#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dqj n ILE 2 N 0.00 0.15 -3.98 5.18 5.41 -1.26 -4.96 119.36 119.89 1dqj n ILE 2 Ca 0.00 -0.03 -0.35 0.00 1.00 0.00 0.00 62.75 63.38 1dqj n ILE 2 Cb 0.00 -2.00 -0.09 0.00 -0.71 0.00 0.00 39.64 36.84 1dqj n ILE 2 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1dqj s VAL 3 N 1.79 4.90 -0.19 1.39 1.01 -1.26 -4.78 120.40 123.25 1dqj s VAL 3 Ca 0.78 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.73 1dqj s VAL 3 Cb -0.51 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1dqj s VAL 3 CO 0.35 0.48 -0.06 -0.76 0.00 0.00 0.00 175.10 175.10 1dqj s LEU 4 N 0.20 2.89 -0.23 3.92 1.43 -1.26 -1.19 118.68 124.43 1dqj s LEU 4 Ca 0.05 -0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 52.75 1dqj s LEU 4 Cb -0.12 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 1dqj s LEU 4 CO 0.00 0.05 0.01 -0.89 0.23 0.00 0.00 176.35 175.75 1dqj s THR 5 N 1.08 3.87 0.02 5.49 2.01 0.98 -3.76 115.64 125.33 1dqj s THR 5 Ca 0.01 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1dqj s THR 5 Cb -0.15 -2.78 -0.04 0.00 0.01 0.00 0.00 72.50 69.54 1dqj s THR 5 CO -0.01 0.39 0.04 -1.10 -0.69 0.00 0.00 174.62 173.26 1dqj s GLN 6 N 1.44 2.88 -0.05 4.92 -0.21 -1.26 -0.34 119.66 127.04 1dqj s GLN 6 Ca 0.05 -0.60 -0.20 0.00 0.02 0.00 0.00 55.36 54.63 1dqj s GLN 6 Cb -0.15 -2.73 0.04 0.00 1.00 0.00 0.00 33.01 31.17 1dqj s GLN 6 CO 0.01 0.61 0.44 -1.54 -2.12 0.00 0.00 175.29 172.69 1dqj s SER 7 N -1.85 -0.37 0.82 5.90 1.04 -0.95 -4.48 113.70 113.81 1dqj s SER 7 Ca 0.23 0.41 -0.12 0.00 0.48 0.00 0.00 55.95 56.95 1dqj s SER 7 Cb -0.12 0.49 0.08 0.00 0.10 0.00 0.00 66.02 66.57 1dqj s SER 7 CO 0.14 -0.45 1.12 -2.84 0.98 0.00 0.00 173.24 172.20 1dqj s PRO 8 N -1.02 1.93 0.38 4.02 0.02 -1.26 -2.24 135.00 136.83 1dqj s PRO 8 Ca -0.11 0.44 0.07 0.00 0.02 0.00 0.00 61.00 61.43 1dqj s PRO 8 Cb -0.03 -1.92 0.77 0.00 0.02 0.00 0.00 34.50 33.34 1dqj s PRO 8 CO 0.05 -1.69 1.95 0.00 -0.33 0.00 0.00 177.00 176.99 1dqj h ALA 9 N -1.13 1.54 -2.66 -1.55 0.00 -1.85 -3.42 119.26 110.20 1dqj h ALA 9 Ca -0.48 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.16 1dqj h ALA 9 Cb 1.29 -0.12 -0.20 0.00 0.00 0.00 0.00 17.79 18.76 1dqj h ALA 9 CO 0.62 0.34 -0.43 -0.08 0.00 0.00 0.00 179.25 179.69 1dqj s THR 10 N -5.05 0.09 -0.08 0.00 -1.32 -1.26 -1.21 115.64 106.80 1dqj s THR 10 Ca -0.07 -0.73 -0.03 0.00 -1.21 0.00 0.00 61.69 59.65 1dqj s THR 10 Cb 0.16 -0.61 0.04 0.00 -1.51 0.00 0.00 72.50 70.59 1dqj s THR 10 CO 0.74 -0.40 0.17 -0.22 -2.21 0.00 0.00 174.62 172.70 1dqj s LEU 11 N -1.59 0.30 -0.25 9.08 0.20 0.48 -4.90 118.68 122.00 1dqj s LEU 11 Ca -0.12 0.37 -0.07 0.00 0.69 0.00 0.00 54.13 55.00 1dqj s LEU 11 Cb -0.05 0.40 -0.03 0.00 -0.43 0.00 0.00 46.19 46.08 1dqj s LEU 11 CO 0.00 -0.19 0.07 -0.44 -0.29 0.00 0.00 176.35 175.50 1dqj s SER 12 N 1.70 5.12 0.20 