.30 1dgj s THR 484 N 0.04 0.80 -0.07 3.63 -4.23 -0.84 -0.87 115.64 114.11 1dgj s THR 484 Ca -0.09 -1.18 -0.04 0.00 -1.18 0.00 0.00 61.69 59.21 1dgj s THR 484 Cb -0.15 -0.82 0.03 0.00 1.34 0.00 0.00 72.50 72.90 1dgj s THR 484 CO 0.06 -0.31 0.17 -0.62 -0.54 0.00 0.00 174.62 173.38 1dgj s ASP 485 N -1.64 -0.15 -0.01 3.99 -1.08 0.15 -1.49 116.67 116.43 1dgj s ASP 485 Ca -0.06 0.35 -0.06 0.00 -0.52 0.00 0.00 52.55 52.25 1dgj s ASP 485 Cb -0.10 0.26 0.00 0.00 -1.46 0.00 0.00 42.92 41.62 1dgj s ASP 485 CO 0.01 -0.13 0.12 -1.66 0.52 0.00 0.00 175.17 174.04 1dgj s TRP 486 N 0.93 0.00 -0.12 -5.34 -2.14 -0.87 -1.25 118.94 110.15 1dgj s TRP 486 Ca -0.07 -0.01 0.01 0.00 2.66 0.00 0.00 56.10 58.68 1dgj s TRP 486 Cb -0.09 -0.03 0.02 0.00 -3.10 0.00 0.00 33.47 30.27 1dgj s TRP 486 CO -0.05 -0.21 -0.12 -1.12 -2.66 0.00 0.00 176.95 172.79 1dgj s SER 487 N -0.94 2.39 -0.40 -2.66 0.01 -0.33 -1.44 113.70 110.33 1dgj s SER 487 Ca -0.10 -0.40 -0.15 0.00 1.31 0.00 0.00 55.95 56.60 1dgj s SER 487 Cb -0.06 -1.02 0.01 0.00 0.21 0.00 0.00 66.02 65.16 1dgj s SER 487 CO 0.01 -0.05 0.33 -0.69 0.41 0.00 0.00 173.24 173.25 1dgj s VAL 488 N 1.35 5.21 -0.50 3.43 1.01 0.11 -1.29 120.40 129.72 1dgj s VAL 488 Ca 0.00 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 1dgj s VAL 488 Cb -0.14 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.35 1dgj s VAL 488 CO -0.06 -0.28 1.21 -0.62 0.00 0.00 0.00 175.10 175.34 1dgj s ASP 489 N 1.72 6.51 -0.01 3.32 -1.08 -0.73 -0.87 116.67 125.53 1dgj s ASP 489 Ca 0.08 0.40 0.15 0.00 -0.52 0.00 0.00 52.55 52.66 1dgj s ASP 489 Cb -0.18 -2.55 0.44 0.00 -1.46 0.00 0.00 42.92 39.17 1dgj s ASP 489 CO 0.11 -1.37 1.37 1.57 0.52 0.00 0.00 175.17 177.37 1dgj n HIS 490 N 8.24 0.70 -4.50 -5.34 -0.00 -0.36 -3.62 115.22 110.35 1dgj n HIS 490 Ca 0.12 -0.52 0.00 0.00 0.46 0.00 0.00 57.72 57.77 1dgj n HIS 490 Cb 0.49 -0.04 0.00 0.00 -0.12 0.00 0.00 29.99 30.31 1dgj n HIS 490 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1dgj n GLY 491 N 0.84 -1.01 0.18 1.57 0.00 -1.26 -2.17 105.19 103.33 1dgj n GLY 491 Ca 0.17 -1.15 0.12 0.00 0.00 0.00 0.00 46.02 45.15 1dgj n GLY 491 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dgj h PRO 492 N 0.00 0.00 -4.89 1.61 0.13 -1.43 -2.48 132.00 124.95 1dgj h PRO 492 Ca 0.00 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.47 1dgj h PRO 492 Cb 0.00 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 30.90 1dgj h PRO 492 CO 0.00 0.00 -0.61 0.71 -0.23 0.00 0.00 178.00 177.87 1dgj s TYR 493 N -3.25 3.12 -0.90 1.56 2.02 -1.26 -4.92 117.35 113.72 1dgj s TYR 493 Ca 0.05 -0.53 0.20 0.00 -0.37 0.00 0.00 57.07 56.42 1dgj s TYR 493 Cb 0.07 -2.27 0.82 0.00 -0.40 0.00 0.00 41.96 40.18 1dgj s TYR 493 CO 0.70 -0.41 1.62 -1.13 -1.57 0.00 0.00 175.55 174.77 1dgj n SER 494 N 4.93 0.16 -4.52 2.29 3.41 -1.26 -4.45 113.62 114.18 1dgj n SER 494 Ca -0.15 0.53 -0.62 0.00 -0.26 0.00 0.00 58.87 58.37 1dgj n SER 494 Cb 0.50 -0.57 -0.10 0.00 -0.26 0.00 0.00 64.21 63.78 1dgj n SER 494 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1dgj n GLU 495 N -1.67 0.27 -0.82 4.33 0.28 -1.26 -0.08 120.64 121.69 1dgj n GLU 495 Ca 0.04 0.09 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1dgj n GLU 495 Cb 0.23 -1.68 0.00 0.00 1.43 0.00 0.00 31.44 31.42 1dgj n GLU 495 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1dgj n PHE 496 N 6.09 0.00 -0.20 -1.84 3.72 -1.26 -4.90 117.46 119.08 1dgj n PHE 496 Ca 0.41 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.76 1dgj n PHE 496 Cb 0.00 -0.88 0.05 0.00 -0.94 0.00 0.00 39.48 37.71 1dgj n PHE 496 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1dgj h GLY 497 N 0.00 0.82 1.46 1.37 0.00 -0.82 -1.12 103.07 104.77 1dgj h GLY 497 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 1dgj h GLY 497 CO 0.00 0.21 -0.22 1.29 0.00 0.00 0.00 176.54 177.82 1dgj h ASP 498 N 0.67 0.64 -0.72 0.19 3.04 -1.91 -2.03 116.42 116.30 1dgj h ASP 498 Ca 0.24 -0.22 -0.04 0.00 -3.24 0.00 0.00 57.03 53.77 1dgj h ASP 498 Cb 0.05 -0.17 -0.03 0.00 -1.04 0.00 0.00 39.33 38.13 1dgj h ASP 498 CO -0.11 0.85 0.29 0.25 -2.04 0.00 0.00 179.24 178.48 1dgj h LEU 499 N 0.56 0.99 -0.75 0.15 5.85 -1.84 -1.02 115.31 119.25 1dgj h LEU 499 Ca 0.08 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 1dgj h LEU 499 Cb 0.68 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 1dgj h LEU 499 CO 0.05 0.89 0.25 0.25 -0.34 0.00 0.00 178.44 179.54 1dgj h LEU 500 N 1.03 1.09 -0.95 2.25 5.85 -1.00 -2.28 115.31 121.30 1dgj h LEU 500 Ca 0.24 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1dgj h LEU 500 Cb 0.21 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1dgj h LEU 500 CO -0.02 1.00 0.15 0.74 -0.34 0.00 0.00 178.44 179.97 1dgj h THR 501 N 1.12 1.24 -0.52 1.05 2.02 -0.62 -1.69 112.91 115.51 1dgj h THR 501 Ca 0.24 -0.86 -0.06 0.00 0.77 0.00 0.00 66.41 66.51 1dgj h THR 501 Cb 0.29 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1dgj h THR 501 CO -0.01 0.32 0.09 0.25 0.37 0.00 0.00 175.52 176.55 1dgj h LEU 502 N 0.88 0.77 -1.88 2.58 5.85 -0.92 -2.01 115.31 120.58 1dgj h LEU 502 Ca 0.19 -0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.86 1dgj h LEU 502 Cb 0.31 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1dgj h LEU 502 CO -0.00 0.78 0.48 0.03 -0.34 0.00 0.00 178.44 179.39 1dgj h ARG 503 N 0.78 0.00 0.02 1.25 2.47 -0.73 0.31 114.38 118.48 1dgj h ARG 503 Ca 0.17 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.66 1dgj h ARG 503 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 1dgj h ARG 503 CO 0.00 0.00 -0.99 0.78 0.56 0.00 0.00 179.97 180.33 1dgj h GLY 504 N 0.00 0.40 2.00 0.04 0.00 -1.34 -1.71 103.07 102.46 1dgj h GLY 504 Ca 0.17 -0.75 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 1dgj h GLY 504 CO -0.00 0.67 -0.32 0.00 0.00 0.00 0.00 176.54 176.89 1dgj h ALA 505 N 0.74 1.16 0.08 3.60 0.00 -0.48 -2.94 119.26 121.43 1dgj h ALA 505 Ca -0.09 -0.29 -0.30 0.00 0.00 0.00 0.00 54.91 54.24 1dgj h ALA 505 Cb 1.64 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1dgj h ALA 505 CO 0.17 0.39 -1.56 1.96 0.00 0.00 0.00 179.25 180.21 1dgj h GLN 506 N 0.00 0.18 0.00 0.00 4.20 -1.36 -3.43 115.11 114.69 1dgj h GLN 506 Ca -0.00 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.40 1dgj h GLN 506 Cb 0.70 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1dgj h GLN 506 CO 0.04 0.99 -1.02 0.66 -0.67 0.00 0.00 178.83 178.84 1dgj n TYR 507 N -3.37 0.00 -2.06 2.96 4.02 -0.65 -4.53 117.16 113.53 1dgj n TYR 507 Ca -0.16 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.30 1dgj n TYR 507 Cb 1.04 -0.13 -0.03 0.00 -0.02 0.00 0.00 39.34 40.20 1dgj n TYR 507 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1dgj s ILE 508 N -2.46 3.59 0.00 -0.72 1.01 -1.12 -1.69 121.20 119.82 1dgj s ILE 508 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.30 1dgj s ILE 508 Cb 0.08 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1dgj s ILE 508 CO 0.50 -0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.71 1dgj n GLY 509 N 4.96 0.75 3.71 6.18 0.00 -1.26 -5.04 105.19 114.49 1dgj n GLY 509 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1dgj n GLY 509 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj n ALA 510 N -0.54 1.39 0.00 4.61 0.00 -0.68 -3.21 120.51 122.08 1dgj n ALA 510 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1dgj n ALA 510 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.15 1dgj n ALA 510 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dgj n GLY 511 N 0.80 1.43 3.39 0.00 0.00 -1.26 -4.78 105.19 104.78 1dgj n GLY 511 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 1dgj n GLY 511 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dgj s TYR 512 N -2.23 2.37 -0.96 1.61 1.51 -1.20 -2.38 117.35 116.07 1dgj s TYR 512 Ca 0.00 -0.36 -0.22 0.00 -1.01 0.00 0.00 57.07 55.48 1dgj s TYR 512 Cb 0.00 -1.33 0.08 0.00 -0.11 0.00 0.00 41.96 40.59 1dgj s TYR 512 CO 0.00 0.26 1.31 0.20 -1.11 0.00 0.00 175.55 176.21 1dgj s GLY 513 N -1.72 1.48 -0.39 0.71 0.00 -0.28 -4.81 107.32 102.32 1dgj s GLY 513 Ca 0.14 -2.39 -0.06 0.00 0.00 0.00 0.00 44.72 42.41 1dgj s GLY 513 CO 0.05 2.43 0.19 -0.42 0.00 0.00 0.00 173.10 175.35 1dgj s ILE 514 N 4.17 3.73 0.32 0.90 1.01 -1.26 -4.88 121.20 125.19 1dgj s ILE 514 Ca 0.40 -1.56 0.03 0.00 0.00 0.00 0.00 60.65 59.53 1dgj s ILE 514 Cb -0.03 -3.32 0.29 0.00 0.01 0.00 0.00 42.46 39.42 1dgj s ILE 514 CO -0.08 -0.46 1.92 0.00 0.00 0.00 0.00 174.94 176.31 1dgj h ALA 515 N 8.22 1.60 -3.31 9.38 0.00 -1.83 -3.42 119.26 129.90 1dgj h ALA 515 Ca -0.20 -0.02 -0.57 0.00 0.00 0.00 0.00 54.91 54.12 1dgj h ALA 515 Cb 1.07 -0.23 -0.34 0.00 0.00 0.00 0.00 17.79 18.29 1dgj h ALA 515 CO 0.69 0.26 -0.83 -0.80 0.00 0.00 0.00 179.25 178.57 1dgj s ASN 516 N -6.04 2.32 -0.01 0.00 0.01 -1.25 -3.46 114.94 106.51 1dgj s ASN 516 Ca -0.11 -0.40 0.01 0.00 -0.71 0.00 0.00 52.86 51.65 1dgj s ASN 516 Cb 0.20 -1.04 0.01 0.00 0.41 0.00 0.00 41.25 40.82 1dgj s ASN 516 CO 0.79 0.03 -0.02 -0.63 -1.51 0.00 0.00 177.10 175.75 1dgj s ILE 517 N 0.88 0.23 -0.08 0.60 1.01 0.79 -2.38 121.20 122.26 1dgj s ILE 517 Ca -0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.46 1dgj s ILE 517 Cb -0.15 -0.23 0.03 0.00 0.01 0.00 0.00 42.46 42.12 1dgj s ILE 517 CO 0.00 0.09 0.02 -0.13 0.00 0.00 0.00 174.94 174.93 1dgj s ARG 518 N 0.21 0.42 0.09 2.79 1.81 -1.02 -1.25 118.95 122.00 1dgj s ARG 518 Ca -0.02 0.12 -0.06 0.00 -1.72 0.00 0.00 55.73 54.05 1dgj s ARG 518 Cb -0.05 -1.01 -0.02 0.00 -0.45 0.00 0.00 34.95 33.43 1dgj s ARG 518 CO -0.01 -0.36 0.14 0.20 -0.68 0.00 0.00 175.30 174.60 1dgj s GLY 519 N 2.02 0.31 -0.08 -3.53 0.00 -0.32 -1.98 107.32 103.74 1dgj s GLY 519 Ca 0.04 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.89 1dgj s GLY 519 CO -0.05 -0.98 -0.03 -0.51 0.00 0.00 0.00 173.10 171.53 1dgj s THR 520 N -3.91 0.57 0.38 0.90 -4.23 -0.56 -2.11 115.64 106.68 1dgj s THR 520 Ca 0.09 -0.03 0.07 0.00 -1.18 0.00 0.00 61.69 60.65 1dgj s THR 520 Cb 0.06 -0.66 -0.02 0.00 1.34 0.00 0.00 72.50 73.22 1dgj s THR 520 CO -0.08 0.28 0.38 -0.83 -0.54 0.00 0.00 174.62 173.83 1dgj s GLY 521 N 1.70 1.91 -0.28 3.99 0.00 0.15 -2.06 107.32 112.74 1dgj s GLY 521 Ca 0.02 -1.72 -0.18 0.00 0.00 0.00 0.00 44.72 42.84 1dgj s GLY 521 CO -0.05 -1.58 0.73 -1.60 0.00 0.00 0.00 173.10 170.60 1dgj s ARG 522 N -4.12 0.70 -0.26 2.90 3.52 -0.52 -1.83 118.95 119.34 1dgj s ARG 522 Ca 0.46 1.12 -0.06 0.00 -0.13 0.00 0.00 55.73 57.12 1dgj s ARG 522 Cb -0.06 0.19 -0.01 0.00 -1.56 0.00 0.00 34.95 33.51 1dgj s ARG 522 CO 0.28 -0.13 0.04 0.99 -0.81 0.00 0.00 175.30 175.67 1dgj s THR 523 N 1.33 3.91 -0.09 4.11 2.01 -0.90 0.05 115.64 126.06 1dgj s THR 523 Ca -0.08 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.51 1dgj s THR 523 Cb -0.05 -2.88 -0.01 0.00 0.01 0.00 0.00 72.50 69.57 1dgj s THR 523 CO -0.15 0.27 -0.21 0.54 -0.69 0.00 0.00 174.62 174.38 1dgj s VAL 524 N 1.53 2.38 -0.02 3.82 0.11 -0.05 -2.47 120.40 125.70 1dgj s VAL 524 Ca 0.05 -0.93 -0.29 0.00 -2.93 0.00 0.00 61.98 57.89 1dgj s VAL 524 Cb -0.16 -1.92 -0.03 0.00 -1.53 0.00 0.00 36.38 32.74 1dgj s VAL 524 CO 0.01 0.56 0.92 0.00 -3.33 0.00 0.00 175.10 173.26 1dgj s ALA 525 N 0.06 3.20 0.40 1.54 0.00 0.10 -1.22 121.76 125.84 1dgj s ALA 525 Ca -0.09 0.45 0.04 0.00 0.00 0.00 0.00 51.96 52.37 1dgj s ALA 525 Cb -0.15 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1dgj s ALA 525 CO 0.05 -0.21 0.15 0.95 0.00 0.00 0.00 175.76 176.71 1dgj s THR 526 N 0.98 0.51 -2.28 0.00 -4.23 -0.93 -4.81 115.64 104.88 1dgj s THR 526 Ca 0.49 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.20 1dgj s THR 526 Cb -0.20 -2.36 0.45 0.00 1.34 0.00 0.00 72.50 71.73 1dgj s THR 526 CO 0.26 0.00 1.44 0.59 -0.54 0.00 0.00 174.62 176.37 1dgj n ASN 527 N -1.34 2.82 -4.66 3.99 5.03 0.74 -1.66 115.26 120.19 1dgj n ASN 527 Ca -0.04 -1.92 -0.26 0.00 0.87 0.00 0.00 54.58 53.23 1dgj n ASN 527 Cb 0.65 -0.25 0.11 0.00 -1.02 0.00 0.00 39.78 39.26 1dgj n ASN 527 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 1dgj s HIS 528 N -1.50 2.19 0.15 3.10 2.46 -1.26 -4.40 115.29 116.03 1dgj s HIS 528 Ca 0.36 0.18 -0.34 0.00 0.47 0.00 0.00 55.06 55.74 1dgj s HIS 528 Cb 0.20 -3.35 -0.16 0.00 -0.13 0.00 0.00 32.58 29.14 1dgj s HIS 528 CO 0.28 -1.79 1.27 0.00 -2.47 0.00 0.00 174.74 172.03 1dgj s TRP 530 N 0.12 1.91 -0.13 0.00 -2.14 -1.26 -4.11 118.94 113.33 1dgj s TRP 530 Ca 0.77 1.67 -0.20 0.00 2.66 0.00 0.00 56.10 61.00 1dgj s TRP 530 Cb -0.86 -3.41 -0.03 0.00 -3.10 0.00 0.00 33.47 26.07 1dgj s TRP 530 CO 0.49 -2.66 0.59 0.20 -2.66 0.00 0.00 176.95 172.91 1dgj s GLY 531 N -2.34 2.35 0.06 3.67 0.00 -0.92 -0.37 107.32 109.77 1dgj s GLY 531 Ca 0.71 -0.13 0.10 0.00 0.00 0.00 0.00 44.72 45.40 1dgj s GLY 531 CO 0.51 1.06 -0.27 0.00 0.00 0.00 0.00 173.10 174.41 1dgj s ALA 532 N 1.10 2.28 0.39 3.20 0.00 -0.58 -4.74 121.76 123.40 1dgj s ALA 532 Ca 0.30 -1.31 -0.24 0.00 0.00 0.00 0.00 51.96 50.71 1dgj s ALA 532 Cb -0.16 -0.46 -0.13 0.00 0.00 0.00 0.00 23.12 22.37 1dgj s ALA 532 CO 0.13 0.54 0.67 0.00 0.00 0.00 0.00 175.76 177.09 1dgj n ALA 533 N 1.59 -1.20 -3.71 0.00 0.00 -1.26 -4.17 120.51 111.76 1dgj n ALA 533 Ca -0.17 0.22 -0.18 0.00 0.00 0.00 0.00 53.44 53.31 1dgj n ALA 533 Cb 0.52 -1.84 -0.16 0.00 0.00 0.00 0.00 19.45 17.97 1dgj n ALA 533 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1dgj s PHE 534 N -1.35 0.34 -0.18 0.00 2.19 -1.26 -2.94 117.98 114.77 1dgj s PHE 534 Ca 0.63 0.00 -0.06 0.00 0.33 0.00 0.00 56.93 57.83 1dgj s PHE 534 Cb -0.63 -0.46 -0.04 0.00 -1.31 0.00 0.00 43.02 40.57 1dgj s PHE 534 CO 0.58 -0.16 0.49 -2.13 1.83 0.00 0.00 175.22 175.83 1dgj n ARG 535 N 4.35 0.00 0.00 10.12 0.63 -0.02 0.73 116.66 132.47 1dgj n ARG 535 Ca -0.22 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.71 1dgj n ARG 535 Cb 0.50 -0.28 0.00 0.00 0.45 0.00 0.00 32.46 33.13 1dgj n ARG 535 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1dgj n GLY 536 N 1.22 2.15 3.15 5.14 0.00 -1.26 -4.89 105.19 110.71 1dgj n GLY 536 Ca 0.12 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 1dgj n GLY 536 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1dgj n TYR 537 N 0.00 -0.42 0.00 1.61 -0.00 0.22 0.23 117.16 118.80 1dgj n TYR 537 Ca 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 57.90 58.03 1dgj n TYR 537 Cb 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 39.34 38.70 1dgj n TYR 537 