3.68 0.01 -1.26 0.24 113.70 123.40 1dqj s SER 12 Ca -0.04 -0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.04 1dqj s SER 12 Cb -0.12 -1.92 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 1dqj s SER 12 CO -0.06 -0.03 0.02 0.68 0.41 0.00 0.00 173.24 174.26 1dqj s VAL 13 N 1.57 0.71 -0.17 3.43 -7.23 -0.04 -4.69 120.40 113.98 1dqj s VAL 13 Ca 0.06 -1.99 -0.09 0.00 -1.81 0.00 0.00 61.98 58.15 1dqj s VAL 13 Cb -0.15 -2.26 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 1dqj s VAL 13 CO 0.03 -0.35 0.13 -0.89 -0.31 0.00 0.00 175.10 173.71 1dqj s THR 14 N -3.64 5.40 0.12 5.32 2.01 -1.26 -0.75 115.64 122.84 1dqj s THR 14 Ca 0.28 0.18 -0.35 0.00 0.31 0.00 0.00 61.69 62.10 1dqj s THR 14 Cb 0.06 -3.43 -0.16 0.00 0.01 0.00 0.00 72.50 68.99 1dqj s THR 14 CO 0.07 0.50 1.34 -2.65 -0.69 0.00 0.00 174.62 173.19 1dqj n PRO 15 N 3.05 1.34 0.00 4.92 -0.02 -1.26 -1.05 135.00 141.98 1dqj n PRO 15 Ca -0.17 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1dqj n PRO 15 Cb 0.53 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1dqj n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dqj n GLY 16 N 2.54 1.56 3.84 -1.23 0.00 0.53 -4.96 105.19 107.47 1dqj n GLY 16 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1dqj n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dqj s ASP 17 N -0.76 5.94 0.20 1.61 1.01 -0.22 -4.32 116.67 120.14 1dqj s ASP 17 Ca 0.00 1.58 0.05 0.00 0.71 0.00 0.00 52.55 54.89 1dqj s ASP 17 Cb 0.00 -2.50 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 1dqj s ASP 17 CO 0.00 -1.06 0.27 -0.44 0.21 0.00 0.00 175.17 174.15 1dqj s SER 18 N -3.61 6.05 0.06 0.27 0.01 -1.26 0.62 113.70 115.85 1dqj s SER 18 Ca 0.58 0.01 -0.09 0.00 1.31 0.00 0.00 55.95 57.76 1dqj s SER 18 Cb -0.13 -1.73 0.00 0.00 0.21 0.00 0.00 66.02 64.38 1dqj s SER 18 CO 0.47 -0.01 0.19 0.54 0.41 0.00 0.00 173.24 174.85 1dqj s VAL 19 N -1.90 0.12 -0.10 3.43 0.11 -0.15 -4.88 120.40 117.03 1dqj s VAL 19 Ca 0.33 -1.02 -0.01 0.00 -2.93 0.00 0.00 61.98 58.36 1dqj s VAL 19 Cb -0.10 -1.10 0.03 0.00 -1.53 0.00 0.00 36.38 33.68 1dqj s VAL 19 CO 0.27 -0.56 -0.06 -0.44 -3.33 0.00 0.00 175.10 170.99 1dqj s SER 20 N -2.42 1.98 -0.13 3.54 0.01 -1.26 -1.01 113.70 114.42 1dqj s SER 20 Ca -0.01 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 56.97 1dqj s SER 20 Cb 0.01 -0.73 -0.03 0.00 0.21 0.00 0.00 66.02 65.49 1dqj s SER 20 CO -0.07 -0.13 0.00 -0.76 0.41 0.00 0.00 173.24 172.69 1dqj s LEU 21 N 1.73 3.54 0.05 2.44 1.43 0.11 -4.91 118.68 123.07 1dqj s LEU 21 Ca 0.04 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 1dqj s LEU 21 Cb -0.13 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1dqj s LEU 21 CO -0.07 0.27 0.18 -0.55 0.23 0.00 0.00 176.35 176.41 1dqj s SER 22 N -0.23 6.19 -0.13 2.29 0.15 -0.95 -0.61 113.70 120.40 1dqj s SER 22 Ca 0.06 0.23 -0.05 0.00 0.70 0.00 0.00 55.95 