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1dgj n GLY 538 N -0.92 2.42 0.12 2.98 0.00 -1.26 -4.96 105.19 103.57 1dgj n GLY 538 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1dgj n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj h ALA 539 N 0.00 -0.18 -0.75 4.61 0.00 -0.56 -2.57 119.26 119.81 1dgj h ALA 539 Ca 0.00 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 54.80 1dgj h ALA 539 Cb 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1dgj h ALA 539 CO 0.00 -0.25 0.50 -1.35 0.00 0.00 0.00 179.25 178.15 1dgj h PRO 540 N -0.89 0.52 0.00 0.00 0.11 -1.73 0.05 132.00 130.07 1dgj h PRO 540 Ca -0.02 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.96 1dgj h PRO 540 Cb 0.53 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 1dgj h PRO 540 CO 0.03 0.35 -0.57 1.05 -0.21 0.00 0.00 178.00 178.65 1dgj h GLU 541 N 0.54 0.00 0.11 1.05 9.09 -1.87 -3.04 114.58 120.46 1dgj h GLU 541 Ca 0.36 0.00 -0.37 0.00 0.05 0.00 0.00 59.36 59.40 1dgj h GLU 541 Cb 0.66 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.73 1dgj h GLU 541 CO -0.13 0.43 -2.05 0.43 0.05 0.00 0.00 179.01 177.74 1dgj n SER 542 N -3.17 2.11 0.07 3.06 7.64 -0.82 -4.31 113.62 118.20 1dgj n SER 542 Ca 0.01 0.17 0.13 0.00 1.01 0.00 0.00 58.87 60.19 1dgj n SER 542 Cb 0.73 -0.81 0.37 0.00 -1.01 0.00 0.00 64.21 63.49 1dgj n SER 542 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1dgj n GLU 543 N -3.47 0.21 0.19 1.43 1.02 -0.06 -3.52 120.64 116.44 1dgj n GLU 543 Ca -0.34 0.13 -0.14 0.00 -0.02 0.00 0.00 57.16 56.80 1dgj n GLU 543 Cb 1.04 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.67 1dgj n GLU 543 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1dgj h PHE 544 N 0.00 -0.47 -0.32 -0.32 3.57 -1.72 -0.98 116.94 116.71 1dgj h PHE 544 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 1dgj h PHE 544 Cb 0.68 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 1dgj h PHE 544 CO 0.00 -0.15 0.13 -1.00 -2.23 0.00 0.00 178.31 175.06 1dgj h PRO 545 N -0.80 0.28 -0.12 6.41 0.13 -1.77 -0.50 132.00 135.63 1dgj h PRO 545 Ca -0.05 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.99 1dgj h PRO 545 Cb 0.53 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1dgj h PRO 545 CO 0.08 0.18 -0.27 0.66 -0.23 0.00 0.00 178.00 178.43 1dgj h SER 546 N 0.28 0.22 1.05 1.44 4.64 -1.61 0.28 113.55 119.85 1dgj h SER 546 Ca 0.14 -0.07 -0.19 0.00 -0.47 0.00 0.00 61.79 61.20 1dgj h SER 546 Cb 0.08 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 1dgj h SER 546 CO -0.12 0.49 -0.92 -0.33 -0.87 0.00 0.00 176.83 175.08 1dgj h GLU 547 N 0.20 0.00 0.17 4.77 4.39 -0.91 -2.33 114.58 120.87 1dgj h GLU 547 Ca 0.03 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.46 1dgj h GLU 547 Cb 0.59 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1dgj h GLU 547 CO 0.04 0.92 -1.17 0.28 -1.16 0.00 0.00 179.01 177.92 1dgj h VAL 548 N 0.00 1.36 -0.36 3.13 2.07 -0.75 -3.23 116.25 118.47 1dgj h VAL 548 Ca -0.01 -2.55 -0.02 0.00 0.82 0.00 0.00 66.70 64.95 1dgj h VAL 548 Cb 1.69 2.97 -0.02 0.00 -1.52 0.00 0.00 31.29 34.42 1dgj h VAL 548 CO 0.12 0.75 0.16 0.25 0.02 0.00 0.00 177.57 178.87 1dgj h LEU 549 N 0.01 0.44 -0.73 2.57 5.85 -1.04 -1.95 115.31 120.47 1dgj h LEU 549 Ca -0.20 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.53 1dgj h LEU 549 Cb 1.90 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.76 1dgj h LEU 549 CO 0.22 0.40 0.44 -0.03 -0.34 0.00 0.00 178.44 179.13 1dgj h MET 550 N 0.50 0.81 -0.05 1.25 4.05 -1.45 0.22 114.93 120.25 1dgj h MET 550 Ca 0.13 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.37 1dgj h MET 550 Cb 0.08 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.69 1dgj h MET 550 CO -0.02 0.53 -0.54 -0.44 0.23 0.00 0.00 176.91 176.67 1dgj h ASP 551 N 0.83 0.16 -0.11 1.39 3.45 -1.39 -1.26 116.42 119.49 1dgj h ASP 551 Ca 0.31 -0.08 -0.13 0.00 0.43 0.00 0.00 57.03 57.56 1dgj h ASP 551 Cb 0.11 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 1dgj h ASP 551 CO -0.15 0.68 -0.35 -0.33 -1.57 0.00 0.00 179.24 177.52 1dgj h GLU 552 N 0.11 0.62 -0.31 3.56 5.08 -0.74 -2.49 114.58 120.42 1dgj h GLU 552 Ca -0.00 -0.29 -0.14 0.00 -1.00 0.00 0.00 59.36 57.93 1dgj h GLU 552 Cb 1.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1dgj h GLU 552 CO 0.08 0.88 -0.35 1.25 -1.00 0.00 0.00 179.01 179.87 1dgj h LEU 553 N 0.52 0.84 -1.00 1.33 5.85 -0.40 -2.81 115.31 119.64 1dgj h LEU 553 Ca 0.05 -0.48 0.07 0.00 0.84 0.00 0.00 57.88 58.36 1dgj h LEU 553 Cb 0.85 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 1dgj h LEU 553 CO 0.07 1.15 0.65 0.00 -0.34 0.00 0.00 178.44 179.97 1dgj h ALA 554 N 0.71 1.40 -0.19 1.25 0.00 -1.06 -0.88 119.26 120.49 1dgj h ALA 554 Ca 0.04 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1dgj h ALA 554 Cb 0.93 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1dgj h ALA 554 CO 0.08 0.43 -0.44 1.49 0.00 0.00 0.00 179.25 180.81 1dgj h GLU 555 N 1.16 0.46 -0.10 0.00 4.81 -1.40 -0.55 114.58 118.97 1dgj h GLU 555 Ca 0.44 -0.24 -0.14 0.00 -0.13 0.00 0.00 59.36 59.28 1dgj h GLU 555 Cb 0.19 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1dgj h GLU 555 CO -0.18 0.81 -0.57 -0.22 -0.73 0.00 0.00 179.01 178.13 1dgj h LYS 556 N 0.38 0.30 0.00 1.92 3.64 -1.03 -3.10 116.57 118.67 1dgj h LYS 556 Ca 0.03 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1dgj h LYS 556 Cb 0.92 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1dgj h LYS 556 CO 0.08 0.78 -0.30 -0.07 -2.27 0.00 0.00 179.45 177.67 1dgj h LEU 557 N 0.23 0.00 0.02 5.20 -0.00 -0.99 -3.48 115.31 116.29 1dgj h LEU 557 Ca -0.00 -0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 57.83 1dgj h LEU 557 Cb 1.06 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.72 1dgj h LEU 557 CO 0.09 0.02 -0.01 0.61 -0.00 0.00 0.00 178.44 179.15 1dgj n GLY 558 N 1.22 0.42 3.84 0.83 0.00 -0.30 -5.04 105.19 106.15 1dgj n GLY 558 Ca 0.04 -1.01 -0.22 0.00 0.00 0.00 0.00 46.02 44.83 1dgj n GLY 558 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dgj s MET 559 N -1.91 2.98 0.16 1.61 -1.94 -0.67 -5.03 119.30 114.50 1dgj s MET 559 Ca 0.00 -0.99 -0.31 0.00 -1.71 0.00 0.00 55.69 52.68 1dgj s MET 559 Cb 0.00 -2.61 -0.08 0.00 2.01 0.00 0.00 34.83 34.14 1dgj s MET 559 CO 0.00 0.42 1.35 0.34 -0.01 0.00 0.00 175.02 177.11 1dgj s ASP 560 N -3.75 6.86 0.25 3.03 -1.08 -1.26 -4.46 116.67 116.27 1dgj s ASP 560 Ca 0.33 2.36 -0.03 0.00 -0.52 0.00 0.00 52.55 54.69 1dgj s ASP 560 Cb -0.08 -2.60 0.41 0.00 -1.46 0.00 0.00 42.92 39.19 1dgj s ASP 560 CO 0.25 -0.59 1.84 -0.65 0.52 0.00 0.00 175.17 176.54 1dgj h PRO 561 N 6.07 0.91 -0.08 4.34 0.11 -1.93 0.17 132.00 141.58 1dgj h PRO 561 Ca -0.43 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1dgj h PRO 561 Cb 1.21 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1dgj h PRO 561 CO 0.82 0.60 -0.04 0.35 -0.21 0.00 0.00 178.00 179.51 1dgj h PHE 562 N 0.93 0.20 -0.47 0.65 3.57 -1.98 -2.83 116.94 117.02 1dgj h PHE 562 Ca 0.41 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.81 1dgj h PHE 562 Cb 0.30 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1dgj h PHE 562 CO -0.03 0.55 0.09 0.93 -2.23 0.00 0.00 178.31 177.61 1dgj h GLU 563 N -0.20 0.73 -0.22 1.11 4.39 -1.82 -1.84 114.58 116.74 1dgj h GLU 563 Ca 0.02 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1dgj h GLU 563 Cb 0.49 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1dgj h GLU 563 CO 0.01 0.68 0.14 1.25 -1.16 0.00 0.00 179.01 179.94 1dgj h LEU 564 N 0.70 0.25 -0.37 1.33 5.85 -0.68 -1.57 115.31 120.82 1dgj h LEU 564 Ca 0.15 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1dgj h LEU 564 Cb 0.31 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1dgj h LEU 564 CO 0.00 0.18 0.22 0.03 -0.34 0.00 0.00 178.44 178.53 1dgj h ARG 565 N 0.29 0.43 -0.39 1.25 3.08 -1.22 -1.44 114.38 116.39 1dgj h ARG 565 Ca 0.08 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.22 1dgj h ARG 565 Cb -0.03 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1dgj h ARG 565 CO -0.02 0.29 0.33 0.00 -1.07 0.00 0.00 179.97 179.50 1dgj h ALA 566 N 1.16 2.20 0.15 0.04 0.00 -0.92 -1.53 119.26 120.36 1dgj h ALA 566 Ca 0.14 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.74 1dgj h ALA 566 Cb -0.00 0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.84 1dgj h ALA 566 CO -0.06 -0.53 -1.28 1.25 0.00 0.00 0.00 179.25 178.63 1dgj h LEU 567 N 0.00 0.78 0.00 0.00 5.85 -0.27 -3.37 115.31 118.30 1dgj h LEU 567 Ca 0.18 -0.76 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1dgj h LEU 567 Cb 0.84 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1dgj h LEU 567 CO -0.00 1.57 -1.00 0.59 -0.34 0.00 0.00 178.44 179.26 1dgj n ASN 568 N -3.73 0.62 -4.51 1.25 3.02 -0.66 -5.00 115.26 106.25 1dgj n ASN 568 Ca -0.13 -0.25 -0.33 0.00 -0.03 0.00 0.00 54.58 53.84 1dgj n ASN 568 Cb 1.01 0.77 0.13 0.00 -0.61 0.00 0.00 39.78 41.08 1dgj n ASN 568 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dgj n TYR 570 N -3.61 1.36 -3.77 0.00 0.53 -1.00 -4.51 117.16 106.17 1dgj n TYR 570 Ca 0.09 0.68 -0.11 0.00 -1.02 0.00 0.00 57.90 57.54 1dgj n TYR 570 Cb 0.52 -2.27 -0.07 0.00 -1.03 0.00 0.00 39.34 36.49 1dgj n TYR 570 CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 1dgj s ARG 571 N -1.36 0.82 -0.33 -0.72 0.52 -1.26 -4.66 118.95 111.96 1dgj s ARG 571 Ca 0.61 -0.59 -0.42 0.00 -0.52 0.00 0.00 55.73 54.81 1dgj s ARG 571 Cb -0.71 0.35 -0.19 0.00 0.52 0.00 0.00 34.95 34.93 1dgj s ARG 571 CO 0.59 -0.27 1.35 -1.91 0.02 0.00 0.00 175.30 175.07 1dgj n GLU 572 N 0.45 0.00 0.00 3.54 4.07 -1.26 -0.20 120.64 127.23 1dgj n GLU 572 Ca -0.18 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.92 1dgj n GLU 572 Cb 0.60 -1.39 0.00 0.00 -0.06 0.00 0.00 31.44 30.59 1dgj n GLU 572 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1dgj n GLY 573 N 3.06 3.16 3.77 8.31 0.00 -1.26 -5.08 105.19 117.16 1dgj n GLY 573 Ca 0.26 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 1dgj n GLY 573 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dgj s ASP 574 N 0.00 5.47 0.37 1.61 -0.00 0.71 -5.07 116.67 119.76 1dgj s ASP 574 Ca 0.00 2.08 0.04 0.00 -0.00 0.00 0.00 52.55 54.67 1dgj s ASP 574 Cb 0.00 -2.57 -0.05 0.00 -0.00 0.00 0.00 42.92 40.31 1dgj s ASP 574 CO 0.00 -1.39 0.08 0.42 -0.00 0.00 0.00 175.17 174.28 1dgj s THR 575 N -2.05 0.99 0.00 -1.27 -4.23 -1.26 -4.46 115.64 103.37 1dgj s THR 575 Ca 0.70 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 1dgj s THR 575 Cb -0.22 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.04 1dgj s THR 575 CO 0.33 0.00 0.00 0.35 -0.54 0.00 0.00 174.62 174.76 1dgj n THR 576 N -0.83 0.00 1.55 3.99 -2.24 0.77 -4.65 114.28 112.87 1dgj n THR 576 Ca -0.05 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.87 1dgj n THR 576 Cb 0.66 -1.98 0.57 0.00 -2.10 0.00 0.00 70.33 67.48 1dgj n THR 576 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1dgj n SER 577 N -0.30 1.29 -0.25 3.42 7.64 -1.26 -2.78 113.62 121.38 1dgj n SER 577 Ca 0.00 -1.45 0.07 0.00 1.01 0.00 0.00 58.87 58.50 1dgj n SER 577 Cb 0.00 -0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.17 1dgj n SER 577 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1dgj n SER 578 N 0.01 1.29 0.00 6.43 7.64 -1.26 -4.85 113.62 122.88 1dgj n SER 578 Ca 0.19 -1.15 0.00 0.00 1.01 0.00 0.00 58.87 58.93 1dgj n SER 578 Cb 0.31 0.59 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 1dgj n SER 578 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dgj n GLY 579 N 1.12 0.64 3.79 0.23 0.00 -1.12 -1.41 105.19 108.45 1dgj n GLY 579 Ca 0.05 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 1dgj n GLY 579 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1dgj s GLN 580 N -1.00 4.04 0.09 1.61 0.74 -1.26 -4.71 119.66 119.17 1dgj s GLN 580 Ca 0.00 0.31 -0.31 0.00 0.05 0.00 0.00 55.36 55.41 1dgj s GLN 580 Cb 0.00 -3.31 -0.07 0.00 1.10 0.00 0.00 33.01 30.74 1dgj s GLN 580 CO 0.00 0.49 1.30 0.42 -0.55 0.00 0.00 175.29 176.95 1dgj s ILE 581 N -0.40 3.66 0.28 -2.34 1.01 -1.26 -0.17 121.20 121.99 1dgj s ILE 581 Ca 0.22 1.19 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 1dgj s ILE 581 Cb -0.15 -3.76 -0.11 0.00 0.01 0.00 0.00 42.46 38.44 1dgj s ILE 581 CO 0.10 0.09 1.59 -2.84 0.00 0.00 0.00 174.94 173.88 1dgj s PRO 582 N 1.10 4.14 0.23 2.79 0.02 -1.26 -4.90 135.00 137.12 1dgj s PRO 582 Ca 0.62 2.55 0.19 0.00 0.02 0.00 0.00 61.00 64.37 1dgj s PRO 582 Cb -0.33 -3.04 0.92 0.00 0.02 0.00 0.00 34.50 32.07 1dgj s PRO 582 CO 0.30 -0.62 1.57 -0.85 -0.33 0.00 0.00 177.00 177.07 1dgj n GLU 583 N 2.35 0.13 -3.76 5.54 -0.00 -1.26 -4.68 120.64 118.95 1dgj n GLU 583 Ca 0.09 0.52 -0.10 0.00 -0.00 0.00 0.00 57.16 57.67 1dgj n GLU 583 Cb 0.38 -1.84 -0.07 0.00 -0.00 0.00 0.00 31.44 29.91 1dgj n GLU 583 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 1dgj s VAL 584 N -3.36 0.10 -0.43 3.84 -7.23 -1.26 -4.89 120.40 107.17 1dgj s VAL 584 Ca 0.01 -0.84 0.08 0.00 -1.81 0.00 0.00 61.98 59.42 1dgj s VAL 584 Cb 0.07 -1.14 0.42 0.00 0.56 0.00 0.00 36.38 36.29 1dgj s VAL 584 CO 0.24 -0.46 1.04 0.23 -0.31 0.00 0.00 175.10 175.83 1dgj n MET 585 N 0.15 2.77 -0.28 4.82 2.81 -1.26 -4.86 117.12 121.28 1dgj n MET 585 Ca -0.17 -4.21 0.09 0.00 -1.81 0.00 0.00 57.70 51.60 1dgj n MET 585 Cb 0.62 -1.99 0.25 0.00 -0.71 0.00 0.00 33.22 31.38 1dgj n MET 585 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1dgj n SER 586 N -0.32 2.99 -0.03 7.83 3.41 -1.26 -4.42 113.62 121.81 1dgj n SER 586 Ca 0.31 -2.00 -0.11 0.00 -0.26 0.00 0.00 58.87 56.81 1dgj n SER 586 Cb 0.66 -0.37 -0.05 0.00 -0.26 0.00 0.00 64.21 64.19 1dgj n SER 586 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1dgj h LEU 587 N 3.28 0.18 -1.05 1.04 3.38 -1.89 -0.36 115.31 119.90 1dgj h LEU 587 Ca 0.00 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 57.95 1dgj h LEU 587 Cb 0.75 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 1dgj h LEU 587 CO 0.00 0.24 0.63 -0.65 0.09 0.00 0.00 178.44 178.75 1dgj h PRO 588 N 0.10 1.00 -0.18 1.13 0.11 -1.83 0.11 132.00 132.45 1dgj h PRO 588 Ca 0.05 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1dgj h PRO 588 Cb 0.11 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1dgj h PRO 588 CO -0.01 0.66 -0.30 1.49 -0.21 0.00 0.00 178.00 179.63 1dgj h GLU 589 N 1.03 0.36 -0.29 1.05 4.81 -1.76 -1.78 114.58 118.00 1dgj h GLU 589 Ca 0.46 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.37 