56.88 1dqj s SER 22 Cb -0.12 -1.87 0.07 0.00 -1.71 0.00 0.00 66.02 62.38 1dqj s SER 22 CO 0.02 0.19 0.27 0.00 1.20 0.00 0.00 173.24 174.92 1dqj s ARG 24 N 2.42 2.52 0.00 0.00 3.00 0.54 -1.06 118.95 126.38 1dqj s ARG 24 Ca 0.01 -0.81 -0.01 0.00 0.00 0.00 0.00 55.73 54.92 1dqj s ARG 24 Cb -0.12 -2.27 -0.04 0.00 0.00 0.00 0.00 34.95 32.52 1dqj s ARG 24 CO -0.09 0.50 0.13 0.00 0.00 0.00 0.00 175.30 175.83 1dqj s ALA 25 N -0.42 3.75 -0.33 2.13 0.00 -0.26 -0.02 121.76 126.60 1dqj s ALA 25 Ca 0.04 -0.84 0.27 0.00 0.00 0.00 0.00 51.96 51.44 1dqj s ALA 25 Cb -0.12 -1.70 1.02 0.00 0.00 0.00 0.00 23.12 22.32 1dqj s ALA 25 CO 0.02 0.72 1.80 0.66 0.00 0.00 0.00 175.76 178.96 1dqj h SER 26 N 3.89 0.00 -4.90 0.00 4.64 -1.49 -3.44 113.55 112.24 1dqj h SER 26 Ca -0.49 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 1dqj h SER 26 Cb 1.18 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.11 1dqj h SER 26 CO 0.66 0.00 -0.70 -1.10 -0.87 0.00 0.00 176.83 174.82 1dqj s GLN 27 N -3.39 0.64 0.26 4.77 -0.21 -1.26 -4.98 119.66 115.49 1dqj s GLN 27 Ca 0.04 -1.12 -0.30 0.00 0.02 0.00 0.00 55.36 54.01 1dqj s GLN 27 Cb 0.09 -0.03 -0.10 0.00 1.00 0.00 0.00 33.01 33.98 1dqj s GLN 27 CO 0.49 -0.04 1.31 0.45 -2.12 0.00 0.00 175.29 175.38 1dqj s SER 28 N -2.58 6.85 -0.07 5.90 0.15 -1.26 -4.64 113.70 118.04 1dqj s SER 28 Ca 0.03 2.53 0.11 0.00 0.70 0.00 0.00 55.95 59.32 1dqj s SER 28 Cb 0.02 -2.63 0.19 0.00 -1.71 0.00 0.00 66.02 61.89 1dqj s SER 28 CO -0.05 -0.52 1.09 2.30 1.20 0.00 0.00 173.24 177.26 1dqj n ILE 29 N 1.84 1.02 0.00 6.45 -5.35 0.68 -4.98 119.36 119.02 1dqj n ILE 29 Ca 0.04 -1.31 0.00 0.00 -0.27 0.00 0.00 62.75 61.20 1dqj n ILE 29 Cb 0.42 0.14 0.00 0.00 -1.74 0.00 0.00 39.64 38.46 1dqj n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1dqj n SER 30 N -0.71 0.00 -0.42 7.28 7.64 -1.24 -0.69 113.62 125.47 1dqj n SER 30 Ca 0.09 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.02 1dqj n SER 30 Cb 0.70 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 64.01 1dqj n SER 30 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1dqj n ASN 31 N 7.63 2.71 -2.42 6.43 2.04 -1.26 -0.44 115.26 129.95 1dqj n ASN 31 Ca 0.00 -2.22 -0.21 0.00 -0.44 0.00 0.00 54.58 51.71 1dqj n ASN 31 Cb 0.00 -0.22 -0.12 0.00 -2.53 0.00 0.00 39.78 36.92 1dqj n ASN 31 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1dqj n ASN 32 N -0.10 6.31 -4.11 0.53 4.13 0.13 -2.15 115.26 119.99 1dqj n ASN 32 Ca 0.10 -2.60 -0.28 0.00 1.68 0.00 0.00 54.58 53.47 1dqj n ASN 32 Cb 0.45 -1.43 -0.17 0.00 -1.54 0.00 0.00 39.78 37.09 1dqj n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1dqj s LEU 33 N -0.28 1.85 0.14 3.41 1.98 -1.26 -1.44 118.68 123.08 1dqj s LEU 33 Ca 0.66 -0.42 0.11 0.00 -2.89 0.00 0.00 54.13 51.59 1dqj s LEU 33 Cb 0.29 -1.09 -0.04 0.00 0.66 0.00 0.00 46.19 46.01 1dqj s LEU 33 CO -0.04 0.09 -0.25 -1.00 -1.89 0.00 0.00 176.35 173.26 1dqj s HIS 34 N 0.51 2.24 -0.11 5.38 3.76 0.12 0.36 115.29 127.54 1dqj s HIS 34 Ca -0.16 -0.38 0.02 0.00 -0.15 0.00 0.00 55.06 54.38 1dqj s HIS 34 Cb -0.17 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.33 1dqj s HIS 34 CO 0.06 0.37 -0.17 -1.58 -0.85 0.00 0.00 174.74 172.57 1dqj s TRP 35 N -1.26 2.72 0.11 1.40 0.52 -0.38 -0.22 118.94 121.83 1dqj s TRP 35 Ca 0.15 -0.72 0.10 0.00 0.02 0.00 0.00 56.10 55.65 1dqj s TRP 35 Cb -0.09 -1.78 -0.04 0.00 -1.15 0.00 0.00 33.47 30.41 1dqj s TRP 35 CO 0.07 -0.24 -0.25 0.71 0.02 0.00 0.00 176.95 177.26 1dqj s TYR 36 N 0.24 2.15 -0.01 -1.98 2.02 0.62 -0.61 117.35 119.78 1dqj s TYR 36 Ca -0.11 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.24 1dqj s TYR 36 Cb -0.16 -1.18 -0.03 0.00 -0.40 0.00 0.00 41.96 40.19 1dqj s TYR 36 CO 0.06 0.28 -0.14 -1.14 -1.57 0.00 0.00 175.55 173.03 1dqj s GLN 37 N -1.92 2.37 -0.18 -0.62 0.74 -0.19 -1.32 119.66 118.54 1dqj s GLN 37 Ca 0.12 -0.79 -0.04 0.00 0.05 0.00 0.00 55.36 54.70 1dqj s GLN 37 Cb -0.10 -2.33 0.09 0.00 1.10 0.00 0.00 33.01 31.76 1dqj s GLN 37 CO 0.05 0.59 0.23 -1.14 -0.55 0.00 0.00 175.29 174.47 1dqj s GLN 38 N -1.04 0.17 0.39 1.67 0.74 0.14 -0.22 119.66 121.51 1dqj s GLN 38 Ca 0.13 0.35 -0.07 0.00 0.05 0.00 0.00 55.36 55.82 1dqj s GLN 38 Cb -0.11 -0.87 -0.05 0.00 1.10 0.00 0.00 33.01 33.08 1dqj s GLN 38 CO 0.03 -0.55 0.72 0.15 -0.55 0.00 0.00 175.29 175.08 1dqj s LYS 39 N 2.35 3.68 0.35 1.67 -0.14 -1.26 -0.56 119.74 125.82 1dqj s LYS 39 Ca 0.06 0.27 -0.28 0.00 -1.36 0.00 0.00 55.97 54.65 1dqj s LYS 39 Cb -0.15 -2.46 -0.12 0.00 -1.68 0.00 0.00 37.83 33.43 1dqj s LYS 39 CO -0.11 -0.01 1.42 -1.13 -0.76 0.00 0.00 175.35 174.76 1dqj n SER 40 N -1.47 3.36 -1.14 2.83 3.41 -1.26 -1.76 113.62 117.59 1dqj n SER 40 Ca 0.01 1.21 -0.14 0.00 -0.26 0.00 0.00 58.87 59.69 1dqj n SER 40 Cb 0.54 -1.56 -0.05 0.00 -0.26 0.00 0.00 64.21 62.88 1dqj n SER 40 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1dqj n HIS 41 N 0.61 -0.10 -4.13 7.33 8.25 -1.26 -4.99 115.22 120.93 1dqj n HIS 41 Ca 0.04 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.41 1dqj n HIS 41 Cb 0.37 -2.56 -0.10 0.00 1.12 0.00 0.00 29.99 28.82 1dqj n HIS 41 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1dqj s GLU 42 N -3.41 0.78 0.53 -0.41 2.02 -0.72 -5.16 118.70 112.33 1dqj s GLU 42 Ca 0.00 -1.33 -0.06 0.00 0.02 0.00 0.00 54.97 53.60 1dqj s GLU 42 Cb 0.00 0.15 -0.02 0.00 0.10 0.00 0.00 34.13 34.36 1dqj s GLU 42 CO 0.00 -0.16 0.84 -1.54 0.02 0.00 0.00 175.26 174.42 1dqj s SER 43 N -3.00 6.04 0.67 -0.19 1.04 -1.26 -4.55 113.70 112.45 1dqj s SER 43 Ca 0.15 0.90 -0.17 0.00 0.48 0.00 0.00 55.95 57.31 1dqj s SER 43 Cb 0.07 -2.09 0.01 0.00 0.10 0.00 0.00 66.02 64.11 1dqj s SER 43 CO -0.04 -0.76 1.21 -2.84 0.98 0.00 0.00 173.24 171.79 1dqj s PRO 44 N -4.86 2.50 -0.07 4.02 0.02 -1.26 -4.60 135.00 130.74 1dqj s PRO 44 Ca 0.50 1.79 0.02 0.00 0.02 0.00 0.00 61.00 63.33 1dqj s PRO 44 Cb -0.10 -1.87 0.02 0.00 0.02 0.00 0.00 34.50 32.56 1dqj s PRO 44 CO 0.46 -1.57 -0.10 0.50 -0.33 0.00 0.00 177.00 175.95 1dqj s ARG 45 N -3.68 1.56 -0.04 5.54 3.52 0.69 -4.94 118.95 121.59 1dqj s ARG 45 Ca 0.76 -0.34 -0.30 0.00 -0.13 0.00 0.00 55.73 55.71 1dqj s ARG 45 Cb -0.30 -1.38 -0.04 0.00 -1.56 0.00 0.00 34.95 31.68 1dqj s ARG 45 CO 0.41 -0.05 1.27 -1.17 -0.81 0.00 0.00 175.30 174.95 1dqj s LEU 46 N 0.91 4.28 -0.21 -0.88 2.96 -1.26 -1.02 118.68 123.46 1dqj s LEU 46 Ca -0.10 1.91 -0.05 0.00 -0.22 0.00 0.00 54.13 55.67 1dqj s LEU 46 Cb -0.15 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.87 1dqj s LEU 46 CO 0.01 -0.64 -0.23 0.18 -1.32 0.00 0.00 176.35 174.34 1dqj n LEU 47 N 5.37 2.26 -3.94 -0.68 4.77 0.22 -4.96 117.00 120.03 1dqj n LEU 47 Ca 0.12 0.08 -0.16 0.00 -0.03 0.00 0.00 56.01 56.02 1dqj n LEU 47 Cb 0.45 -0.68 -0.15 0.00 -2.33 0.00 0.00 43.42 40.71 1dqj n LEU 47 CO 0.56 0.65 -0.40 -0.63 -1.33 0.00 0.00 177.39 176.25 1dqj s ILE 48 N -2.41 0.39 0.10 -0.08 -1.09 -1.18 -4.02 121.20 112.91 1dqj s ILE 48 Ca -0.29 -0.19 0.10 0.00 -2.23 0.00 0.00 60.65 58.04 1dqj s ILE 48 Cb 0.09 -0.34 -0.04 0.00 -1.58 0.00 0.00 42.46 40.60 1dqj s ILE 48 CO 0.43 0.12 -0.27 -1.59 -1.23 0.00 0.00 174.94 172.40 1dqj s LYS 49 N -0.02 1.56 -1.25 2.79 -2.85 -0.88 -1.24 119.74 117.85 1dqj s LYS 49 Ca 0.01 -1.26 -0.09 0.00 -1.00 0.00 0.00 55.97 53.64 1dqj s LYS 49 Cb -0.03 -1.93 -0.01 0.00 -2.06 0.00 0.00 37.83 33.80 1dqj s LYS 49 CO -0.00 0.47 0.68 0.66 0.10 0.00 0.00 175.35 177.26 1dqj n TYR 50 N 1.25 -1.88 0.00 1.78 4.01 -1.12 -1.05 117.16 120.16 1dqj n TYR 50 Ca -0.18 0.66 0.00 0.00 -0.16 0.00 0.00 57.90 58.23 1dqj n TYR 50 Cb 0.53 -3.84 0.00 0.00 -0.31 0.00 0.00 39.34 35.72 1dqj n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dqj n ALA 51 N -4.20 0.00 -1.09 -0.72 0.00 0.16 -3.80 120.51 110.85 1dqj n ALA 51 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1dqj n ALA 51 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1dqj n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1dqj n SER 52 N 0.95 0.00 -4.71 0.00 3.41 -1.21 -2.63 113.62 109.43 1dqj n SER 52 Ca 0.00 -0.90 -0.42 0.00 -0.26 0.00 0.00 58.87 57.29 1dqj n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1dqj n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dqj s GLN 53 N 0.00 4.41 0.46 4.33 -0.21 -0.21 -4.64 119.66 123.79 1dqj s GLN 53 Ca 0.00 1.76 -0.21 0.00 0.02 0.00 0.00 55.36 56.93 1dqj s GLN 53 Cb 0.00 -3.40 -0.09 0.00 1.00 0.00 0.00 33.01 30.52 1dqj s GLN 53 CO 0.00 -0.31 1.01 -1.54 -2.12 0.00 0.00 175.29 172.33 1dqj s SER 54 N 1.18 6.61 -0.26 5.90 1.04 -1.26 -2.07 113.70 124.84 1dqj s SER 54 Ca 0.58 1.85 -0.09 0.00 0.48 0.00 0.00 55.95 58.78 1dqj s SER 54 Cb -0.29 