1dgj h GLU 589 Cb 0.38 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 1dgj h GLU 589 CO -0.22 0.63 -0.50 0.52 -0.73 0.00 0.00 179.01 178.71 1dgj h MET 590 N 0.31 0.86 -0.16 1.92 2.86 0.90 -2.54 114.93 119.08 1dgj h MET 590 Ca 0.04 -0.53 -0.05 0.00 -2.06 0.00 0.00 59.70 57.10 1dgj h MET 590 Cb 0.70 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1dgj h MET 590 CO 0.05 1.17 -0.15 0.74 1.06 0.00 0.00 176.91 179.78 1dgj h PHE 591 N 0.64 0.27 -0.28 -0.22 -1.00 -0.71 -0.95 116.94 114.70 1dgj h PHE 591 Ca 0.02 -0.03 -0.13 0.00 2.81 0.00 0.00 57.97 60.63 1dgj h PHE 591 Cb 1.11 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 40.58 1dgj h PHE 591 CO 0.07 0.40 -0.38 -0.44 -1.61 0.00 0.00 178.31 176.36 1dgj h ASP 592 N 0.24 0.69 0.54 2.17 3.45 -1.18 -0.02 116.42 122.31 1dgj h ASP 592 Ca 0.05 -0.30 -0.16 0.00 0.43 0.00 0.00 57.03 57.05 1dgj h ASP 592 Cb 0.41 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 1dgj h ASP 592 CO 0.02 0.99 -0.70 0.11 -1.57 0.00 0.00 179.24 178.10 1dgj h LYS 593 N 0.54 0.14 0.01 3.56 1.57 -1.00 -3.22 116.57 118.17 1dgj h LYS 593 Ca 0.05 -0.11 -0.24 0.00 -1.87 0.00 0.00 60.65 58.48 1dgj h LYS 593 Cb 0.89 0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.24 1dgj h LYS 593 CO 0.08 0.78 -0.99 1.98 -0.57 0.00 0.00 179.45 180.72 1dgj h MET 594 N 0.09 0.49 -0.86 3.15 4.05 -1.01 -3.37 114.93 117.47 1dgj h MET 594 Ca -0.02 -0.54 0.18 0.00 -0.28 0.00 0.00 59.70 59.05 1dgj h MET 594 Cb 1.24 0.16 -0.16 0.00 -0.80 0.00 0.00 31.60 32.04 1dgj h MET 594 CO 0.10 1.18 -0.16 -0.09 0.23 0.00 0.00 176.91 178.17 1dgj h ARG 595 N 0.27 0.01 -0.81 0.39 2.43 -1.00 0.13 114.38 115.80 1dgj h ARG 595 Ca -0.10 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.10 1dgj h ARG 595 Cb 1.64 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 31.14 1dgj h ARG 595 CO 0.18 0.01 0.52 -1.35 -1.51 0.00 0.00 179.97 177.82 1dgj h PRO 596 N 0.01 0.98 -0.52 0.20 0.11 -1.75 -2.32 132.00 128.72 1dgj h PRO 596 Ca 0.43 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.39 1dgj h PRO 596 Cb 0.71 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 1dgj h PRO 596 CO -0.86 0.65 -0.06 1.88 -0.21 0.00 0.00 178.00 179.39 1dgj h TYR 597 N 1.01 1.03 0.32 0.65 0.05 -1.23 -2.90 116.97 115.89 1dgj h TYR 597 Ca 0.33 -0.19 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 1dgj h TYR 597 Cb 0.02 -0.26 -0.00 0.00 1.01 0.00 0.00 36.73 37.49 1dgj h TYR 597 CO -0.03 0.95 -0.19 -0.92 -1.05 0.00 0.00 178.16 176.92 1dgj h TYR 598 N 0.85 -0.49 0.00 4.88 5.03 -0.85 -2.33 116.97 124.06 1dgj h TYR 598 Ca 0.15 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.42 1dgj h TYR 598 Cb 0.59 0.17 -0.00 0.00 1.55 0.00 0.00 36.73 39.04 1dgj h TYR 598 CO 0.04 -0.29 -0.15 0.93 -1.32 0.00 0.00 178.16 177.36 1dgj h GLU 599 N -0.48 0.00 -0.16 1.82 5.08 -1.46 -0.81 114.58 118.56 1dgj h GLU 599 Ca -0.03 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.14 1dgj h GLU 599 Cb 0.39 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.65 1dgj h GLU 599 CO 0.04 0.15 -0.63 0.93 -1.00 0.00 0.00 179.01 178.50 1dgj h GLU 600 N 0.00 0.71 -0.12 2.33 4.39 -1.40 -2.65 114.58 117.85 1dgj h GLU 600 Ca -0.00 -0.55 -0.07 0.00 0.34 0.00 0.00 59.36 59.08 1dgj h GLU 600 Cb 0.29 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1dgj h GLU 600 CO 0.02 1.17 -0.25 0.77 -1.16 0.00 0.00 179.01 179.56 1dgj h SER 601 N 0.41 0.21 0.25 1.42 0.02 -0.93 0.58 113.55 115.52 1dgj h SER 601 Ca -0.03 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1dgj h SER 601 Cb 1.26 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1dgj h SER 601 CO 0.13 0.46 -0.12 0.11 -1.14 0.00 0.00 176.83 176.27 1dgj h LYS 602 N 0.19 -0.33 0.30 3.45 1.57 -1.02 -0.10 116.57 120.63 1dgj h LYS 602 Ca 0.03 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1dgj h LYS 602 Cb 0.55 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1dgj h LYS 602 CO 0.04 -0.20 -0.14 0.87 -0.57 0.00 0.00 179.45 179.45 1dgj h LYS 603 N -0.38 -0.39 -0.93 3.15 1.57 -1.23 -3.07 116.57 115.30 1dgj h LYS 603 Ca -0.03 0.03 0.17 0.00 -1.87 0.00 0.00 60.65 58.94 1dgj h LYS 603 Cb 0.29 0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.61 1dgj h LYS 603 CO 0.06 -0.07 0.59 -0.09 -0.57 0.00 0.00 179.45 179.37 1dgj h ARG 604 N -0.73 0.61 -0.12 3.15 2.43 -0.90 0.60 114.38 119.42 1dgj h ARG 604 Ca -0.04 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 58.91 1dgj h ARG 604 Cb 0.49 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1dgj h ARG 604 CO 0.07 0.41 -0.64 -0.24 -1.51 0.00 0.00 179.97 178.05 1dgj h VAL 605 N 0.63 1.32 -0.19 0.20 3.04 -1.06 -2.39 116.25 117.80 1dgj h VAL 605 Ca 0.49 -1.90 -0.05 0.00 -1.01 0.00 0.00 66.70 64.22 1dgj h VAL 605 Cb 0.89 2.10 -0.01 0.00 -2.01 0.00 0.00 31.29 32.27 1dgj h VAL 605 CO -0.24 0.59 -0.07 0.50 -1.01 0.00 0.00 177.57 177.34 1dgj h LYS 606 N 0.32 0.39 0.00 4.17 3.64 -1.34 -2.75 116.57 121.00 1dgj h LYS 606 Ca -0.05 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1dgj h LYS 606 Cb 1.28 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1dgj h LYS 606 CO 0.13 0.67 0.00 -1.91 -2.27 0.00 0.00 179.45 176.07 1dgj n GLU 607 N -4.60 0.23 0.00 1.90 2.13 0.16 -3.00 120.64 117.45 1dgj n GLU 607 Ca -0.05 0.12 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1dgj n GLU 607 Cb 0.30 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.51 1dgj n GLU 607 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1dgj n ARG 608 N -1.20 -0.61 -2.29 5.31 1.74 -0.90 -5.03 116.66 113.68 1dgj n ARG 608 Ca 0.07 -0.40 -0.41 0.00 -0.77 0.00 0.00 57.85 56.33 1dgj n ARG 608 Cb 0.08 -0.90 -0.03 0.00 -1.02 0.00 0.00 32.46 30.59 1dgj n ARG 608 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1dgj s SER 609 N -0.03 6.97 0.41 0.55 0.01 -1.06 -4.81 113.70 115.75 1dgj s SER 609 Ca 0.00 2.30 0.08 0.00 1.31 0.00 0.00 55.95 59.64 1dgj s SER 609 Cb 0.00 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.62 1dgj s SER 609 CO 0.00 -0.48 0.50 -0.89 0.41 0.00 0.00 173.24 172.79 1dgj s THR 610 N 0.20 2.98 0.28 1.44 2.01 0.11 -4.96 115.64 117.69 1dgj s THR 610 Ca 0.56 -1.11 0.14 0.00 0.31 0.00 0.00 61.69 61.59 1dgj s THR 610 Cb -0.35 -3.03 0.05 0.00 0.01 0.00 0.00 72.50 69.19 1dgj s THR 610 CO 0.36 -0.01 1.71 0.00 -0.69 0.00 0.00 174.62 175.99 1dgj h ALA 611 N 0.78 1.09 0.00 7.40 0.00 -2.01 -3.24 119.26 123.28 1dgj h ALA 611 Ca -0.41 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 53.91 1dgj h ALA 611 Cb 1.27 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1dgj h ALA 611 CO 0.49 0.60 -1.84 -0.85 0.00 0.00 0.00 179.25 177.65 1dgj n GLU 612 N -3.80 0.65 -3.84 0.00 0.28 -1.26 -4.80 120.64 107.87 1dgj n GLU 612 Ca -0.01 0.01 -0.30 0.00 -0.16 0.00 0.00 57.16 56.69 1dgj n GLU 612 Cb 0.52 -1.63 -0.15 0.00 1.43 0.00 0.00 31.44 31.61 1dgj n GLU 612 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1dgj s ILE 613 N -3.05 1.41 0.18 3.84 1.01 -1.22 -2.41 121.20 120.96 1dgj s ILE 613 Ca -0.06 -1.77 -0.24 0.00 0.00 0.00 0.00 60.65 58.57 1dgj s ILE 613 Cb 0.10 -2.06 -0.08 0.00 0.01 0.00 0.00 42.46 40.43 1dgj s ILE 613 CO 0.85 -0.65 0.78 -0.54 0.00 0.00 0.00 174.94 175.37 1dgj s LYS 614 N 1.33 4.52 0.03 2.79 -0.14 -0.60 0.06 119.74 127.72 1dgj s LYS 614 Ca 0.10 1.12 0.08 0.00 -1.36 0.00 0.00 55.97 55.92 1dgj s LYS 614 Cb -0.18 -3.17 -0.03 0.00 -1.68 0.00 0.00 37.83 32.77 1dgj s LYS 614 CO -0.19 0.53 -0.24 1.03 -0.76 0.00 0.00 175.35 175.73 1dgj s ARG 615 N -1.34 1.97 0.23 1.68 0.52 -1.26 0.30 118.95 121.05 1dgj s ARG 615 Ca 0.38 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.57 1dgj s ARG 615 Cb -0.22 -2.07 -0.04 0.00 0.52 0.00 0.00 34.95 33.14 1dgj s ARG 615 CO 0.25 0.54 0.12 0.20 0.02 0.00 0.00 175.30 176.43 1dgj s GLY 616 N -1.14 1.63 -0.03 -3.53 0.00 0.25 -4.50 107.32 100.00 1dgj s GLY 616 Ca 0.12 -1.78 0.04 0.00 0.00 0.00 0.00 44.72 43.10 1dgj s GLY 616 CO 0.02 -1.49 -0.14 0.54 0.00 0.00 0.00 173.10 172.02 1dgj s VAL 617 N -3.94 1.19 0.02 1.40 0.11 -1.26 -1.22 120.40 116.70 1dgj s VAL 617 Ca 0.38 -0.60 0.03 0.00 -2.93 0.00 0.00 61.98 58.86 1dgj s VAL 617 Cb 0.07 -1.02 -0.01 0.00 -1.53 0.00 0.00 36.38 33.89 1dgj s VAL 617 CO 0.13 0.35 -0.09 -0.83 -3.33 0.00 0.00 175.10 171.33 1dgj s GLY 618 N -0.05 0.48 0.32 6.54 0.00 -0.16 -4.16 107.32 110.29 1dgj s GLY 618 Ca -0.00 -0.53 0.09 0.00 0.00 0.00 0.00 44.72 44.27 1dgj s GLY 618 CO 0.01 -0.51 -0.09 -1.34 0.00 0.00 0.00 173.10 171.16 1dgj s VAL 619 N -0.62 2.08 -0.21 1.40 -7.23 -1.26 -0.93 120.40 113.63 1dgj s VAL 619 Ca -0.01 -2.19 -0.28 0.00 -1.81 0.00 0.00 61.98 57.69 1dgj s VAL 619 Cb -0.06 -2.58 0.13 0.00 0.56 0.00 0.00 36.38 34.44 1dgj s VAL 619 CO 0.00 -0.24 1.06 0.00 -0.31 0.00 0.00 175.10 175.61 1dgj s ALA 620 N -2.72 -1.97 -0.17 1.32 0.00 -0.80 -4.26 121.76 113.15 1dgj s ALA 620 Ca 0.32 1.70 -0.05 0.00 0.00 0.00 0.00 51.96 53.92 1dgj s ALA 620 Cb 0.03 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 1dgj s ALA 620 CO 0.15 -0.27 -0.00 -1.17 0.00 0.00 0.00 175.76 174.47 1dgj s LEU 621 N -0.66 3.39 0.02 0.00 2.96 -1.26 -0.86 118.68 122.28 1dgj s LEU 621 Ca 0.01 -0.10 0.08 0.00 -0.22 0.00 0.00 54.13 53.90 1dgj s LEU 621 Cb -0.02 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 1dgj s LEU 621 CO -0.02 0.14 -0.23 -0.83 -1.32 0.00 0.00 176.35 174.09 1dgj s GLY 622 N 0.53 1.20 -0.01 7.98 0.00 -0.79 -4.73 107.32 111.51 1dgj s GLY 622 Ca -0.01 -1.09 -0.02 0.00 0.00 0.00 0.00 44.72 43.60 1dgj s GLY 622 CO 0.02 -0.98 0.03 0.14 0.00 0.00 0.00 173.10 172.32 1dgj s VAL 623 N -0.71 0.03 0.12 1.40 1.01 -1.26 -1.67 120.40 119.32 1dgj s VAL 623 Ca 0.09 -0.27 -0.18 0.00 0.00 0.00 0.00 61.98 61.62 1dgj s VAL 623 Cb -0.09 -0.14 0.04 0.00 0.00 0.00 0.00 36.38 36.19 1dgj s VAL 623 CO 0.01 -0.15 0.45 -0.47 0.00 0.00 0.00 175.10 174.94 1dgj s TYR 624 N -0.44 -0.29 0.32 5.22 6.04 -0.92 -4.91 117.35 122.36 1dgj s TYR 624 Ca -0.05 0.05 -0.03 0.00 0.04 0.00 0.00 57.07 57.09 1dgj s TYR 624 Cb -0.03 0.32 -0.04 0.00 -1.04 0.00 0.00 41.96 41.16 1dgj s TYR 624 CO -0.00 -0.71 0.55 0.20 -1.54 0.00 0.00 175.55 174.05 1dgj s GLY 625 N -2.64 1.64 -0.33 8.97 0.00 -1.26 -0.55 107.32 113.14 1dgj s GLY 625 Ca 0.01 -0.71 -0.09 0.00 0.00 0.00 0.00 44.72 43.94 1dgj s GLY 625 CO -0.10 -0.62 0.14 0.00 0.00 0.00 0.00 173.10 172.51 1dgj s ALA 626 N -2.20 3.17 0.00 3.20 0.00 0.22 -4.66 121.76 121.49 1dgj s ALA 626 Ca 0.42 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.83 1dgj s ALA 626 Cb -0.10 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1dgj s ALA 626 CO 0.33 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1dgj n GLY 627 N 4.92 2.75 3.85 0.00 0.00 -0.10 -4.28 105.19 112.33 1dgj n GLY 627 Ca -0.13 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.58 1dgj n GLY 627 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dgj s LEU 628 N 0.00 3.87 0.36 0.99 1.43 -1.26 -4.87 118.68 119.20 1dgj s LEU 628 Ca 0.00 1.37 -0.25 0.00 -1.03 0.00 0.00 54.13 54.22 1dgj s LEU 628 Cb 0.00 -4.24 -0.13 0.00 0.03 0.00 0.00 46.19 41.86 1dgj s LEU 628 CO 0.00 -0.38 0.84 0.47 0.23 0.00 0.00 176.35 177.51 1dgj n ASP 629 N -0.98 0.48 0.00 2.29 9.92 -1.26 -4.44 116.55 122.56 1dgj n ASP 629 Ca 0.04 1.06 0.00 0.00 -0.53 0.00 0.00 54.79 55.36 1dgj n ASP 629 Cb 0.54 -1.23 0.00 0.00 -0.64 0.00 0.00 41.12 39.78 1dgj n ASP 629 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1dgj n GLY 630 N 1.43 0.18 2.81 0.44 0.00 -0.17 -4.31 105.19 105.57 1dgj n GLY 630 Ca 0.11 -0.91 -0.24 0.00 0.00 0.00 0.00 46.02 44.98 1dgj n GLY 630 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dgj n PRO 631 N 0.00 1.54 -2.04 1.61 -0.04 -1.24 -4.41 135.00 130.42 1dgj n PRO 631 Ca 0.00 -1.36 -0.42 0.00 -0.04 0.00 0.00 63.50 61.68 1dgj n PRO 631 Cb 0.00 -2.48 -0.03 0.00 -0.04 0.00 0.00 33.50 30.96 1dgj n PRO 631 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1dgj s ASP 632 N 4.15 6.70 0.19 3.54 3.68 -1.26 -4.68 116.67 128.99 1dgj s ASP 632 Ca 0.38 2.38 0.10 0.00 2.13 0.00 0.00 52.55 57.53 1dgj s ASP 632 Cb 0.10 -2.57 -0.04 0.00 -1.45 0.00 0.00 42.92 38.95 1dgj s ASP 632 CO 0.02 -0.81 -0.14 -0.89 0.13 0.00 0.00 175.17 173.48 1dgj s THR 633 N 2.24 2.90 0.02 1.71 2.01 -1.26 -1.57 115.64 121.67 1dgj s THR 633 Ca 0.70 -1.83 -0.06 0.00 0.31 0.00 0.00 61.69 60.80 1dgj s THR 633 Cb -0.37 -2.43 -0.00 0.00 0.01 0.00 0.00 72.50 69.70 1dgj s THR 633 CO 0.30 -0.14 0.12 -0.55 -0.69 0.00 0.00 174.62 173.66 1dgj s SER 634 N -2.85 0.09 0.17 3.53 0.15 -0.98 -4.64 113.70 109.17 1dgj s SER 634 Ca 0.24 -0.34 0.07 0.00 0.70 0.00 0.00 55.95 56.63 1dgj s SER 634 Cb -0.08 0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.39 1dgj s SER 634 CO 0.14 -0.42 -0.15 -0.70 1.20 0.00 0.00 173.24 173.31 1dgj s GLU 635 N -1.81 1.20 -0.21 5.44 2.56 -1.12 -2.10 118.70 122.66 1dgj s GLU 635 Ca -0.12 -1.44 -0.28 0.00 0.00 0.00 0.00 54.97 53.13 1dgj s GLU 635 Cb -0.06 -1.06 0.13 0.00 2.00 0.00 0.00 34.13 35.15 1dgj s GLU 635 CO -0.01 0.19 1.06 0.00 -0.56 0.00 0.00 175.26 175.95 1dgj s ALA 636 N -2.57 -1.98 0.15 6.30 0.00 -0.26 -4.23 121.76 119.17 1dgj s ALA 636 Ca 0.17 1.70 0.09 0.00 0.00 0.00 0.00 51.96 53.91 1dgj s ALA 636 Cb -0.03 -1.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 1dgj s ALA 636 CO 0.05 -0.27 -0.20 1.67 0.00 0.00 0.00 175.76 177.01 1dgj s TRP 637 N -0.66 1.87 -0.03 0.00 1.48 -0.57 0.65 118.94 121.67 1dgj s TRP 637 Ca 0.01 -0.44 0.02 0.00 -1.06 0.00 0.00 56.10 54.63 1dgj s TRP 637 Cb -0.02 -0.96 0.01 0.00 -1.16 0.00 0.00 33.47 31.34 1dgj s TRP 637 CO -0.02 0.31 -0.09 0.08 -4.06 0.00 0.00 176.95 173.17 1dgj s VAL 638 N -1.76 0.78 -0.09 -0.66 1.01 -0.56 -0.60 120.40 118.53 1dgj s VAL 638 Ca 0.14 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1dgj s VAL 638 Cb -0.07 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.62 1dgj s VAL 638 CO 0.06 0.25 -0.12 -0.70 0.00 0.00 0.00 175.10 174.59 1dgj s GLU 639 N 0.35 1.83 0.20 2.72 2.12 -0.83 0.44 118.70 125.52 1dgj s GLU 639 Ca -0.06 -0.43 -0.30 0.00 0.36 0.00 0.00 54.97 54.54 1dgj s GLU 639 Cb -0.10 -1.58 -0.08 0.00 0.26 0.00 0.00 34.13 32.63 1dgj s GLU 639 CO 0.01 -0.05 1.07 -1.17 -0.54 0.00 0.00 175.26 174.58 1dgj s LEU 640 N 0.93 4.52 0.27 2.70 2.96 -0.42 -2.35 118.68 127.29 1dgj s LEU 640 Ca -0.09 2.09 0.07 0.00 -0.22 0.00 0.00 54.13 55.98 1dgj s LEU 640 Cb -0.15 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 42.90 1dgj s LEU 640 CO 0.00 -0.14 0.22 0.20 -1.32 0.00 0.00 176.35 175.31 1dgj s ASN 641 N -0.40 5.49 0.27 3.68 0.01 -0.46 -4.83 114.94 118.69 1dgj s ASN 641 Ca 0.47 -0.29 -0.04 0.00 -0.71 0.00 0.00 52.86 52.29 1dgj s ASN 641 Cb -0.29 -1.32 0.36 0.00 0.41 0.00 0.00 41.25 40.40 1dgj s ASN 641 CO 0.35 -0.10 1.91 0.44 -1.51 0.00 0.00 177.10 178.19 1dgj h ASP 642 N 1.44 1.07 0.00 -1.22 3.32 -1.91 -1.18 116.42 117.95 1dgj h ASP 642 Ca -0.48 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1dgj h ASP 642 Cb 1.24 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1dgj h ASP 642 CO 0.60 0.74 0.00 -0.90 -1.72 0.00 0.00 179.24 177.96 1dgj n ASP 643 N -4.44 0.19 0.00 6.45 5.75 -1.26 -4.71 116.55 118.53 1dgj n ASP 643 Ca 0.13 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 1dgj n ASP 643 Cb 0.10 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1dgj n ASP 643 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dgj n GLY 644 N 0.36 0.66 3.97 6.12 0.00 -0.44 -5.04 105.19 110.82 1dgj n GLY 644 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1dgj n GLY 644 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dgj s SER 645 N -2.31 4.14 0.01 1.61 1.04 -1.25 -4.86 113.70 112.07 1dgj s SER 645 Ca 0.00 -0.10 0.03 0.00 0.48 0.00 0.00 55.95 56.36 1dgj s SER 645 Cb 0.00 -0.25 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 1dgj s SER 645 CO 0.00 -2.01 -0.10 -0.69 0.98 0.00 0.00 173.24 171.42 1dgj s VAL 646 N -3.32 0.77 -0.21 5.02 1.01 -0.56 -1.36 120.40 121.74 1dgj s VAL 646 Ca 0.67 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 1dgj s VAL 646 Cb -0.06 -0.67 0.01 0.00 0.00 0.00 0.00 36.38 35.66 1dgj s VAL 646 CO 0.46 0.11 -0.11 -0.89 0.00 0.00 0.00 175.10 174.66 1dgj s THR 647 N -0.44 2.69 -0.16 3.92 2.01 -0.99 0.93 115.64 123.59 1dgj s THR 647 Ca 0.02 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.05 1dgj s THR 647 Cb -0.05 -2.23 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 1dgj s THR 647 CO 0.00 0.41 0.34 -0.22 -0.69 0.00 0.00 174.62 174.47 1dgj s LEU 648 N 1.36 4.23 -0.23 4.42 0.20 0.13 -1.97 118.68 126.81 1dgj s LEU 648 Ca 0.04 0.55 -0.02 0.00 0.69 0.00 0.00 54.13 55.39 1dgj s LEU 648 Cb -0.14 -2.45 0.01 0.00 -0.43 0.00 0.00 46.19 43.18 1dgj s LEU 648 CO -0.08 0.04 -0.07 -0.83 -0.29 0.00 0.00 176.35 175.13 1dgj s GLY 649 N 0.64 1.59 0.34 7.98 0.00 0.24 -0.35 107.32 117.77 1dgj s GLY 649 Ca 0.18 -1.33 0.01 0.00 0.00 0.00 0.00 44.72 43.58 1dgj s GLY 649 CO 0.06 0.46 0.43 1.16 0.00 0.00 0.00 173.10 175.21 1dgj n ASN 650 N 4.71 -1.17 -2.55 1.64 0.23 -0.83 -1.51 115.26 115.78 1dgj n ASN 650 Ca -0.18 -2.96 -0.14 0.00 -0.53 0.00 0.00 54.58 50.78 1dgj n ASN 650 Cb 0.49 2.28 0.03 0.00 -2.08 0.00 0.00 39.78 40.50 1dgj n ASN 650 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1dgj n SER 651 N -1.65 2.88 -4.54 0.53 7.64 -1.26 -2.06 113.62 115.17 1dgj n SER 651 Ca 0.03 -2.98 -0.42 0.00 1.01 0.00 0.00 58.87 56.51 1dgj n SER 651 Cb 0.59 -0.47 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 1dgj n SER 651 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1dgj s TRP 652 N -3.47 2.69 0.39 1.43 -0.11 -1.26 -4.54 118.94 114.06 1dgj s TRP 652 Ca 0.36 -1.03 -0.27 0.00 1.22 0.00 0.00 56.10 56.38 1dgj s TRP 652 Cb 0.40 -4.61 -0.11 0.00 -1.50 0.00 0.00 33.47 27.66 1dgj s TRP 652 CO -0.04 -1.83 1.31 0.39 -4.62 0.00 0.00 176.95 172.16 1dgj n GLU 653 N 8.30 2.10 -3.88 5.86 4.71 -1.26 -4.83 120.64 131.64 1dgj n GLU 653 Ca 0.32 0.74 -0.36 0.00 -0.01 0.00 0.00 57.16 57.86 1dgj n GLU 653 Cb 0.50 -2.40 -0.14 0.00 -1.01 0.00 0.00 31.44 28.40 1dgj n GLU 653 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1dgj s ASP 654 N -0.40 4.64 0.16 1.62 2.15 -1.26 -4.75 116.67 118.83 1dgj s ASP 654 Ca 0.58 -0.80 0.26 0.00 0.43 0.00 0.00 52.55 53.01 1dgj s ASP 654 Cb -0.53 -1.75 0.65 0.00 -0.30 0.00 0.00 42.92 41.00 1dgj s ASP 654 CO 0.60 -0.15 1.61 1.41 -0.17 0.00 0.00 175.17 178.47 1dgj n HIS 655 N 4.75 0.74 0.00 -5.34 8.25 -1.26 -4.34 115.22 118.01 1dgj n HIS 655 Ca -0.16 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1dgj n HIS 655 Cb 0.47 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.78 1dgj n HIS 655 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dgj n GLY 656 N 1.33 1.18 0.25 -1.41 0.00 -1.26 -1.86 105.19 103.42 1dgj n GLY 656 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 1dgj n GLY 656 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1dgj h GLN 657 N 0.00 0.00 0.00 1.61 -0.00 -1.88 -3.08 115.11 111.76 1dgj h GLN 657 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1dgj h GLN 657 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1dgj h GLN 657 CO 0.00 0.12 0.00 0.41 -0.00 0.00 0.00 178.83 179.36 1dgj n GLY 658 N 0.07 0.92 0.26 0.06 0.00 -1.26 -4.92 105.19 100.32 1dgj n GLY 658 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1dgj n GLY 658 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj h ALA 659 N 0.00 1.57 -0.30 4.61 0.00 -1.88 -2.27 119.26 120.99 1dgj h ALA 659 Ca 0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1dgj h ALA 659 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1dgj h ALA 659 CO 0.00 0.13 -0.36 0.38 0.00 0.00 0.00 179.25 179.39 1dgj h ASP 660 N 0.00 0.84 -0.12 0.00 2.03 -1.95 -1.73 116.42 115.49 1dgj h ASP 660 Ca -0.00 -0.49 -0.11 0.00 -0.73 0.00 0.00 57.03 55.70 1dgj h ASP 660 Cb 0.21 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.46 1dgj h ASP 660 CO 0.01 1.16 -0.27 0.00 -1.03 0.00 0.00 179.24 179.11 1dgj h ALA 661 N 0.70 0.98 -0.35 4.15 0.00 -1.86 -2.13 119.26 120.74 1dgj h ALA 661 Ca 0.04 -0.37 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 1dgj h ALA 661 Cb 0.95 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1dgj h ALA 661 CO 0.09 0.60 -0.43 0.78 0.00 0.00 0.00 179.25 180.29 1dgj h GLY 662 N 1.02 0.98 0.99 0.00 0.00 -1.36 -0.03 103.07 104.67 1dgj h GLY 662 Ca 0.07 -1.04 -0.10 0.00 0.00 0.00 0.00 47.33 46.26 1dgj h GLY 662 CO 0.06 0.94 -0.13 1.76 0.00 0.00 0.00 176.54 179.17 1dgj h SER 663 N 0.72 0.80 -0.18 0.19 0.02 -1.18 -2.65 113.55 111.27 1dgj h SER 663 Ca 0.05 -0.38 -0.03 0.00 -0.84 0.00 0.00 61.79 60.59 1dgj h SER 663 Cb 1.03 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1dgj h SER 663 CO 0.10 0.99 -0.01 0.25 -1.14 0.00 0.00 176.83 177.02 1dgj h LEU 664 N 0.59 0.32 -0.83 5.07 5.85 -1.33 -1.21 115.31 123.77 1dgj h LEU 664 Ca 0.10 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 1dgj h LEU 664 Cb 0.66 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1dgj h LEU 664 CO 0.04 0.57 0.24 1.23 -0.34 0.00 0.00 178.44 180.19 1dgj h GLY 665 N 0.07 1.19 0.80 3.75 0.00 -1.05 -0.58 103.07 107.25 1dgj h GLY 665 Ca 0.05 -0.68 -0.10 0.00 0.00 0.00 0.00 47.33 46.60 1dgj h GLY 665 CO 0.01 0.64 -0.29 -0.84 0.00 0.00 0.00 176.54 176.06 1dgj h THR 666 N 1.07 1.36 0.33 4.70 2.02 -1.46 -2.18 112.91 118.75 1dgj h THR 666 Ca 0.24 -1.55 -0.02 0.00 0.77 0.00 0.00 66.41 65.85 1dgj h THR 666 Cb 0.28 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 1dgj h THR 666 CO -0.01 0.46 -0.16 0.00 0.37 0.00 0.00 175.52 176.18 1dgj h ALA 667 N 0.55 -0.44 -0.56 6.16 0.00 -1.17 -2.24 119.26 121.57 1dgj h ALA 667 Ca 0.01 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.88 1dgj h ALA 667 Cb 0.88 0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.75 1dgj h ALA 667 CO 0.06 -0.66 -0.02 1.25 0.00 0.00 0.00 179.25 179.89 1dgj h HIS 668 N -0.62 -0.07 -0.83 0.00 6.17 -1.17 0.14 115.15 118.77 1dgj h HIS 668 Ca -0.04 0.04 -0.01 0.00 0.71 0.00 0.00 60.37 61.07 1dgj h HIS 668 Cb 0.45 0.12 -0.04 0.00 2.52 0.00 0.00 27.41 30.45 1dgj h HIS 668 CO -0.01 -0.15 0.47 1.49 0.71 0.00 0.00 177.93 180.44 1dgj h GLU 669 N 0.10 1.14 0.00 5.26 4.57 -1.33 -2.66 114.58 121.67 1dgj h GLU 669 Ca 0.29 -0.12 -0.06 0.00 -1.18 0.00 0.00 59.36 58.28 1dgj h GLU 669 Cb 0.45 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1dgj h GLU 669 CO -0.49 0.83 -0.29 0.00 -1.18 0.00 0.00 179.01 177.88 1dgj h ALA 670 N 1.25 0.92 -0.33 2.92 0.00 -0.43 -3.09 119.26 120.50 1dgj h ALA 670 Ca 0.29 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1dgj h ALA 670 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1dgj h ALA 670 CO -0.05 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.84 1dgj n LEU 671 N -3.32 2.11 -0.25 0.00 7.99 0.33 -4.62 117.00 119.24 1dgj n LEU 671 Ca 0.01 -0.99 0.02 0.00 -0.01 0.00 0.00 56.01 55.04 1dgj n LEU 671 Cb 0.53 -0.22 0.10 0.00 -0.11 0.00 0.00 43.42 43.72 1dgj n LEU 671 CO 0.36 0.50 0.74 0.03 -1.51 0.00 0.00 177.39 177.50 1dgj h ARG 672 N 2.49 0.02 0.00 3.23 2.47 -1.42 -0.96 114.38 120.21 1dgj h ARG 672 Ca 0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1dgj h ARG 672 Cb 0.56 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1dgj h ARG 672 CO 0.00 0.01 0.06 -1.00 0.56 0.00 0.00 179.97 179.60 1dgj h PRO 673 N 0.02 0.00 -0.01 0.04 0.13 -1.88 0.21 132.00 130.50 1dgj h PRO 673 Ca 0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1dgj h PRO 673 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1dgj h PRO 673 CO -0.73 0.00 -0.45 1.28 -0.23 0.00 0.00 178.00 177.87 1dgj n LEU 674 N -2.40 1.82 -0.93 1.56 4.77 -0.37 -4.97 117.00 116.47 1dgj n LEU 674 Ca -0.02 -0.66 -0.12 0.00 -0.03 0.00 0.00 56.01 55.18 1dgj n LEU 674 Cb 0.09 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 1dgj n LEU 674 CO 0.11 0.34 -0.12 0.61 -1.33 0.00 0.00 177.39 177.01 1dgj n GLY 675 N 1.41 1.29 3.72 -0.72 0.00 0.74 -4.96 105.19 106.68 1dgj n GLY 675 Ca 0.10 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1dgj n GLY 675 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1dgj n ILE 676 N -2.55 0.24 -3.06 -0.61 2.08 -1.25 -5.00 119.36 109.21 1dgj n ILE 676 Ca -0.12 -0.06 -0.26 0.00 0.56 0.00 0.00 62.75 62.87 1dgj n ILE 676 Cb 0.45 -1.97 -0.01 0.00 -0.75 0.00 0.00 39.64 37.36 1dgj n ILE 676 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1dgj s THR 677 N 0.89 5.01 0.38 1.39 -4.23 -1.26 -4.89 115.64 112.92 1dgj s THR 677 Ca 0.73 -0.11 0.11 0.00 -1.18 0.00 0.00 61.69 61.24 1dgj s THR 677 Cb -0.51 -3.85 0.33 0.00 1.34 0.00 0.00 72.50 69.82 1dgj s THR 677 CO 0.36 -0.65 1.89 -0.65 -0.54 0.00 0.00 174.62 175.03 1dgj h PRO 678 N 0.66 0.60 0.00 3.99 0.11 -1.94 -0.77 132.00 134.65 1dgj h PRO 678 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1dgj h PRO 678 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1dgj h PRO 678 CO 0.62 0.40 0.00 -0.85 -0.21 0.00 0.00 178.00 177.96 1dgj n GLU 679 N -4.53 0.48 -1.01 1.05 0.00 -1.26 -3.29 120.64 112.08 1dgj n GLU 679 Ca 0.16 0.04 -0.11 0.00 0.00 0.00 0.00 57.16 57.25 1dgj n GLU 679 Cb 0.47 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 30.58 1dgj n GLU 679 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1dgj n ASN 680 N -1.20 3.16 -3.78 -1.84 5.03 -0.29 -4.82 115.26 111.53 1dgj n ASN 680 Ca 0.14 -3.76 -0.30 0.00 0.87 0.00 0.00 54.58 51.52 1dgj n ASN 680 Cb 0.16 -0.68 -0.15 0.00 -1.02 0.00 0.00 39.78 38.09 1dgj n ASN 680 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1dgj s ILE 681 N -3.45 1.10 0.36 2.41 1.01 -1.21 -1.50 121.20 119.93 1dgj s ILE 681 Ca 0.49 -1.58 -0.14 0.00 0.00 0.00 0.00 60.65 59.42 1dgj s ILE 681 Cb 0.43 -1.83 -0.08 0.00 0.01 0.00 0.00 42.46 40.99 1dgj s ILE 681 CO 0.02 -0.67 0.76 -1.00 0.00 0.00 0.00 174.94 174.05 1dgj s HIS 682 N 1.47 3.41 -0.12 3.97 3.76 0.26 -4.93 115.29 123.11 1dgj s HIS 682 Ca 0.10 1.17 0.01 0.00 -0.15 0.00 0.00 55.06 56.19 1dgj s HIS 682 Cb -0.18 -2.52 0.02 0.00 1.11 0.00 0.00 32.58 31.01 1dgj s HIS 682 CO -0.22 0.00 -0.14 -0.51 -0.85 0.00 0.00 174.74 173.02 1dgj s LEU 683 N -3.33 1.65 -0.29 0.89 1.43 -1.26 0.20 118.68 117.97 1dgj s LEU 683 Ca 0.53 -0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.19 1dgj s LEU 683 Cb -0.10 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 45.09 1dgj s LEU 683 CO 0.23 -0.02 -0.00 -0.69 0.23 0.00 0.00 176.35 176.09 1dgj s VAL 684 N 1.19 3.05 0.10 -1.59 1.01 0.53 -4.95 120.40 119.74 1dgj s VAL 684 Ca -0.03 -1.26 0.03 0.00 0.00 0.00 0.00 61.98 60.72 1dgj s VAL 684 Cb -0.14 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 1dgj s VAL 684 CO -0.05 -0.03 -0.08 -0.04 0.00 0.00 0.00 175.10 174.90 1dgj s MET 685 N 1.29 0.85 -0.73 2.72 -1.94 -1.26 -1.97 119.30 118.26 1dgj s MET 685 Ca -0.04 -1.25 -0.07 0.00 -1.71 0.00 0.00 55.69 52.62 1dgj s MET 685 Cb -0.19 -0.38 0.01 0.00 2.01 0.00 0.00 34.83 36.28 1dgj s MET 685 CO -0.01 0.03 0.63 0.09 -0.01 0.00 0.00 175.02 175.75 1dgj n ASN 686 N 0.25 -5.71 -3.15 3.03 3.02 -0.87 -4.93 115.26 106.89 1dgj n ASN 686 Ca -0.14 -0.58 0.04 0.00 -0.03 0.00 0.00 54.58 53.88 1dgj n ASN 686 Cb 0.59 -2.60 -0.01 0.00 -0.61 0.00 0.00 39.78 37.16 1dgj n ASN 686 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1dgj s ASP 687 N -2.72 -1.14 0.09 6.41 3.68 -1.26 -2.74 116.67 118.98 1dgj s ASP 687 Ca 0.08 0.53 0.06 0.00 2.13 0.00 0.00 52.55 55.35 1dgj s ASP 687 Cb -0.01 1.88 0.32 0.00 -1.45 0.00 0.00 42.92 43.66 1dgj s ASP 687 CO 0.86 -0.21 1.16 0.35 0.13 0.00 0.00 175.17 177.45 1dgj n THR 688 N 5.41 1.64 1.03 1.71 -2.24 -0.82 0.65 114.28 121.66 1dgj n THR 688 Ca -0.00 0.57 0.11 0.00 -2.27 0.00 0.00 64.05 62.46 1dgj n THR 688 Cb 0.53 -1.57 0.07 0.00 -2.10 0.00 0.00 70.33 67.26 1dgj n THR 688 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1dgj n SER 689 N -1.69 1.06 0.00 3.42 3.41 -1.26 -4.61 113.62 113.94 1dgj n SER 689 Ca -0.00 -0.88 0.00 0.00 -0.26 0.00 0.00 58.87 57.73 1dgj n SER 689 Cb 0.04 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1dgj n SER 689 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1dgj n LYS 690 N -1.12 0.65 -4.37 4.33 5.02 0.47 -5.08 118.16 118.06 1dgj n LYS 690 Ca 0.06 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.01 1dgj n LYS 690 Cb 0.36 -0.81 -0.09 0.00 -0.02 0.00 0.00 35.03 34.47 1dgj n LYS 690 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1dgj s THR 691 N -1.62 4.20 1.24 -0.18 -4.23 0.21 -4.97 115.64 110.28 1dgj s THR 691 Ca 0.00 -0.40 -0.16 0.00 -1.18 0.00 0.00 61.69 59.96 1dgj s THR 691 Cb 0.00 -2.80 0.31 0.00 1.34 0.00 0.00 72.50 71.35 1dgj s THR 691 CO 0.00 0.52 1.00 -2.16 -0.54 0.00 0.00 174.62 173.44 1dgj s PRO 692 N -1.13 -1.50 -0.89 3.99 0.04 -1.26 -4.40 135.00 129.85 1dgj s PRO 692 Ca 0.16 0.59 -0.24 0.00 0.04 0.00 0.00 61.00 61.55 1dgj s PRO 692 Cb -0.11 -1.51 0.05 0.00 0.04 0.00 0.00 34.50 32.98 1dgj s PRO 692 CO 0.05 -4.04 1.32 1.21 0.04 0.00 0.00 177.00 175.58 1dgj s ASN 