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.24 1dqj s SER 54 CO 0.28 -0.59 0.11 -0.63 0.98 0.00 0.00 173.24 173.39 1dqj s ILE 55 N -2.01 4.69 0.10 -1.02 -1.09 -1.26 -4.89 121.20 115.72 1dqj s ILE 55 Ca 0.64 -0.04 -0.33 0.00 -2.23 0.00 0.00 60.65 58.69 1dqj s ILE 55 Cb -0.14 -3.20 -0.13 0.00 -1.58 0.00 0.00 42.46 37.41 1dqj s ILE 55 CO 0.18 0.31 1.70 -0.24 -1.23 0.00 0.00 174.94 175.67 1dqj n SER 56 N 4.90 3.42 0.00 3.58 2.88 -1.26 -1.31 113.62 125.83 1dqj n SER 56 Ca -0.15 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1dqj n SER 56 Cb 0.52 -1.45 0.00 0.00 -0.75 0.00 0.00 64.21 62.53 1dqj n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1dqj n GLY 57 N 3.83 0.39 3.78 0.46 0.00 -1.26 -5.07 105.19 107.32 1dqj n GLY 57 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1dqj n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dqj s ILE 58 N -2.00 5.44 0.21 -0.61 -1.09 -0.43 -5.05 121.20 117.67 1dqj s ILE 58 Ca 0.00 0.22 -0.30 0.00 -2.23 0.00 0.00 60.65 58.34 1dqj s ILE 58 Cb 0.00 -3.46 -0.16 0.00 -1.58 0.00 0.00 42.46 37.26 1dqj s ILE 58 CO 0.00 0.50 0.84 -2.65 -1.23 0.00 0.00 174.94 172.40 1dqj n PRO 59 N 2.95 0.65 0.28 2.79 -0.02 -1.26 -4.86 135.00 135.53 1dqj n PRO 59 Ca -0.17 0.23 0.19 0.00 -2.02 0.00 0.00 63.50 61.73 1dqj n PRO 59 Cb 0.53 -1.48 0.94 0.00 -0.02 0.00 0.00 33.50 33.47 1dqj n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1dqj h SER 60 N 1.89 0.00 0.51 2.55 4.64 -1.97 -2.61 113.55 118.56 1dqj h SER 60 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1dqj h SER 60 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1dqj h SER 60 CO 0.61 0.00 0.00 0.08 -0.87 0.00 0.00 176.83 176.65 1dqj h ARG 61 N 0.00 0.00 -5.78 4.77 0.11 -1.89 -3.42 114.38 108.17 1dqj h ARG 61 Ca 0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 1dqj h ARG 61 Cb 0.16 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.17 1dqj h ARG 61 CO 0.00 0.00 -0.11 -0.06 0.10 0.00 0.00 179.97 179.90 1dqj s PHE 62 N -3.59 3.52 0.02 4.08 0.08 -0.98 -1.47 117.98 119.63 1dqj s PHE 62 Ca 0.00 0.94 -0.16 0.00 0.12 0.00 0.00 56.93 57.83 1dqj s PHE 62 Cb 0.09 -2.59 0.03 0.00 -0.57 0.00 0.00 43.02 39.98 1dqj s PHE 62 CO 0.38 0.16 0.36 -1.54 -0.10 0.00 0.00 175.22 174.48 1dqj s SER 63 N 0.64 -0.23 0.12 1.36 1.04 -0.58 -4.99 113.70 111.06 1dqj s SER 63 Ca 0.28 0.03 0.06 0.00 0.48 0.00 0.00 55.95 56.80 1dqj s SER 63 Cb -0.15 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1dqj s SER 63 CO 0.11 -0.56 -0.15 -0.83 0.98 0.00 0.00 173.24 172.79 1dqj s GLY 64 N -1.71 1.13 0.28 7.32 0.00 -1.26 -0.08 107.32 113.00 1dqj s GLY 64 Ca -0.09 -1.29 -0.07 0.00 0.00 0.00 0.00 44.72 43.28 1dqj s GLY 64 CO 0.01 -1.34 0.42 -1.35 0.00 0.00 0.00 173.10 170.84 1dqj s SER 65 N -2.36 0.36 0.00 1.64 1.04 -0.36 -4.22 113.70 109.80 1dqj s SER 65 Ca 0.09 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.28 1dqj