693 N -2.74 6.38 0.08 6.66 3.84 -1.26 -4.17 114.94 123.73 1dgj s ASN 693 Ca 0.68 -1.17 0.26 0.00 0.21 0.00 0.00 52.86 52.84 1dgj s ASN 693 Cb -0.21 -2.53 0.71 0.00 -0.55 0.00 0.00 41.25 38.66 1dgj s ASN 693 CO 0.63 -1.55 1.60 -1.20 -2.79 0.00 0.00 177.10 173.78 1dgj n SER 694 N 8.67 0.50 0.00 -4.21 7.64 -1.26 -2.79 113.62 122.18 1dgj n SER 694 Ca 0.20 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.30 1dgj n SER 694 Cb 0.50 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1dgj n SER 694 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dgj n GLY 695 N 1.41 0.04 3.76 0.23 0.00 -1.26 -4.60 105.19 104.76 1dgj n GLY 695 Ca 0.05 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 1dgj n GLY 695 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dgj s PRO 696 N -2.48 2.97 -1.32 1.61 0.04 -1.26 -4.74 135.00 129.83 1dgj s PRO 696 Ca 0.00 1.69 -0.08 0.00 0.04 0.00 0.00 61.00 62.65 1dgj s PRO 696 Cb 0.00 -1.94 0.13 0.00 0.04 0.00 0.00 34.50 32.73 1dgj s PRO 696 CO 0.00 -1.17 2.10 0.00 0.04 0.00 0.00 177.00 177.96 1dgj n ALA 697 N -1.74 5.91 -2.48 8.56 0.00 -0.23 -4.61 120.51 125.92 1dgj n ALA 697 Ca 0.13 -4.19 -0.09 0.00 0.00 0.00 0.00 53.44 49.28 1dgj n ALA 697 Cb 0.50 -2.97 -0.08 0.00 0.00 0.00 0.00 19.45 16.91 1dgj n ALA 697 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1dgj s GLY 698 N 0.88 0.46 0.00 0.00 0.00 -1.26 -4.88 107.32 102.52 1dgj s GLY 698 Ca 0.46 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 44.22 1dgj s GLY 698 CO -0.03 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 172.69 1dgj n GLY 699 N -0.11 0.44 3.75 0.20 0.00 -1.26 -3.20 105.19 105.01 1dgj n GLY 699 Ca -0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 1dgj n GLY 699 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dgj n SER 700 N -0.22 -5.11 -0.07 1.61 7.64 -1.26 -0.92 113.62 115.29 1dgj n SER 700 Ca 0.00 -0.67 -0.11 0.00 1.01 0.00 0.00 58.87 59.10 1dgj n SER 700 Cb 0.11 -4.08 -0.15 0.00 -1.01 0.00 0.00 64.21 59.08 1dgj n SER 700 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1dgj n ARG 701 N -4.61 0.67 -0.29 1.43 1.85 -1.19 -3.81 116.66 110.70 1dgj n ARG 701 Ca 0.02 0.13 -0.02 0.00 -1.00 0.00 0.00 57.85 56.99 1dgj n ARG 701 Cb 0.54 -1.63 0.04 0.00 -1.05 0.00 0.00 32.46 30.36 1dgj n ARG 701 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1dgj h SER 702 N 0.01 -1.21 -0.48 2.89 0.02 -1.82 0.01 113.55 112.97 1dgj h SER 702 Ca -0.46 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1dgj h SER 702 Cb 2.11 0.64 -0.02 0.00 0.14 0.00 0.00 62.40 65.27 1dgj h SER 702 CO 0.04 -0.29 0.32 -0.61 -1.14 0.00 0.00 176.83 175.14 1dgj h GLN 703 N -0.07 0.63 0.00 3.45 5.75 -1.92 0.55 115.11 123.50 1dgj h GLN 703 Ca 0.31 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.72 1dgj h GLN 703 Cb 0.58 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.98 1dgj h GLN 703 CO -0.84 0.42 -0.45 0.28 -2.65 0.00 0.00 178.83 175.60 1dgj h VAL 704 N 0.65 0.42 0.31 2.39 2.07 -1.64 -3.11 116.25 117.35 1dgj h VAL 704 Ca 0.18 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 1dgj h VAL 704 Cb -0.07 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1dgj h VAL 704 CO -0.04 0.14 -0.15 0.58 0.02 0.00 0.00 177.57 178.13 1dgj h VAL 705 N -1.00 0.04 -0.57 2.57 2.07 -1.11 -2.62 116.25 115.63 1dgj h VAL 705 Ca -0.07 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 1dgj h VAL 705 Cb 0.59 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1dgj h VAL 705 CO -0.04 0.01 0.12 0.74 0.02 0.00 0.00 177.57 178.42 1dgj h THR 706 N -1.11 1.24 -0.53 2.57 2.02 -1.27 -1.58 112.91 114.25 1dgj h THR 706 Ca -0.04 -0.88 0.05 0.00 0.77 0.00 0.00 66.41 66.31 1dgj h THR 706 Cb 0.34 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.36 1dgj h THR 706 CO 0.07 0.33 0.26 1.23 0.37 0.00 0.00 175.52 177.78 1dgj h GLY 707 N 1.00 0.74 1.30 2.16 0.00 -0.88 -0.07 103.07 107.32 1dgj h GLY 707 Ca 0.18 -0.17 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 1dgj h GLY 707 CO 0.00 0.10 0.13 3.43 0.00 0.00 0.00 176.54 180.20 1dgj h ASN 708 N 0.50 0.82 -0.65 0.19 2.35 -0.99 0.18 115.58 117.98 1dgj h ASN 708 Ca 0.24 -0.16 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 1dgj h ASN 708 Cb 0.16 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1dgj h ASN 708 CO -0.18 0.81 0.07 0.00 -1.65 0.00 0.00 177.43 176.48 1dgj h ALA 709 N 1.30 0.86 -0.19 -0.83 0.00 -0.46 -0.26 119.26 119.68 1dgj h ALA 709 Ca 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1dgj h ALA 709 Cb 0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1dgj h ALA 709 CO 0.00 0.66 0.03 0.82 0.00 0.00 0.00 179.25 180.76 1dgj h ILE 710 N 1.01 1.22 -0.26 0.00 2.04 -0.65 -1.05 117.51 119.83 1dgj h ILE 710 Ca 0.19 -0.73 0.06 0.00 1.00 0.00 0.00 64.86 65.38 1dgj h ILE 710 Cb 0.49 1.34 -0.06 0.00 -0.74 0.00 0.00 36.82 37.85 1dgj h ILE 710 CO 0.02 0.22 -0.12 -0.09 0.00 0.00 0.00 178.15 178.18 1dgj h ARG 711 N 0.11 -0.08 -0.37 2.37 2.43 -0.41 -2.22 114.38 116.20 1dgj h ARG 711 Ca 0.06 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1dgj h ARG 711 Cb 0.31 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1dgj h ARG 711 CO 0.00 -0.06 0.23 0.28 -1.51 0.00 0.00 179.97 178.92 1dgj h VAL 712 N -0.09 1.12 -0.08 0.20 2.07 -0.95 -1.89 116.25 116.64 1dgj h VAL 712 Ca 0.14 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1dgj h VAL 712 Cb 0.29 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1dgj h VAL 712 CO -0.31 0.12 -0.00 0.00 0.02 0.00 0.00 177.57 177.39 1dgj h ALA 713 N 1.10 1.86 -0.08 1.67 0.00 -0.95 -2.00 119.26 120.86 1dgj h ALA 713 Ca 0.13 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.76 1dgj h ALA 713 Cb -0.00 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1dgj h ALA 713 CO -0.03 0.11 -0.84 0.00 0.00 0.00 0.00 179.25 178.50 1dgj h GLU 715 N 0.41 0.16 -0.15 0.00 5.08 -0.78 -0.19 114.58 119.11 1dgj h GLU 715 Ca -0.08 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.05 1dgj h GLU 715 Cb 1.49 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.72 1dgj h GLU 715 CO 0.17 0.25 -0.69 0.52 -1.00 0.00 0.00 179.01 178.25 1dgj h MET 716 N 0.16 0.73 -0.58 2.33 2.86 -1.35 -1.72 114.93 117.37 1dgj h MET 716 Ca 0.04 -0.59 -0.02 0.00 -2.06 0.00 0.00 59.70 57.07 1dgj h MET 716 Cb 0.24 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 1dgj h MET 716 CO 0.01 1.20 0.30 1.25 1.06 0.00 0.00 176.91 180.73 1dgj h LEU 717 N 0.44 0.74 -0.50 1.22 5.85 -0.86 0.18 115.31 122.37 1dgj h LEU 717 Ca -0.05 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.60 1dgj h LEU 717 Cb 1.33 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 1dgj h LEU 717 CO 0.14 0.64 0.27 0.40 -0.34 0.00 0.00 178.44 179.55 1dgj h ILE 718 N 0.78 0.99 0.00 4.05 2.04 -1.01 -1.22 117.51 123.14 1dgj h ILE 718 Ca 0.20 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.79 1dgj h ILE 718 Cb 0.08 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1dgj h ILE 718 CO -0.03 0.10 -0.42 -0.33 0.00 0.00 0.00 178.15 177.46 1dgj h GLU 719 N 0.53 0.00 0.00 2.37 4.39 -1.01 -2.59 114.58 118.27 1dgj h GLU 719 Ca 0.21 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.87 1dgj h GLU 719 Cb 0.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1dgj h GLU 719 CO -0.13 0.42 -0.19 0.78 -1.16 0.00 0.00 179.01 178.73 1dgj h GLY 720 N 1.71 0.00 -0.59 -3.84 0.00 0.46 -2.90 103.07 97.92 1dgj h GLY 720 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1dgj h GLY 720 CO 0.06 0.00 -0.15 1.03 0.00 0.00 0.00 176.54 177.48 1dgj n MET 721 N -3.32 1.47 -1.84 4.80 2.81 -0.60 -4.94 117.12 115.49 1dgj n MET 721 Ca 0.00 -1.00 -0.42 0.00 -1.81 0.00 0.00 57.70 54.48 1dgj n MET 721 Cb 0.43 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.43 1dgj n MET 721 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1dgj s ARG 722 N -2.22 4.16 0.07 0.03 1.81 -1.10 -1.06 118.95 120.64 1dgj s ARG 722 Ca 0.29 2.40 -0.29 0.00 -1.72 0.00 0.00 55.73 56.42 1dgj s ARG 722 Cb 0.20 -4.01 -0.05 0.00 -0.45 0.00 0.00 34.95 30.63 1dgj s ARG 722 CO 0.42 -0.88 0.93 0.21 -0.68 0.00 0.00 175.30 175.30 1dgj s LYS 723 N 4.05 4.63 -0.57 3.54 2.20 -0.01 -4.85 119.74 128.73 1dgj s LYS 723 Ca 0.80 1.37 -0.38 0.00 -0.36 0.00 0.00 55.97 57.40 1dgj s LYS 723 Cb -0.38 -3.40 -0.17 0.00 -1.51 0.00 0.00 37.83 32.37 1dgj s LYS 723 CO 0.35 0.15 2.29 -2.30 -0.36 0.00 0.00 175.35 175.49 1dgj n PRO 724 N 3.12 0.33 0.00 4.03 -0.02 -1.26 -1.67 135.00 139.52 1dgj n PRO 724 Ca 0.02 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1dgj n PRO 724 Cb 0.50 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1dgj n PRO 724 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dgj n GLY 725 N 6.95 1.15 2.93 -1.23 0.00 -1.26 -4.86 105.19 108.88 1dgj n GLY 725 Ca 0.53 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.26 1dgj n GLY 725 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dgj s GLY 726 N -0.11 2.77 0.00 -0.02 0.00 -0.67 -5.09 107.32 104.20 1dgj s GLY 726 Ca 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 44.72 41.08 1dgj s GLY 726 CO 0.00 1.06 0.00 0.61 0.00 0.00 0.00 173.10 174.77 1dgj n GLY 727 N 2.41 1.99 3.32 0.20 0.00 -1.26 -4.55 105.19 107.29 1dgj n GLY 727 Ca 0.14 -0.49 -0.19 0.00 0.00 0.00 0.00 46.02 45.49 1dgj n GLY 727 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dgj s PHE 728 N 0.00 1.64 0.81 1.61 0.40 -1.26 -0.83 117.98 120.35 1dgj s PHE 728 Ca 0.00 -0.56 -0.11 0.00 -0.60 0.00 0.00 56.93 55.66 1dgj s PHE 728 Cb 0.00 -0.79 0.18 0.00 0.51 0.00 0.00 43.02 42.92 1dgj s PHE 728 CO 0.00 0.29 1.10 1.19 0.70 0.00 0.00 175.22 178.50 1dgj n PHE 729 N -0.06 -3.74 -4.32 0.36 3.01 -0.22 -4.76 117.46 107.74 1dgj n PHE 729 Ca -0.11 -1.18 -0.18 0.00 1.01 0.00 0.00 57.45 57.00 1dgj n PHE 729 Cb 0.59 -0.84 -0.10 0.00 -0.01 0.00 0.00 39.48 39.12 1dgj n PHE 729 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1dgj s THR 730 N -3.35 1.61 0.57 4.37 -4.23 -1.26 -4.97 115.64 108.37 1dgj s THR 730 Ca 0.65 -2.14 0.31 0.00 -1.18 0.00 0.00 61.69 59.32 1dgj s THR 730 Cb -0.02 -1.97 0.44 0.00 1.34 0.00 0.00 72.50 72.29 1dgj s THR 730 CO 0.45 -0.61 1.83 -0.65 -0.54 0.00 0.00 174.62 175.10 1dgj h PRO 731 N 2.68 0.00 0.24 3.99 0.11 -1.87 0.47 132.00 137.63 1dgj h PRO 731 Ca -0.38 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 1dgj h PRO 731 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1dgj h PRO 731 CO 0.61 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 178.28 1dgj h ALA 732 N 1.40 -0.41 -0.63 -0.75 0.00 -1.94 -2.94 119.26 113.99 1dgj h ALA 732 Ca 0.36 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.36 1dgj h ALA 732 Cb 1.66 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 1dgj h ALA 732 CO -0.00 -0.39 0.44 0.93 0.00 0.00 0.00 179.25 180.23 1dgj h GLU 733 N -0.83 0.11 -0.15 0.00 5.08 -1.60 -0.53 114.58 116.65 1dgj h GLU 733 Ca -0.03 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1dgj h GLU 733 Cb 0.25 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1dgj h GLU 733 CO 0.06 0.08 0.07 1.98 -1.00 0.00 0.00 179.01 180.19 1dgj h MET 734 N 0.12 0.23 -0.49 2.33 4.05 -0.19 -2.52 114.93 118.46 1dgj h MET 734 Ca 0.30 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 1dgj h MET 734 Cb 1.03 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.77 1dgj h MET 734 CO -0.04 0.29 0.31 0.87 0.23 0.00 0.00 176.91 178.57 1dgj h LYS 735 N 0.11 0.66 -0.42 0.39 1.79 -0.91 -2.76 116.57 115.42 1dgj h LYS 735 Ca 0.05 -0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 1dgj h LYS 735 Cb 0.14 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 30.60 1dgj h LYS 735 CO -0.01 0.46 0.17 0.00 -1.08 0.00 0.00 179.45 178.99 1dgj h ALA 736 N 1.16 0.51 0.00 3.86 0.00 -1.41 -1.25 119.26 122.13 1dgj h ALA 736 Ca 0.18 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1dgj h ALA 736 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1dgj h ALA 736 CO -0.04 -0.22 0.00 0.39 0.00 0.00 0.00 179.25 179.39 1dgj n GLU 737 N -4.99 0.31 -2.00 0.00 -0.58 -0.96 -4.84 120.64 107.59 1dgj n GLU 737 Ca 0.03 0.09 -0.19 0.00 -0.42 0.00 0.00 57.16 56.67 1dgj n GLU 737 Cb 0.15 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.48 1dgj n GLU 737 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dgj n GLY 738 N -0.04 0.59 3.76 0.62 0.00 -0.47 -4.95 105.19 104.70 1dgj n GLY 738 Ca 0.09 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1dgj n GLY 738 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dgj s ARG 739 N -4.35 4.61 0.35 1.61 1.81 -1.06 -5.01 118.95 116.92 1dgj s ARG 739 Ca 0.00 1.78 -0.28 0.00 -1.72 0.00 0.00 55.73 55.51 1dgj s ARG 739 Cb 0.00 -3.15 -0.11 0.00 -0.45 0.00 0.00 34.95 31.24 1dgj s ARG 739 CO 0.00 0.19 1.41 -1.25 -0.68 0.00 0.00 175.30 174.97 1dgj s PRO 740 N -1.51 4.22 -0.10 3.54 0.04 -1.26 -4.77 135.00 135.15 1dgj s PRO 740 Ca 0.45 2.42 -0.06 0.00 0.04 0.00 0.00 61.00 63.84 1dgj s PRO 740 Cb -0.31 -3.02 -0.27 0.00 0.04 0.00 0.00 34.50 30.94 1dgj s PRO 740 CO 0.40 -0.39 0.43 0.52 0.04 0.00 0.00 177.00 178.01 1dgj h MET 741 N 3.24 0.27 -6.14 4.56 2.86 -1.95 -3.47 114.93 114.30 1dgj h MET 741 Ca -0.50 -0.47 -0.59 0.00 -2.06 0.00 0.00 59.70 56.09 1dgj h MET 741 Cb 1.23 0.17 -0.05 0.00 0.06 0.00 0.00 31.60 33.02 1dgj h MET 741 CO 0.65 1.20 -0.18 0.50 1.06 0.00 0.00 176.91 180.15 1dgj s ARG 742 N -2.56 3.90 -0.09 1.72 3.52 -1.26 -1.30 118.95 122.87 1dgj s ARG 742 Ca -0.20 0.37 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 1dgj s ARG 742 Cb 0.06 -3.07 0.02 0.00 -1.56 0.00 0.00 34.95 30.41 1dgj s ARG 742 CO 0.79 0.59 -0.09 0.71 -0.81 0.00 0.00 175.30 176.48 1dgj s TYR 743 N -1.29 1.36 0.02 5.12 1.51 0.17 -4.97 117.35 119.28 1dgj s TYR 743 Ca 0.31 -0.58 -0.19 0.00 -1.01 0.00 0.00 57.07 55.60 1dgj s TYR 743 Cb -0.15 -1.09 -0.06 0.00 -0.11 0.00 0.00 41.96 40.55 1dgj s TYR 743 CO 0.17 -0.38 0.54 -0.51 -1.11 0.00 0.00 175.55 174.26 1dgj s ASP 744 N 1.22 6.96 0.07 2.29 1.01 -1.26 -1.49 116.67 125.46 1dgj s ASP 744 Ca -0.04 1.14 0.08 0.00 0.71 0.00 0.00 52.55 54.44 1dgj s ASP 744 Cb -0.14 -2.34 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 1dgj s ASP 744 CO -0.03 0.21 -0.22 -0.83 0.21 0.00 0.00 175.17 174.51 1dgj s GLY 745 N -0.68 1.23 -0.02 0.21 0.00 0.21 -4.74 107.32 103.52 1dgj s GLY 745 Ca 0.28 -1.17 -0.12 0.00 0.00 0.00 0.00 44.72 43.71 1dgj s GLY 745 CO 0.17 -1.12 0.26 1.25 0.00 0.00 0.00 173.10 173.66 1dgj s LYS 746 N -1.47 0.57 -0.14 2.90 2.20 -1.26 -1.11 119.74 121.43 1dgj s LYS 746 Ca 0.08 -0.16 -0.11 0.00 -0.36 0.00 0.00 55.97 55.42 1dgj s LYS 746 Cb -0.09 0.25 0.04 0.00 -1.51 0.00 0.00 37.83 36.52 1dgj s LYS 746 CO 0.03 -0.14 0.37 -0.46 -0.36 0.00 0.00 175.35 174.79 1dgj s TRP 747 N -1.13 -0.46 -0.10 4.03 -0.00 -0.89 -4.81 118.94 115.59 1dgj s TRP 747 Ca -0.12 1.06 0.03 0.00 -0.00 0.00 0.00 56.10 57.07 1dgj s TRP 747 Cb -0.05 0.17 -0.00 0.00 -0.00 0.00 0.00 33.47 33.58 1dgj s TRP 747 CO 0.03 -0.24 -0.22 0.99 -0.00 0.00 0.00 176.95 177.51 1dgj s THR 748 N 0.62 2.28 0.18 5.86 2.01 -1.26 -2.31 115.64 123.02 1dgj s THR 748 Ca -0.03 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 60.72 1dgj s THR 748 Cb -0.05 -1.89 -0.09 0.00 0.01 0.00 0.00 72.50 70.49 1dgj s THR 748 CO -0.04 0.55 1.33 0.00 -0.69 0.00 0.00 174.62 175.78 1dgj s ALA 749 N 0.29 3.54 -1.30 7.40 0.00 -0.61 -4.93 121.76 126.15 1dgj s ALA 749 Ca -0.16 1.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.78 1dgj s ALA 749 Cb -0.17 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.42 1dgj s ALA 749 CO 0.08 -0.56 2.29 -0.35 0.00 0.00 0.00 175.76 177.21 1dgj n PRO 750 N 2.92 2.65 -4.33 0.00 -0.04 -1.26 -4.32 135.00 130.61 1dgj n PRO 750 Ca 0.07 -2.27 -0.17 0.00 -0.04 0.00 0.00 63.50 61.09 1dgj n PRO 750 Cb 0.43 -3.05 -0.10 0.00 -0.04 0.00 0.00 33.50 30.73 1dgj n PRO 750 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dgj s ALA 751 N 3.42 1.81 -0.01 0.55 0.00 -1.26 -4.72 121.76 121.55 1dgj s ALA 751 Ca 0.53 -1.80 0.03 0.00 0.00 0.00 0.00 51.96 50.72 1dgj s ALA 751 Cb 0.14 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.87 1dgj s ALA 751 CO -0.04 -0.30 -0.09 0.15 0.00 0.00 0.00 175.76 175.49 1dgj s LYS 752 N -3.90 0.79 0.85 0.00 1.02 0.35 -3.60 119.74 115.25 1dgj s LYS 752 Ca 0.30 -0.31 -0.12 0.00 0.02 0.00 0.00 55.97 55.86 1dgj s LYS 752 Cb 0.06 -0.76 0.11 0.00 -0.52 0.00 0.00 37.83 36.72 1dgj s LYS 752 CO 0.10 0.17 1.17 -0.51 -0.92 0.00 0.00 175.35 175.36 1dgj s ASP 753 N -0.09 3.37 0.37 2.83 1.01 -1.26 -1.58 116.67 121.32 1dgj s ASP 753 Ca 0.02 2.25 -0.20 0.00 0.71 0.00 0.00 52.55 55.32 1dgj s ASP 753 Cb -0.05 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.20 1dgj s ASP 753 CO -0.00 -2.81 0.89 0.00 0.21 0.00 0.00 175.17 173.45 1dgj n ASP 755 N -0.28 0.49 0.30 0.00 5.68 -0.32 -4.85 116.55 117.57 1dgj n ASP 755 Ca 0.05 -1.49 0.15 0.00 -0.50 0.00 0.00 54.79 53.00 1dgj n ASP 755 Cb 0.53 -0.41 0.78 0.00 -1.14 0.00 0.00 41.12 40.87 1dgj n ASP 755 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1dgj h ALA 756 N -1.01 1.24 -0.25 2.12 0.00 -1.94 0.83 119.26 120.25 1dgj h ALA 756 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1dgj h ALA 756 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1dgj h ALA 756 CO 0.18 -0.24 -0.01 0.36 0.00 0.00 0.00 179.25 179.53 1dgj n LYS 757 N -2.73 2.47 -1.56 0.00 2.85 -1.26 -3.88 118.16 114.05 1dgj n LYS 757 Ca -0.02 -2.89 -0.10 0.00 -1.05 0.00 0.00 58.31 54.25 1dgj n LYS 757 Cb 0.30 -1.80 -0.03 0.00 -0.65 0.00 0.00 35.03 32.85 1dgj n LYS 757 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1dgj n GLY 758 N -0.77 0.80 3.79 2.58 0.00 0.29 -1.64 105.19 110.24 1dgj n GLY 758 Ca 0.24 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1dgj n GLY 758 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dgj s GLN 759 N -3.35 3.06 0.00 1.61 -1.52 -1.26 -4.45 119.66 113.74 1dgj s GLN 759 Ca 0.00 -0.53 0.00 0.00 -1.95 0.00 0.00 55.36 52.88 1dgj s GLN 759 Cb 0.00 -2.85 0.00 0.00 -0.22 0.00 0.00 33.01 29.94 1dgj s GLN 759 CO 0.00 0.63 0.00 0.41 -0.25 0.00 0.00 175.29 176.08 1dgj n GLY 760 N 0.94 -0.05 2.50 3.09 0.00 -0.50 -1.17 105.19 110.00 1dgj n GLY 760 Ca -0.11 -1.48 -0.27 0.00 0.00 0.00 0.00 46.02 44.16 1dgj n GLY 760 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dgj n SER 761 N 1.20 1.80 0.26 1.61 7.64 -1.10 -3.98 113.62 121.06 1dgj n SER 761 Ca 0.00 -2.97 0.11 0.00 1.01 0.00 0.00 58.87 57.02 1dgj n SER 761 Cb 0.00 -0.66 0.71 0.00 -1.01 0.00 0.00 64.21 63.25 1dgj n SER 761 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1dgj h PRO 762 N 4.80 0.00 -4.69 1.43 0.13 -1.60 1.02 132.00 133.08 1dgj h PRO 762 Ca 0.17 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.91 1dgj h PRO 762 Cb 0.79 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.63 1dgj h PRO 762 CO 0.62 0.09 -0.78 -0.06 -0.23 0.00 0.00 178.00 177.64 1dgj s PHE 763 N -4.51 0.78 0.11 1.56 0.08 -1.26 -1.00 117.98 113.74 1dgj s PHE 763 Ca -0.04 -0.15 0.08 0.00 0.12 0.00 0.00 56.93 56.94 1dgj s PHE 763 Cb 0.15 -0.51 -0.14 0.00 -0.57 0.00 0.00 43.02 41.95 1dgj s PHE 763 CO 0.61 -0.02 1.32 0.00 -0.10 0.00 0.00 175.22 177.03 1dgj h ALA 764 N 5.95 0.42 -3.38 5.36 0.00 -1.85 -3.47 119.26 122.29 1dgj h ALA 764 Ca -0.30 -0.84 -0.45 0.00 0.00 0.00 0.00 54.91 53.31 1dgj h ALA 764 Cb 1.18 -0.15 -0.21 0.00 0.00 0.00 0.00 17.79 18.61 1dgj h ALA 764 CO 0.50 1.16 -0.79 0.00 0.00 0.00 0.00 179.25 180.12 1dgj s TYR 766 N -1.40 2.00 -0.05 0.00 2.02 -1.26 -0.61 117.35 118.05 1dgj s TYR 766 Ca 0.02 -0.98 0.02 0.00 -0.37 0.00 0.00 57.07 55.75 1dgj s TYR 766 Cb -0.09 -1.38 0.02 0.00 -0.40 0.00 0.00 41.96 40.11 1dgj s TYR 766 CO 0.03 0.04 -0.08 -1.64 -1.57 0.00 0.00 175.55 172.33 1dgj s MET 767 N -3.82 1.13 0.01 -0.62 -1.94 0.28 -4.73 119.30 109.61 1dgj s MET 767 Ca 0.29 -0.23 0.07 0.00 -1.71 0.00 0.00 55.69 54.11 1dgj s MET 767 Cb 0.07 -1.02 -0.02 0.00 2.01 0.00 0.00 34.83 35.86 1dgj s MET 767 CO 0.14 -0.02 -0.22 0.71 -0.01 0.00 0.00 175.02 175.63 1dgj s TYR 768 N 0.72 1.93 -0.04 -0.03 2.02 -0.97 -2.17 117.35 118.81 1dgj s TYR 768 Ca -0.12 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.15 1dgj s TYR 768 Cb -0.14 -1.20 0.01 0.00 -0.40 0.00 0.00 41.96 40.23 1dgj s TYR 768 CO 0.01 0.03 0.14 0.20 -1.57 0.00 0.00 175.55 174.37 1dgj s GLY 769 N -0.85 -0.05 -0.22 0.71 0.00 -0.67 -1.23 107.32 105.01 1dgj s GLY 769 Ca 0.08 0.21 -0.01 0.00 0.00 0.00 0.00 44.72 45.01 1dgj s GLY 769 CO 0.01 0.13 -0.10 1.08 0.00 0.00 0.00 173.10 174.21 1dgj s LEU 770 N -0.46 2.79 -0.11 0.66 1.43 0.57 -1.89 118.68 121.67 1dgj s LEU 770 Ca -0.05 -0.70 -0.04 0.00 -1.03 0.00 0.00 54.13 52.30 1dgj s LEU 770 Cb -0.04 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 1dgj s LEU 770 CO 0.01 -0.06 0.04 -0.36 0.23 0.00 0.00 176.35 176.21 1dgj s PHE 771 N 1.34 3.28 -0.03 0.29 0.08 -0.04 -1.65 117.98 121.26 1dgj s PHE 771 Ca 0.03 0.24 0.02 0.00 0.12 0.00 0.00 56.93 57.33 1dgj s PHE 771 Cb -0.15 -1.88 0.01 0.00 -0.57 0.00 0.00 43.02 40.43 1dgj s PHE 771 CO -0.07 0.46 -0.06 -1.17 -0.10 0.00 0.00 175.22 174.29 1dgj s LEU 772 N -0.66 1.64 0.01 -0.37 2.96 -0.59 -1.91 118.68 119.75 1dgj s LEU 772 Ca 0.11 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 1dgj s LEU 772 Cb -0.12 -0.41 -0.01 0.00 0.50 0.00 0.00 46.19 46.15 1dgj s LEU 772 CO 0.02 0.01 -0.02 0.42 -1.32 0.00 0.00 176.35 175.46 1dgj s THR 773 N 0.43 0.08 -0.24 3.68 -4.23 -0.11 -1.53 115.64 113.72 1dgj s THR 773 Ca -0.06 -0.54 -0.03 0.00 -1.18 0.00 0.00 61.69 59.89 1dgj s THR 773 Cb -0.09 -0.17 0.01 0.00 1.34 0.00 0.00 72.50 73.59 1dgj s THR 773 CO 0.00 -0.29 -0.05 -1.61 -0.54 0.00 0.00 174.62 172.14 1dgj s GLU 774 N -0.85 3.13 0.02 3.99 2.02 -0.60 -0.99 118.70 125.41 1dgj s GLU 774 Ca -0.09 -0.79 0.08 0.00 0.02 0.00 0.00 54.97 54.18 1dgj s GLU 774 Cb -0.06 -3.01 -0.03 0.00 0.10 0.00 0.00 34.13 31.13 1dgj s GLU 774 CO -0.01 -0.30 -0.22 0.14 0.02 0.00 0.00 175.26 174.89 1dgj s VAL 775 N 1.41 2.45 -0.17 2.63 -7.23 -0.36 0.94 120.40 120.08 1dgj s VAL 775 Ca 0.03 -1.17 -0.03 0.00 -1.81 0.00 0.00 61.98 59.00 1dgj s VAL 775 Cb -0.15 -1.96 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 1dgj s VAL 775 CO -0.04 0.44 -0.05 0.00 -0.31 0.00 0.00 175.10 175.14 1dgj s ALA 776 N -0.79 2.91 -0.18 1.32 0.00 -0.28 -0.59 121.76 124.15 1dgj s ALA 776 Ca 0.12 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.14 1dgj s ALA 776 Cb -0.10 -1.56 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 1dgj s ALA 776 CO 0.02 0.04 -0.10 0.08 0.00 0.00 0.00 175.76 175.80 1dgj s VAL 777 N 0.67 3.04 -1.01 0.00 1.01 0.15 -1.28 120.40 122.99 1dgj s VAL 777 Ca -0.03 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.11 1dgj s VAL 777 Cb -0.15 -2.34 0.06 0.00 0.00 0.00 0.00 36.38 33.96 1dgj s VAL 777 CO 0.02 0.48 1.40 -0.70 0.00 0.00 0.00 175.10 176.30 1dgj s GLU 778 N 1.07 3.59 0.38 2.72 2.12 -0.76 -1.55 118.70 126.27 1dgj s GLU 778 Ca 0.00 -1.21 0.23 0.00 0.36 0.00 0.00 54.97 54.35 1dgj s GLU 778 Cb -0.15 -5.29 1.35 0.00 0.26 0.00 0.00 34.13 30.30 1dgj s GLU 778 CO -0.02 -2.15 1.54 0.28 -0.54 0.00 0.00 175.26 174.37 1dgj n VAL 779 N 6.68 -0.37 -0.19 3.70 0.31 -1.01 -0.01 118.33 127.43 1dgj n VAL 779 Ca 0.32 1.93 -0.09 0.00 -0.01 0.00 0.00 64.34 66.49 1dgj n VAL 779 Cb 0.51 -3.14 0.02 0.00 -0.91 0.00 0.00 33.84 30.31 1dgj n VAL 779 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dgj h ALA 780 N 1.86 0.73 0.00 3.52 0.00 -1.90 -3.38 119.26 120.10 1dgj h ALA 780 Ca 0.84 -0.25 -0.28 0.00 0.00 0.00 0.00 54.91 55.21 1dgj h ALA 780 Cb 2.33 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.86 1dgj h ALA 780 CO -0.68 0.48 -2.07 0.25 0.00 0.00 0.00 179.25 177.23 1dgj n THR 781 N -4.35 1.08 0.00 0.00 -2.24 0.01 -5.02 114.28 103.77 1dgj n THR 781 Ca 0.02 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1dgj n THR 781 Cb 0.27 -1.07 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 1dgj n THR 781 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dgj n GLY 782 N 2.50 0.93 3.64 3.38 0.00 0.99 -4.40 105.19 112.22 1dgj n GLY 782 Ca -0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 1dgj n GLY 782 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgj s LYS 783 N -0.76 3.97 0.08 1.61 1.02 -1.25 -4.15 119.74 120.26 1dgj s LYS 783 Ca 0.00 1.32 -0.06 0.00 0.02 0.00 0.00 55.97 57.25 1dgj s LYS 783 Cb 0.00 -3.86 -0.05 0.00 -0.52 0.00 0.00 37.83 33.40 1dgj s LYS 783 CO 0.00 -1.05 0.33 0.00 -0.92 0.00 0.00 175.35 173.71 1dgj s ALA 784 N 4.22 3.82 -0.13 5.17 0.00 -1.26 -1.82 121.76 131.76 1dgj s ALA 784 Ca 0.56 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 1dgj s ALA 784 Cb -0.17 -2.10 0.06 0.00 0.00 0.00 0.00 23.12 20.90 1dgj s ALA 784 CO 0.21 0.66 0.13 0.99 0.00 0.00 0.00 175.76 177.76 1dgj s THR 785 N -1.49 -0.19 -0.25 0.00 2.01 -0.40 -4.96 115.64 110.36 1dgj s THR 785 Ca 0.35 0.09 -0.29 0.00 0.31 0.00 0.00 61.69 62.15 1dgj s THR 785 Cb -0.13 -0.45 -0.02 0.00 0.01 0.00 0.00 72.50 71.91 1dgj s THR 785 CO 0.21 -0.07 1.63 -0.69 -0.69 0.00 0.00 174.62 175.01 1dgj s VAL 786 N 2.23 3.68 -0.17 3.82 1.01 -1.26 -1.13 120.40 128.57 1dgj s VAL 786 Ca 0.04 0.75 0.22 0.00 0.00 0.00 0.00 61.98 62.99 1dgj s VAL 786 Cb -0.14 -3.74 -0.15 0.00 0.00 0.00 0.00 36.38 32.35 1dgj s VAL 786 CO -0.08 -0.34 0.81 -0.62 0.00 0.00 0.00 175.10 174.87 1dgj n GLU 787 N 7.81 0.61 -3.57 2.72 1.02 0.27 -3.89 120.64 125.60 1dgj n GLU 787 Ca 0.19 -0.02 -0.16 0.00 -0.02 0.00 0.00 57.16 57.15 1dgj n GLU 787 Cb 0.46 -1.69 -0.07 0.00 -0.02 0.00 0.00 31.44 30.12 1dgj n GLU 787 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1dgj s LYS 788 N -3.42 0.96 -0.03 3.49 2.20 -1.12 -4.51 119.74 117.32 1dgj s LYS 788 Ca -0.03 0.53 -0.00 0.00 -0.36 0.00 0.00 55.97 56.10 1dgj s LYS 788 Cb 0.12 0.46 0.03 0.00 -1.51 0.00 0.00 37.83 36.92 1dgj s LYS 788 CO 0.84 -0.24 0.05 -1.64 -0.36 0.00 0.00 175.35 174.00 1dgj s MET 789 N -0.58 -0.03 -0.07 4.03 -1.94 -0.55 -1.56 119.30 118.60 1dgj s MET 789 Ca -0.07 0.23 0.04 0.00 -1.71 0.00 0.00 55.69 54.18 1dgj s MET 789 Cb -0.02 -0.26 0.00 0.00 2.01 0.00 0.00 34.83 36.56 1dgj s MET 789 CO 0.06 -0.18 -0.18 0.08 -0.01 0.00 0.00 175.02 174.79 1dgj s VAL 790 N 1.19 1.55 -0.18 -6.03 1.01 -0.58 -0.23 120.40 117.12 1dgj s VAL 790 Ca -0.08 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1dgj s VAL 790 Cb -0.13 -1.35 0.05 0.00 0.00 0.00 0.00 36.38 34.95 1dgj s VAL 790 CO -0.03 0.45 0.02 0.00 0.00 0.00 0.00 175.10 175.53 1dgj s VAL 792 N 1.84 5.10 0.05 0.00 1.01 -0.66 -1.88 120.40 125.87 1dgj s VAL 792 Ca -0.00 1.15 0.03 0.00 0.00 0.00 0.00 61.98 63.16 1dgj s VAL 792 Cb -0.16 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1dgj s VAL 792 CO -0.07 0.24 -0.09 0.00 0.00 0.00 0.00 175.10 175.17 1dgj s ALA 793 N 1.09 0.74 -0.28 5.51 0.00 0.12 -0.32 121.76 128.61 1dgj s ALA 793 Ca 0.30 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1dgj s ALA 793 Cb -0.16 0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.06 1dgj s ALA 793 CO 0.12 0.02 0.04 0.34 0.00 0.00 0.00 175.76 176.29 1dgj s ASP 794 N -1.67 3.98 -0.10 0.00 3.68 -0.37 -0.38 116.67 121.81 1dgj s ASP 794 Ca -0.07 -1.51 0.14 0.00 2.13 0.00 0.00 52.55 53.23 1dgj s ASP 794 Cb -0.10 -1.04 0.26 0.00 -1.45 0.00 0.00 42.92 40.60 1dgj s ASP 794 CO 0.01 -0.35 1.13 2.30 0.13 0.00 0.00 175.17 178.39 1dgj n ILE 795 N 4.73 1.25 -4.14 4.11 -5.35 -1.26 -2.30 119.36 116.39 1dgj n ILE 795 Ca -0.04 -1.76 0.00 0.00 -0.27 0.00 0.00 62.75 60.68 1dgj n ILE 795 Cb 0.43 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 1dgj n ILE 795 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dgj n GLY 796 N -0.77 -0.55 3.78 3.28 0.00 -1.24 -1.52 105.19 108.18 1dgj n GLY 796 Ca 0.11 -1.12 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 1dgj n GLY 796 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgj s LYS 797 N 0.00 4.26 -0.09 1.61 -0.14 -0.26 -4.50 119.74 120.62 1dgj s LYS 797 Ca 0.00 1.51 -0.22 0.00 -1.36 0.00 0.00 55.97 55.90 1dgj s LYS 797 Cb 0.00 -2.62 -0.04 0.00 -1.68 0.00 0.00 37.83 33.49 1dgj s LYS 797 CO 0.00 -0.05 0.64 0.42 -0.76 0.00 0.00 175.35 175.59 1dgj s ILE 798 N -1.62 5.08 -0.08 2.17 1.01 -1.26 -4.35 121.20 122.15 1dgj s ILE 798 Ca 0.56 1.30 -0.19 0.00 0.00 0.00 0.00 60.65 62.31 1dgj s ILE 798 Cb -0.22 -3.97 -0.29 0.00 0.01 0.00 0.00 42.46 37.99 1dgj s ILE 798 CO 0.28 0.26 0.71 0.00 0.00 0.00 0.00 174.94 176.19 1dgj s ASN 800 N -6.99 0.89 0.14 0.00 3.84 -1.26 -0.90 114.94 110.66 1dgj s ASN 800 Ca -0.17 0.23 -0.16 0.00 0.21 0.00 0.00 52.86 52.97 1dgj s ASN 800 Cb 0.03 0.27 -0.00 0.00 -0.55 0.00 0.00 41.25 41.00 1dgj s ASN 800 CO 0.79 -0.26 1.69 0.50 -2.79 0.00 0.00 177.10 177.03 1dgj h LYS 801 N 8.36 0.59 -0.65 0.43 1.63 -1.56 -1.68 116.57 123.69 1dgj h LYS 801 Ca -0.14 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.55 1dgj h LYS 801 Cb 1.12 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.62 1dgj h LYS 801 CO 0.16 0.55 0.36 -0.07 -3.45 0.00 0.00 179.45 177.00 1dgj h LEU 802 N 0.51 0.80 0.43 5.20 3.38 -1.87 0.39 115.31 124.15 1dgj h LEU 802 Ca 0.14 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1dgj h LEU 802 Cb 0.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1dgj h LEU 802 CO -0.01 0.64 -0.21 0.58 0.09 0.00 0.00 178.44 179.53 1dgj h VAL 803 N 0.91 0.45 -0.92 1.22 2.07 -1.86 -1.92 116.25 116.19 1dgj h VAL 803 Ca 0.23 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1dgj h VAL 803 Cb 0.01 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 1dgj h VAL 803 CO -0.04 0.07 0.53 -0.37 0.02 0.00 0.00 177.57 177.78 1dgj h VAL 804 N -0.92 1.26 0.11 2.57 -1.51 -1.19 0.15 116.25 116.72 1dgj h VAL 804 Ca -0.06 -0.61 -0.01 0.00 -1.23 0.00 0.00 66.70 64.79 1dgj h VAL 804 Cb 0.57 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.71 1dgj h VAL 804 CO 0.10 0.28 -0.05 0.44 -1.23 0.00 0.00 177.57 177.11 1dgj h ASP 805 N 1.29 -0.13 0.23 4.19 3.32 -0.97 -1.85 116.42 122.50 1dgj h ASP 805 Ca 0.33 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 1dgj h ASP 805 Cb -0.01 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1dgj h ASP 805 CO -0.06 -0.07 -0.07 1.23 -1.72 0.00 0.00 179.24 178.56 1dgj h GLY 806 N -0.17 0.00 1.47 2.75 0.00 -0.96 -1.56 103.07 104.60 1dgj h GLY 806 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.06 1dgj h GLY 806 CO 0.03 0.00 -1.06 1.46 0.00 0.00 0.00 176.54 176.97 1dgj h GLN 807 N 0.00 0.45 -0.12 4.80 1.08 -0.40 -2.53 115.11 118.39 1dgj h GLN 807 Ca -0.00 -0.55 -0.17 0.00 -1.45 0.00 0.00 58.65 56.49 1dgj h GLN 807 Cb 0.20 0.17 0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1dgj h GLN 807 CO 0.01 1.20 -0.58 0.82 -0.95 0.00 0.00 178.83 179.32 1dgj h ILE 808 N 0.23 1.34 0.26 2.54 2.04 -0.86 -0.05 117.51 123.00 1dgj h ILE 808 Ca -0.11 -1.87 -0.01 0.00 1.00 0.00 0.00 64.86 63.86 1dgj h ILE 808 Cb 1.72 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 1dgj h ILE 808 CO 0.19 0.57 -0.13 1.88 0.00 0.00 0.00 178.15 180.66 1dgj h TYR 809 N 0.24 -0.33 -0.73 1.37 0.05 -1.40 -0.49 116.97 115.68 1dgj h TYR 809 Ca -0.04 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.78 1dgj h TYR 809 Cb 1.22 0.11 -0.05 0.00 1.01 0.00 0.00 36.73 39.02 1dgj h TYR 809 CO 0.11 -0.20 0.44 0.78 -1.05 0.00 0.00 178.16 178.24 1dgj h GLY 810 N -0.36 1.07 0.92 3.88 0.00 -1.36 -1.98 103.07 105.24 1dgj h GLY 810 Ca -0.04 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1dgj h GLY 810 CO 0.06 0.24 0.13 -1.33 0.00 0.00 0.00 176.54 175.64 1dgj h GLY 811 N 0.84 0.46 1.19 4.60 0.00 -0.69 -2.61 103.07 106.85 1dgj h GLY 811 Ca 0.31 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1dgj h GLY 811 CO -0.15 0.23 0.52 1.41 0.00 0.00 0.00 176.54 178.55 1dgj h LEU 812 N 0.33 0.94 -0.35 3.11 3.38 -0.79 -1.65 115.31 120.28 1dgj h LEU 812 Ca 0.10 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1dgj h LEU 812 Cb 0.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1dgj h LEU 812 CO -0.01 0.70 0.21 0.00 0.09 0.00 0.00 178.44 179.43 1dgj h ALA 813 N 1.47 0.44 0.00 1.53 0.00 -1.10 -1.08 119.26 120.53 1dgj h ALA 813 Ca 0.29 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1dgj h ALA 813 Cb -0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1dgj h ALA 813 CO -0.06 -0.06 -0.24 1.96 0.00 0.00 0.00 179.25 180.85 1dgj h GLN 814 N 0.45 0.00 -0.69 0.00 4.20 -1.24 -2.10 115.11 115.73 1dgj h GLN 814 Ca 0.12 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1dgj h GLN 814 Cb 0.01 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1dgj h GLN 814 CO -0.02 0.24 0.40 0.78 -0.67 0.00 0.00 178.83 179.56 1dgj h GLY 815 N 0.90 1.00 0.78 3.46 0.00 -0.24 -0.40 103.07 108.57 1dgj h GLY 815 Ca -0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 1dgj h GLY 815 CO 0.03 0.41 -0.11 -2.08 0.00 0.00 0.00 176.54 174.79 1dgj h VAL 816 N 0.95 1.32 -0.34 4.60 2.07 -0.81 -2.27 116.25 121.77 1dgj h VAL 816 Ca 0.25 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1dgj h VAL 816 Cb -0.02 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1dgj h VAL 816 CO -0.04 0.35 0.06 1.23 0.02 0.00 0.00 177.57 179.19 1dgj h GLY 817 N 0.05 0.54 1.10 2.17 0.00 -1.24 0.14 103.07 105.84 1dgj h GLY 817 Ca 0.04 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 1dgj h GLY 817 CO 0.03 0.27 -0.03 -2.00 0.00 0.00 0.00 176.54 174.81 1dgj h LEU 818 N 0.49 1.05 0.07 3.11 5.85 -0.98 0.40 115.31 125.31 1dgj h LEU 818 Ca 0.11 -0.32 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 1dgj h LEU 818 Cb 0.24 -0.28 0.01 0.00 0.37 0.00 0.00 40.66 40.99 1dgj h LEU 818 CO 0.00 1.12 -0.45 0.00 -0.34 0.00 0.00 178.44 178.76 1dgj h ALA 819 N 0.98 -0.04 0.00 1.25 0.00 -1.00 -3.42 119.26 117.03 1dgj h ALA 819 Ca 0.16 -0.60 -0.35 0.00 0.00 0.00 0.00 54.91 54.12 1dgj h ALA 819 Cb 0.60 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 1dgj h ALA 819 CO 0.04 0.21 -2.22 1.28 0.00 0.00 0.00 179.25 178.56 1dgj n LEU 820 N -4.34 0.26 0.00 0.00 4.77 0.46 0.24 117.00 118.39 1dgj n LEU 820 Ca -0.12 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1dgj n LEU 820 Cb 0.66 0.40 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 1dgj n LEU 820 CO 0.42 0.48 -0.10 -1.54 -1.33 0.00 0.00 177.39 175.32 1dgj n SER 821 N -2.83 0.98 -4.81 -1.43 3.41 -0.35 -4.08 113.62 104.51 1dgj n SER 821 Ca -0.29 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 57.99 1dgj n SER 821 Cb 1.13 0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 65.15 1dgj n SER 821 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1dgj s GLU 822 N -1.10 3.90 0.00 4.33 2.02 0.13 -4.39 118.70 123.59 1dgj s GLU 822 Ca 0.00 1.19 0.00 0.00 0.02 0.00 0.00 54.97 56.18 1dgj s GLU 822 Cb 0.00 -2.12 0.00 0.00 0.10 0.00 0.00 34.13 32.11 1dgj s GLU 822 CO 0.00 -0.32 0.00 -3.47 0.02 0.00 0.00 175.26 171.49 1dgj n ASP 823 N -1.11 0.00 -3.62 -0.19 2.03 -1.13 -4.56 116.55 107.97 1dgj n ASP 823 Ca 0.08 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.11 1dgj n ASP 823 Cb 0.53 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.82 1dgj n ASP 823 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1dgj s TYR 824 N -2.00 2.07 0.08 -0.67 5.04 -0.68 -4.68 117.35 116.51 1dgj s TYR 824 Ca 0.00 -2.65 -0.00 0.00 -2.44 0.00 0.00 57.07 51.97 1dgj s TYR 824 Cb 0.00 -1.69 -0.00 0.00 0.35 0.00 0.00 41.96 40.62 1dgj s TYR 824 CO 0.00 -0.73 -0.00 -1.91 -1.34 0.00 0.00 175.55 171.57 1dgj n GLU 825 N 2.74 0.01 -2.78 4.97 4.07 -1.26 -4.71 120.64 123.68 1dgj n GLU 825 Ca 0.22 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.89 1dgj n GLU 825 Cb 0.41 -0.51 -0.03 0.00 -0.06 0.00 0.00 31.44 31.24 1dgj n GLU 825 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1dgj s ASP 826 N -5.89 6.69 0.51 4.31 -1.08 -1.26 -4.93 116.67 115.02 1dgj s ASP 826 Ca -0.00 0.60 0.20 0.00 -0.52 0.00 0.00 52.55 52.83 1dgj s ASP 826 Cb 0.00 -2.48 1.28 0.00 -1.46 0.00 0.00 42.92 40.26 1dgj s ASP 826 CO 0.01 -0.90 2.03 -0.07 0.52 0.00 0.00 175.17 176.76 1dgj h LEU 827 N 10.18 0.09 0.02 -1.34 3.38 -1.94 0.13 115.31 125.83 1dgj h LEU 827 Ca -0.23 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.41 1dgj h LEU 827 Cb 1.07 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1dgj h LEU 827 CO 1.00 0.05 -1.85 0.29 0.09 0.00 0.00 178.44 178.02 1dgj n LYS 828 N -4.44 0.61 0.16 1.13 5.02 -1.26 -4.10 118.16 115.28 1dgj n LYS 828 Ca 0.07 0.40 0.04 0.00 -2.02 0.00 0.00 58.31 56.80 1dgj n LYS 828 Cb 0.43 -1.65 0.47 0.00 -0.02 0.00 0.00 35.03 34.26 1dgj n LYS 828 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1dgj h LYS 829 N -0.73 0.16 -0.77 1.97 1.57 -1.95 -3.11 116.57 113.72 1dgj h LYS 829 Ca -0.48 -0.03 -0.39 0.00 -1.87 0.00 0.00 60.65 57.88 1dgj h LYS 829 Cb 1.57 -0.03 -0.23 0.00 0.08 0.00 0.00 32.23 33.62 1dgj h LYS 829 CO -0.21 0.25 0.39 0.72 -0.57 0.00 0.00 179.45 180.02 1dgj n HIS 830 N -4.36 2.37 0.34 -1.35 8.25 0.02 -4.19 115.22 116.30 1dgj n HIS 830 Ca -0.01 -1.73 0.12 0.00 -0.26 0.00 0.00 57.72 55.83 1dgj n HIS 830 Cb 0.20 -0.78 0.22 0.00 1.12 0.00 0.00 29.99 30.75 1dgj n HIS 830 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1dgj n SER 831 N -1.09 3.45 -4.16 0.41 3.41 -1.17 -4.54 113.62 109.93 1dgj n SER 831 Ca 0.50 -1.99 -0.18 0.00 -0.26 0.00 0.00 58.87 56.94 1dgj n SER 831 Cb 1.45 -0.25 -0.12 0.00 -0.26 0.00 0.00 64.21 65.03 1dgj n SER 831 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1dgj s THR 832 N -1.51 1.03 0.14 6.66 -4.23 -1.26 -4.15 115.64 112.33 1dgj s THR 832 Ca 0.39 -1.28 -0.31 0.00 -1.18 0.00 0.00 61.69 59.30 1dgj s THR 832 Cb 0.23 -1.02 -0.08 0.00 1.34 0.00 0.00 72.50 72.98 1dgj s THR 832 CO 0.32 -0.25 1.55 -0.03 -0.54 0.00 0.00 174.62 175.67 1dgj h MET 833 N 4.30 -0.29 -0.30 3.99 1.85 -1.91 -0.70 114.93 121.88 1dgj h MET 833 Ca -0.40 0.02 -0.06 0.00 -0.61 0.00 0.00 59.70 58.65 1dgj h MET 833 Cb 1.19 0.07 -0.02 0.00 0.43 0.00 0.00 31.60 33.27 1dgj h MET 833 CO 0.40 -0.19 -0.06 0.78 -0.40 0.00 0.00 176.91 177.44 1dgj h GLY 834 N -0.30 0.52 0.99 1.39 0.00 -1.95 -2.90 103.07 100.82 1dgj h GLY 834 Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1dgj h GLY 834 CO -0.67 0.30 0.24 -1.33 0.00 0.00 0.00 176.54 175.08 1dgj h GLY 835 N 0.85 0.55 1.75 4.60 0.00 -1.40 -1.47 103.07 107.95 1dgj h GLY 835 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1dgj h GLY 835 CO 0.02 0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.77 1dgj n ALA 836 N -2.22 1.76 -2.21 3.60 0.00 -0.53 -4.68 120.51 116.24 1dgj n ALA 836 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1dgj n ALA 836 Cb 0.04 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1dgj n ALA 836 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dgj n GLY 837 N -0.03 0.75 3.76 0.00 0.00 -0.55 -2.84 105.19 106.28 1dgj n GLY 837 Ca 0.06 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1dgj n GLY 837 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1dgj s ILE 838 N -2.95 2.77 0.09 -0.61 2.07 -1.22 -3.87 121.20 117.49 1dgj s ILE 838 Ca 0.00 0.75 -0.31 0.00 -1.41 0.00 0.00 60.65 59.68 1dgj s ILE 838 Cb 0.00 -3.48 -0.07 0.00 0.13 0.00 0.00 42.46 39.04 1dgj s ILE 838 CO 0.00 0.17 1.38 -2.84 -1.91 0.00 0.00 174.94 171.74 1dgj s PRO 839 N -1.51 4.32 0.47 3.50 0.02 -1.26 -4.96 135.00 135.58 1dgj s PRO 839 Ca 0.50 2.04 -0.02 0.00 0.02 0.00 0.00 61.00 63.55 1dgj s PRO 839 Cb -0.39 -3.31 -0.01 0.00 0.02 0.00 0.00 34.50 30.81 1dgj s PRO 839 CO 0.50 -0.45 0.72 -1.54 -0.33 0.00 0.00 177.00 175.90 1dgj s SER 840 N 1.24 5.90 0.26 2.53 1.04 -1.26 -4.77 113.70 118.64 1dgj s SER 840 Ca 0.64 0.48 -0.09 0.00 0.48 0.00 0.00 55.95 57.46 1dgj s SER 840 Cb -0.36 -1.73 0.42 0.00 0.10 0.00 0.00 66.02 64.45 1dgj s SER 840 CO 0.30 -0.70 1.59 -0.29 0.98 0.00 0.00 173.24 175.11 1dgj h ILE 841 N 0.31 0.13 0.00 -1.02 2.10 -1.92 0.66 117.51 117.77 1dgj h ILE 841 Ca -0.47 -0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.47 1dgj h ILE 841 Cb 1.24 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.10 1dgj h ILE 841 CO 0.59 0.00 0.00 0.11 -1.08 0.00 0.00 178.15 177.77 1dgj h LYS 842 N 0.01 0.00 0.00 2.19 1.79 -1.94 -1.15 116.57 117.47 1dgj h LYS 842 Ca 0.43 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 1dgj h LYS 842 Cb 0.69 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1dgj h LYS 842 CO -0.88 0.00 0.00 0.52 -1.08 0.00 0.00 179.45 178.01 1dgj h MET 843 N 0.00 0.00 -5.36 3.15 2.86 -1.23 -3.44 114.93 110.91 1dgj h MET 843 Ca 0.00 0.00 -0.62 0.00 -2.06 0.00 0.00 59.70 57.02 1dgj h MET 843 Cb 0.07 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 31.59 1dgj h MET 843 CO 0.00 0.00 -0.54 0.42 1.06 0.00 0.00 176.91 177.85 1dgj s ILE 844 N -3.26 4.98 0.27 -1.22 -1.09 -0.43 -4.61 121.20 115.83 1dgj s ILE 844 Ca 0.06 0.03 -0.29 0.00 -2.23 0.00 0.00 60.65 58.22 1dgj s ILE 844 Cb 0.06 -3.24 -0.10 0.00 -1.58 0.00 0.00 42.46 37.61 1dgj s ILE 844 CO 0.65 0.48 1.31 -2.84 -1.23 0.00 0.00 174.94 173.30 1dgj s PRO 845 N 0.14 4.38 0.49 2.79 0.02 -1.25 -4.87 135.00 136.70 1dgj s PRO 845 Ca 0.06 2.14 0.28 0.00 0.02 0.00 0.00 61.00 63.51 1dgj s PRO 845 Cb -0.12 -3.13 1.04 0.00 0.02 0.00 0.00 34.50 32.31 1dgj s PRO 845 CO 0.00 -0.20 1.86 0.22 -0.33 0.00 0.00 177.00 178.55 1dgj h ASP 846 N 4.27 0.00 -2.53 2.53 -0.00 -1.92 -3.37 116.42 115.40 1dgj h ASP 846 Ca -0.47 0.00 -0.72 0.00 -0.00 0.00 0.00 57.03 55.84 1dgj h ASP 846 Cb 1.22 0.00 -0.19 0.00 -0.00 0.00 0.00 39.33 40.36 1dgj h ASP 846 CO 0.71 0.09 0.89 -0.62 -0.00 0.00 0.00 179.24 180.31 1dgj s ASP 847 N -5.95 6.80 -0.02 2.28 -1.08 -1.26 -4.96 116.67 112.48 1dgj s ASP 847 Ca 0.02 -2.46 0.04 0.00 -0.52 0.00 0.00 52.55 49.64 1dgj s ASP 847 Cb 0.09 -2.37 -0.01 0.00 -1.46 0.00 0.00 42.92 39.17 1dgj s ASP 847 CO 0.60 -0.89 -0.15 -0.63 0.52 0.00 0.00 175.17 174.62 1dgj s ILE 848 N 1.93 1.22 0.01 4.11 1.01 -1.26 -1.48 121.20 126.74 1dgj s ILE 848 Ca 0.34 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1dgj s ILE 848 Cb -0.05 -1.03 -0.01 0.00 0.01 0.00 0.00 42.46 41.38 1dgj s ILE 848 CO -0.07 0.35 -0.02 -0.70 0.00 0.00 0.00 174.94 174.50 1dgj s GLU 849 N -0.21 0.18 -0.02 2.79 2.12 0.67 -4.98 118.70 119.26 1dgj s GLU 849 Ca 0.03 -0.31 0.06 0.00 0.36 0.00 0.00 54.97 55.11 1dgj s GLU 849 Cb -0.08 0.00 -0.01 0.00 0.26 0.00 0.00 34.13 34.30 1dgj s GLU 849 CO 0.00 -0.01 -0.19 0.42 -0.54 0.00 0.00 175.26 174.94 1dgj s ILE 850 N -0.69 1.54 -0.11 -3.70 1.01 -1.26 -0.94 121.20 117.04 1dgj s ILE 850 Ca -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.75 1dgj s ILE 850 Cb -0.05 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.16 1dgj s ILE 850 CO -0.00 0.44 -0.10 -0.69 0.00 0.00 0.00 174.94 174.58 1dgj s VAL 851 N -0.42 1.20 -0.20 2.92 1.01 -0.78 -4.98 120.40 119.16 1dgj s VAL 851 Ca 0.06 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 1dgj s VAL 851 Cb -0.08 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 1dgj s VAL 851 CO -0.00 0.39 0.13 -0.31 0.00 0.00 0.00 175.10 175.31 1dgj s TYR 852 N 1.42 3.42 -0.55 5.22 1.51 -1.26 -0.71 117.35 126.39 1dgj s TYR 852 Ca 0.01 0.34 -0.06 0.00 -1.01 0.00 0.00 57.07 56.35 1dgj s TYR 852 Cb -0.13 -2.15 0.14 0.00 -0.11 0.00 0.00 41.96 39.71 1dgj s TYR 852 CO -0.06 0.31 0.39 0.08 -1.11 0.00 0.00 175.55 175.16 1dgj s VAL 853 N 0.30 3.92 -1.37 0.71 1.01 0.49 -4.95 120.40 120.50 1dgj s VAL 853 Ca 0.08 -2.40 -0.12 0.00 0.00 0.00 0.00 61.98 59.54 1dgj s VAL 853 Cb -0.11 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1dgj s VAL 853 CO -0.02 -0.82 2.49 -0.62 0.00 0.00 0.00 175.10 176.13 1dgj n GLU 854 N 4.16 2.95 -2.67 2.72 1.02 -1.26 -4.33 120.64 123.23 1dgj n GLU 854 Ca 0.02 -2.17 -0.42 0.00 -0.02 0.00 0.00 57.16 54.56 1dgj n GLU 854 Cb 0.40 -2.91 -0.03 0.00 -0.02 0.00 0.00 31.44 28.88 1dgj n GLU 854 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1dgj s THR 855 N 2.99 4.75 0.48 2.62 2.01 -1.26 -4.74 115.64 122.49 1dgj s THR 855 Ca 0.57 2.01 -0.20 0.00 0.31 0.00 0.00 61.69 64.37 1dgj s THR 855 Cb 0.15 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 1dgj s THR 855 CO -0.05 0.03 1.02 -2.16 -0.69 0.00 0.00 174.62 172.78 1dgj s PRO 856 N 1.82 3.86 -0.22 4.92 0.04 -1.26 -3.63 135.00 140.53 1dgj s PRO 856 Ca 0.50 1.27 -0.10 0.00 0.04 0.00 0.00 61.00 62.71 1dgj s PRO 856 Cb -0.19 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 1dgj s PRO 856 CO 0.20 -0.37 0.15 1.03 0.04 0.00 0.00 177.00 178.05 1dgj s ARG 857 N -3.34 4.13 0.26 4.56 1.81 -0.88 -4.97 118.95 120.52 1dgj s ARG 857 Ca 0.65 -0.24 -0.03 0.00 -1.72 0.00 0.00 55.73 54.39 1dgj s ARG 857 Cb -0.14 -3.48 0.41 0.00 -0.45 0.00 0.00 34.95 31.28 1dgj s ARG 857 CO 0.20 0.17 1.85 0.87 -0.68 0.00 0.00 175.30 177.72 1dgj h LYS 858 N 7.12 0.98 -0.27 3.54 1.57 -1.91 -2.59 116.57 125.01 1dgj h LYS 858 Ca -0.39 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1dgj h LYS 858 Cb 1.16 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1dgj h LYS 858 CO 0.70 0.65 0.00 -0.25 -0.57 0.00 0.00 179.45 179.98 1dgj n ASP 859 N -4.61 2.53 -4.90 0.86 8.00 -1.26 -4.89 116.55 112.27 1dgj n ASP 859 Ca 0.15 -1.86 -0.31 0.00 0.71 0.00 0.00 54.79 53.48 1dgj n ASP 859 Cb 0.23 -0.17 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 1dgj n ASP 859 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1dgj s GLY 860 N -1.53 2.15 -0.20 0.44 0.00 -0.97 -4.97 107.32 102.24 1dgj s GLY 860 Ca 0.35 -0.61 -0.29 0.00 0.00 0.00 0.00 44.72 44.17 1dgj s GLY 860 CO 0.29 -0.53 1.86 2.56 0.00 0.00 0.00 173.10 177.27 1dgj s PRO 861 N -2.80 3.60 -1.37 2.90 0.04 -1.26 -1.54 135.00 134.57 1dgj s PRO 861 Ca 0.41 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 63.31 1dgj s PRO 861 Cb -0.12 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1dgj s PRO 861 CO 0.26 -1.55 0.12 1.19 0.04 0.00 0.00 177.00 177.05 1dgj n PHE 862 N 9.47 -0.97 -1.96 0.56 3.01 -1.26 -2.59 117.46 123.72 1dgj n PHE 862 Ca 0.23 0.10 -0.10 0.00 1.01 0.00 0.00 57.45 58.69 1dgj n PHE 862 Cb 0.45 -3.46 -0.01 0.00 -0.01 0.00 0.00 39.48 36.45 1dgj n PHE 862 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dgj n GLY 863 N -1.10 0.25 3.95 1.37 0.00 -0.59 -4.68 105.19 104.39 1dgj n GLY 863 Ca -0.17 -0.50 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 1dgj n GLY 863 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj s ALA 864 N -2.46 3.95 0.43 4.61 0.00 -1.07 -1.10 121.76 126.12 1dgj s ALA 864 Ca 0.00 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 50.89 1dgj s ALA 864 Cb 0.00 -1.75 -0.01 0.00 0.00 0.00 0.00 23.12 21.36 1dgj s ALA 864 CO 0.00 0.45 0.10 0.45 0.00 0.00 0.00 175.76 176.76 1dgj n SER 865 N -0.79 1.89 -3.93 0.00 2.88 -0.57 -4.00 113.62 109.10 1dgj n SER 865 Ca -0.08 -3.15 -0.30 0.00 -1.33 0.00 0.00 58.87 54.01 1dgj n SER 865 Cb 0.55 0.81 0.21 0.00 -0.75 0.00 0.00 64.21 65.03 1dgj n SER 865 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1dgj s GLY 866 N -3.55 1.77 0.00 0.46 0.00 -1.26 -4.78 107.32 99.96 1dgj s GLY 866 Ca 0.14 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1dgj s GLY 866 CO 0.10 -0.40 0.00 1.55 0.00 0.00 0.00 173.10 174.35 1dgj n VAL 867 N -4.06 0.00 -0.16 1.40 3.14 -1.26 -4.74 118.33 112.65 1dgj n VAL 867 Ca 0.16 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.50 1dgj n VAL 867 Cb 0.59 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.33 1dgj n VAL 867 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1dgj n GLY 868 N 0.03 -1.29 0.99 7.55 0.00 -1.26 -1.23 105.19 109.97 1dgj n GLY 868 Ca 0.00 0.51 0.12 0.00 0.00 0.00 0.00 46.02 46.65 1dgj n GLY 868 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dgj n GLU 869 N -4.17 2.32 -0.17 1.61 1.02 -1.26 -4.49 120.64 115.50 1dgj n GLU 869 Ca 0.01 -1.96 -0.10 0.00 -0.02 0.00 0.00 57.16 55.08 1dgj n GLU 869 Cb 0.10 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1dgj n GLU 869 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 1dgj h MET 870 N 4.27 0.90 0.00 3.49 4.05 -1.55 -3.10 114.93 122.99 1dgj h MET 870 Ca 0.00 -0.31 0.00 0.00 -0.28 0.00 0.00 59.70 59.11 1dgj h MET 870 Cb 0.92 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.66 1dgj h MET 870 CO 0.00 0.96 0.00 -0.35 0.23 0.00 0.00 176.91 177.75 1dgj n PRO 871 N -4.28 0.49 -0.09 0.39 -0.04 -1.26 -2.35 135.00 127.85 1dgj n PRO 871 Ca 0.01 0.01 0.03 0.00 -0.04 0.00 0.00 63.50 63.51 1dgj n PRO 871 Cb 0.35 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.39 1dgj n PRO 871 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1dgj n LEU 872 N -1.03 2.45 0.15 1.53 7.94 -1.17 -3.42 117.00 123.45 1dgj n LEU 872 Ca 0.12 -2.17 -0.13 0.00 -1.11 0.00 0.00 56.01 52.72 1dgj n LEU 872 Cb 0.06 -0.15 -0.08 0.00 0.53 0.00 0.00 43.42 43.79 1dgj n LEU 872 CO 0.10 0.60 0.49 0.71 -1.11 0.00 0.00 177.39 178.18 1dgj h THR 873 N 0.75 0.65 0.00 1.96 1.35 -1.54 -3.38 112.91 112.70 1dgj h THR 873 Ca 0.00 -0.68 -0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1dgj h THR 873 Cb 0.68 0.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 1dgj h THR 873 CO 0.01 0.12 -0.48 0.00 -0.25 0.00 0.00 175.52 174.93 1dgj n ALA 874 N -2.52 2.02 0.24 6.62 0.00 -1.26 -3.68 120.51 121.94 1dgj n ALA 874 Ca -0.09 -1.12 0.09 0.00 0.00 0.00 0.00 53.44 52.32 1dgj n ALA 874 Cb 0.27 -0.50 0.62 0.00 0.00 0.00 0.00 19.45 19.84 1dgj n ALA 874 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1dgj h PRO 875 N 0.02 0.00 -0.28 0.00 0.13 -1.81 -2.44 132.00 127.61 1dgj h PRO 875 Ca -0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 1dgj h PRO 875 Cb 1.38 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 1dgj h PRO 875 CO 0.00 0.17 -0.40 1.12 -0.23 0.00 0.00 178.00 178.66 1dgj h HIS 876 N 0.00 0.81 -0.24 1.56 2.07 -1.89 -2.47 115.15 114.99 1dgj h HIS 876 Ca -0.00 -0.24 -0.02 0.00 -2.85 0.00 0.00 60.37 57.26 1dgj h HIS 876 Cb 0.37 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.16 1dgj h HIS 876 CO 0.00 0.97 0.04 0.00 -3.07 0.00 0.00 177.93 175.87 1dgj h ALA 877 N 1.00 1.64 -0.17 6.11 0.00 -1.79 -1.89 119.26 124.15 1dgj h ALA 877 Ca 0.05 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1dgj h ALA 877 Cb 0.93 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1dgj h ALA 877 CO 0.08 0.28 -0.18 0.00 0.00 0.00 0.00 179.25 179.43 1dgj h ALA 878 N 1.72 0.26 -0.43 0.00 0.00 -1.28 -1.88 119.26 117.65 1dgj h ALA 878 Ca 0.08 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1dgj h ALA 878 Cb 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1dgj h ALA 878 CO -0.00 0.17 0.26 0.82 0.00 0.00 0.00 179.25 180.51 1dgj h ILE 879 N 0.08 1.07 -0.82 0.00 2.04 -1.10 0.58 117.51 119.36 1dgj h ILE 879 Ca 0.03 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1dgj h ILE 879 Cb 0.73 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1dgj h ILE 879 CO 0.05 0.10 0.43 0.40 0.00 0.00 0.00 178.15 179.13 1dgj h ILE 880 N 0.54 1.25 -0.25 -0.67 1.08 -1.33 -0.90 117.51 117.22 1dgj h ILE 880 Ca 0.17 -0.64 -0.12 0.00 -0.39 0.00 0.00 64.86 63.88 1dgj h ILE 880 Cb -0.02 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 33.89 1dgj h ILE 880 CO -0.06 0.28 -0.35 0.78 -0.69 0.00 0.00 178.15 178.11 1dgj h ASN 881 N 1.15 0.57 -0.43 1.72 2.35 -0.97 -2.30 115.58 117.67 1dgj h ASN 881 Ca 0.29 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1dgj h ASN 881 Cb 0.06 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1dgj h ASN 881 CO -0.04 0.87 0.23 1.23 -1.65 0.00 0.00 177.43 178.07 1dgj h GLY 882 N 1.05 0.64 0.83 2.83 0.00 -0.14 -0.07 103.07 108.22 1dgj h GLY 882 Ca 0.05 -0.30 0.02 0.00 0.00 0.00 0.00 47.33 47.11 1dgj h GLY 882 CO 0.07 0.29 0.18 -2.22 0.00 0.00 0.00 176.54 174.85 1dgj h ILE 883 N 0.55 0.98 -0.29 2.60 2.04 -0.92 0.73 117.51 123.21 1dgj h ILE 883 Ca 0.15 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 1dgj h ILE 883 Cb 0.07 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1dgj h ILE 883 CO -0.02 0.07 0.17 0.22 0.00 0.00 0.00 178.15 178.59 1dgj h TYR 884 N 0.36 0.38 -0.39 1.37 3.20 -1.18 -1.42 116.97 119.30 1dgj h TYR 884 Ca 0.15 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.11 1dgj h TYR 884 Cb 0.06 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1dgj h TYR 884 CO -0.10 0.29 0.28 -0.97 -1.64 0.00 0.00 178.16 176.01 1dgj h ASN 885 N 0.37 0.07 0.05 -2.11 -0.73 -0.30 0.63 115.58 113.56 1dgj h ASN 885 Ca 0.10 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.27 1dgj h ASN 885 Cb 0.02 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1dgj h ASN 885 CO -0.02 0.04 -0.02 0.00 -0.37 0.00 0.00 177.43 177.06 1dgj h ALA 886 N 1.80 -0.07 -0.01 1.57 0.00 0.12 -3.43 119.26 119.25 1dgj h ALA 886 Ca 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1dgj h ALA 886 Cb 0.63 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1dgj h ALA 886 CO -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1dgj n GLY 888 N 0.10 1.10 3.71 0.00 0.00 0.22 -4.48 105.19 105.84 1dgj n GLY 888 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1dgj n GLY 888 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgj s ALA 889 N -3.53 3.23 -0.27 4.61 0.00 -1.26 -4.48 121.76 120.06 1dgj s ALA 889 Ca 0.00 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.43 1dgj s ALA 889 Cb 0.00 -3.30 0.06 0.00 0.00 0.00 0.00 23.12 19.89 1dgj s ALA 889 CO 0.00 -0.28 -0.08 0.50 0.00 0.00 0.00 175.76 175.90 1dgj s ARG 890 N 1.16 2.05 -0.29 0.00 3.52 -1.24 -3.20 118.95 120.95 1dgj s ARG 890 Ca 0.49 -1.35 -0.13 0.00 -0.13 0.00 0.00 55.73 54.61 1dgj s ARG 890 Cb -0.20 -2.87 -0.04 0.00 -1.56 0.00 0.00 34.95 30.28 1dgj s ARG 890 CO 0.25 -0.62 0.26 0.08 -0.81 0.00 0.00 175.30 174.46 1dgj s VAL 891 N 1.13 5.26 -1.46 7.11 1.01 -1.26 -4.93 120.40 127.25 1dgj s VAL 891 Ca -0.06 0.26 0.17 0.00 0.00 0.00 0.00 61.98 62.35 1dgj s VAL 891 Cb -0.20 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1dgj s VAL 891 CO -0.06 0.18 0.86 0.54 0.00 0.00 0.00 175.10 176.62 1dgj n ARG 892 N 5.17 1.62 -3.93 2.72 5.12 -1.26 -4.84 116.66 121.27 1dgj n ARG 892 Ca -0.12 -0.74 -0.33 0.00 -1.93 0.00 0.00 57.85 54.73 1dgj n ARG 892 Cb 0.51 -1.30 -0.14 0.00 -1.16 0.00 0.00 32.46 30.38 1dgj n ARG 892 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1dgj s HIS 893 N -2.05 3.60 0.46 -1.55 2.46 -1.26 -0.05 115.29 116.89 1dgj s HIS 893 Ca 0.13 -2.60 -0.20 0.00 0.47 0.00 0.00 55.06 52.86 1dgj s HIS 893 Cb 0.14 -2.83 -0.10 0.00 -0.13 0.00 0.00 32.58 29.65 1dgj s HIS 893 CO 0.46 -0.93 0.98 -0.51 -2.47 0.00 0.00 174.74 172.27 1dgj s LEU 894 N 1.05 3.88 0.41 8.88 1.43 -0.50 -4.39 118.68 129.44 1dgj s LEU 894 Ca 0.06 1.77 -0.10 0.00 -1.03 0.00 0.00 54.13 54.83 1dgj s LEU 894 Cb -0.20 -4.55 -0.06 0.00 0.03 0.00 0.00 46.19 41.41 1dgj s LEU 894 CO -0.06 -0.53 0.78 -2.16 0.23 0.00 0.00 176.35 174.61 1dgj s PRO 895 N -3.26 3.77 -1.42 1.29 0.04 -1.26 -4.25 135.00 129.91 1dgj s PRO 895 Ca 0.64 0.47 -0.15 0.00 0.04 0.00 0.00 61.00 62.00 1dgj s PRO 895 Cb -0.12 -2.38 0.04 0.00 0.04 0.00 0.00 34.50 32.08 1dgj s PRO 895 CO 0.17 -0.06 2.16 0.00 0.04 0.00 0.00 177.00 179.31 1dgj n ALA 896 N -1.37 5.22 -1.36 8.56 0.00 0.14 -4.96 120.51 126.75 1dgj n ALA 896 Ca 0.02 -3.85 -0.32 0.00 0.00 0.00 0.00 53.44 49.29 1dgj n ALA 896 Cb 0.54 -3.55 0.07 0.00 0.00 0.00 0.00 19.45 16.51 1dgj n ALA 896 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1dgj s ARG 897 N 3.40 2.46 0.17 0.00 0.52 -1.26 -4.72 118.95 119.51 1dgj s ARG 897 Ca 0.48 1.28 -0.26 0.00 -0.52 0.00 0.00 55.73 56.71 1dgj s ARG 897 Cb 0.13 -1.91 0.03 0.00 0.52 0.00 0.00 34.95 33.71 1dgj s ARG 897 CO -0.06 -1.50 1.56 -1.35 0.02 0.00 0.00 175.30 173.97 1dgj h PRO 898 N -0.65 -0.22 0.00 3.54 0.11 -1.88 0.41 132.00 133.31 1dgj h PRO 898 Ca -0.45 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1dgj h PRO 898 Cb 1.24 0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 1dgj h PRO 898 CO 0.52 -0.15 -0.08 1.05 -0.21 0.00 0.00 178.00 179.13 1dgj h GLU 899 N -0.23 0.00 -0.06 1.05 9.09 -1.87 -0.51 114.58 122.05 1dgj h GLU 899 Ca 0.17 0.00 -0.23 0.00 0.05 0.00 0.00 59.36 59.35 1dgj h GLU 899 Cb 0.56 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.67 1dgj h GLU 899 CO -0.69 0.08 -0.88 -0.22 0.05 0.00 0.00 179.01 177.35 1dgj h LYS 900 N 0.00 0.61 -0.24 1.06 3.64 -1.34 -1.73 116.57 118.58 1dgj h LYS 900 Ca -0.00 -0.57 -0.12 0.00 -1.27 0.00 0.00 60.65 58.68 1dgj h LYS 900 Cb 0.22 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1dgj h LYS 900 CO 0.01 1.19 -0.37 0.28 -2.27 0.00 0.00 179.45 178.30 1dgj h VAL 901 N 0.38 1.29 0.08 2.00 2.07 -0.23 -2.86 116.25 118.98 1dgj h VAL 901 Ca -0.08 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 65.94 1dgj h VAL 901 Cb 1.51 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1dgj h VAL 901 CO 0.17 0.47 -0.04 0.25 0.02 0.00 0.00 177.57 178.44 1dgj h LEU 902 N 0.44 -0.09 -0.46 2.57 5.85 -1.00 -2.68 115.31 119.95 1dgj h LEU 902 Ca 0.05 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.60 1dgj h LEU 902 Cb 0.84 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.81 1dgj h LEU 902 CO 0.07 0.21 -0.11 -0.33 -0.34 0.00 0.00 178.44 177.94 1dgj h GLU 903 N -0.40 0.00 0.00 1.25 5.08 -1.30 -1.04 114.58 118.18 1dgj h GLU 903 Ca -0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1dgj h GLU 903 Cb 0.34 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1dgj h GLU 903 CO 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.03 1dgj n ALA 904 N -2.80 2.28 -2.63 3.43 0.00 -1.08 -4.82 120.51 114.89 1dgj n ALA 904 Ca 0.04 -0.11 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 1dgj n ALA 904 Cb 0.25 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 1dgj n ALA 904 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1dgj s MET 905 N -2.00 3.38 0.00 0.00 0.00 -0.40 -3.71 119.30 116.57 1dgj s MET 905 Ca 0.27 -0.10 0.31 0.00 0.00 0.00 0.00 55.69 56.18 1dgj s MET 905 Cb 0.13 -4.05 1.74 0.00 0.00 0.00 0.00 34.83 32.64 1dgj s MET 905 CO 0.21 -1.60 2.13 -0.35 0.00 0.00 0.00 175.02 175.41