s SER 65 Cb -0.06 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1dqj s SER 65 CO 0.04 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.71 1dqj n GLY 66 N -0.44 1.93 3.52 7.32 0.00 -1.26 -1.67 105.19 114.59 1dqj n GLY 66 Ca 0.00 -2.05 -0.09 0.00 0.00 0.00 0.00 46.02 43.87 1dqj n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dqj s SER 67 N 0.00 -0.38 0.06 1.61 1.04 -1.01 -4.88 113.70 110.14 1dqj s SER 67 Ca 0.00 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.56 1dqj s SER 67 Cb 0.00 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1dqj s SER 67 CO 0.00 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1dqj n GLY 68 N 0.05 1.99 0.00 7.32 0.00 0.41 -3.24 105.19 111.73 1dqj n GLY 68 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1dqj n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dqj n THR 69 N 0.00 0.00 -4.01 2.61 -2.24 -1.26 -0.23 114.28 109.14 1dqj n THR 69 Ca 0.00 -0.33 -0.34 0.00 -2.27 0.00 0.00 64.05 61.11 1dqj n THR 69 Cb 0.00 1.14 -0.15 0.00 -2.10 0.00 0.00 70.33 69.23 1dqj n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1dqj s ASP 70 N -0.38 4.22 0.17 3.42 2.15 -1.20 -1.11 116.67 123.94 1dqj s ASP 70 Ca 0.00 -1.04 0.08 0.00 0.43 0.00 0.00 52.55 52.02 1dqj s ASP 70 Cb 0.00 -1.60 -0.04 0.00 -0.30 0.00 0.00 42.92 40.97 1dqj s ASP 70 CO 0.00 -0.14 -0.17 -0.36 -0.17 0.00 0.00 175.17 174.33 1dqj s PHE 71 N 1.24 1.78 -0.06 -5.34 0.40 -0.22 -2.41 117.98 113.37 1dqj s PHE 71 Ca -0.02 -0.49 -0.03 0.00 -0.60 0.00 0.00 56.93 55.78 1dqj s PHE 71 Cb -0.17 -0.87 0.03 0.00 0.51 0.00 0.00 43.02 42.51 1dqj s PHE 71 CO -0.06 0.33 0.13 0.99 0.70 0.00 0.00 175.22 177.31 1dqj s THR 72 N -2.26 -0.04 -0.21 0.64 2.01 -0.67 -1.94 115.64 113.17 1dqj s THR 72 Ca 0.17 0.13 -0.05 0.00 0.31 0.00 0.00 61.69 62.25 1dqj s THR 72 Cb -0.05 -0.21 -0.02 0.00 0.01 0.00 0.00 72.50 72.23 1dqj s THR 72 CO 0.07 0.05 0.01 -0.22 -0.69 0.00 0.00 174.62 173.83 1dqj s LEU 73 N 0.85 3.23 -0.02 4.42 2.96 0.21 -1.22 118.68 129.11 1dqj s LEU 73 Ca -0.07 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.65 1dqj s LEU 73 Cb -0.09 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1dqj s LEU 73 CO -0.04 0.03 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.47 1dqj s SER 74 N 1.18 4.29 -0.28 3.68 0.01 0.89 0.07 113.70 123.55 1dqj s SER 74 Ca 0.03 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1dqj s SER 74 Cb -0.14 -0.94 0.08 0.00 0.21 0.00 0.00 66.02 65.23 1dqj s SER 74 CO 0.01 0.31 0.03 -0.63 0.41 0.00 0.00 173.24 173.38 1dqj s ILE 75 N -0.86 1.31 -0.47 1.44 1.01 -0.18 -1.52 121.20 121.92 1dqj s ILE 75 Ca 0.14 -1.41 -0.25 0.00 0.00 0.00 0.00 60.65 59.13 1dqj s ILE 75 Cb -0.11 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.57 1dqj s ILE 75 CO 0.04 -0.41 0.92 0.21 0.00 0.00 0.00 174.94 175.69 1dqj s ASN 76 N 1.44 6.47 -0.14 3.58 3.84 -0.54 -0.97 114.94 128.61 1dqj s ASN 76 Ca 0.03 0.04 -0.03 0.00 0.21 0.00 0.00 52.86 53.12 1dqj s ASN 76 Cb -0.18 -2.44 0.00 0.00 -0.55 0.00 0.00 41.25 38.08 1dqj s ASN 76 CO -0.14 -1.06 0.16 -0.24 -2.79 0.00 0.00 177.10 173.03 1dqj n SER 77 N 7.17 -3.53 -4.73 -4.21 2.88 -1.18 -4.76 113.62 105.26 1dqj n SER 77 Ca 0.05 0.08 -0.42 0.00 -1.33 0.00 0.00 58.87 57.26 1dqj n SER 77 Cb 0.48 -2.13 -0.02 0.00 -0.75 0.00 0.00 64.21 61.79 1dqj n SER 77 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1dqj n VAL 78 N -0.72 0.73 -4.06 2.46 0.31 0.20 -4.68 118.33 112.57 1dqj n VAL 78 Ca 0.02 -0.18 -0.22 0.00 -0.01 0.00 0.00 64.34 63.95 1dqj n VAL 78 Cb 0.26 -1.95 -0.04 0.00 -0.91 0.00 0.00 33.84 31.20 1dqj n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1dqj s GLU 79 N -0.03 2.97 0.61 5.55 0.41 -1.26 -0.35 118.70 126.60 1dqj s GLU 79 Ca 0.67 -1.04 0.29 0.00 -0.41 0.00 0.00 54.97 54.48 1dqj s GLU 79 Cb -0.51 -2.60 1.54 0.00 -1.78 0.00 0.00 34.13 30.78 1dqj s GLU 79 CO 0.44 0.37 1.93 0.00 -0.49 0.00 0.00 175.26 177.51 1dqj h THR 80 N 1.42 0.29 -0.17 3.63 1.03 -1.96 0.11 112.91 117.27 1dqj h THR 80 Ca -0.49 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.91 1dqj h THR 80 Cb 1.24 0.66 0.00 0.00 -1.07 0.00 0.00 68.15 68.98 1dqj h THR 80 CO 0.60 0.00 0.00 -1.84 -0.01 0.00 0.00 175.52 174.27 1dqj n GLU 81 N -3.53 1.81 0.00 0.00 0.00 -1.26 -4.09 120.64 113.57 1dqj n GLU 81 Ca 0.05 -1.21 0.13 0.00 0.00 0.00 0.00 57.16 56.13 1dqj n GLU 81 Cb 0.55 -1.41 0.37 0.00 0.00 0.00 0.00 31.44 30.94 1dqj n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1dqj n ASP 82 N 0.44 1.81 -4.75 -1.84 8.00 0.39 -4.93 116.55 115.67 1dqj n ASP 82 Ca 0.17 -1.52 -0.40 0.00 0.71 0.00 0.00 54.79 53.74 1dqj n ASP 82 Cb 0.36 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.46 1dqj n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dqj s PHE 83 N -2.11 3.79 -5.00 1.24 0.40 -1.26 -4.89 117.98 110.15 1dqj s PHE 83 Ca 0.32 1.79 0.00 0.00 -0.60 0.00 0.00 56.93 58.45 1dqj s PHE 83 Cb 0.20 -3.12 0.00 0.00 0.51 0.00 0.00 43.02 40.61 1dqj s PHE 83 CO 0.37 -0.02 0.00 0.41 0.70 0.00 0.00 175.22 176.68 1dqj n GLY 84 N 1.59 -0.28 3.89 4.36 0.00 -0.87 -4.82 105.19 109.06 1dqj n GLY 84 Ca -0.00 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.63 1dqj n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dqj s MET 85 N -2.00 3.42 -0.09 1.61 -1.94 0.27 -0.21 119.30 120.37 1dqj s MET 85 Ca 0.00 -0.25 0.01 0.00 -1.71 0.00 0.00 55.69 53.74 1dqj s MET 85 Cb 0.00 -3.12 0.02 0.00 2.01 0.00 0.00 34.83 33.73 1dqj s MET 85 CO 0.00 0.72 -0.11 0.71 -0.01 0.00 0.00 175.02 176.33 1dqj s TYR 86 N -1.20 1.54 0.11 -0.03 1.51 0.07 0.24 117.35 119.58 1dqj s TYR 86 Ca 0.22 -0.68 0.09 0.00 -1.01 0.00 0.00 57.07 55.69 1dqj s TYR 86 Cb -0.12 -1.18 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 1dqj s TYR 86 CO 0.13 -0.40 -0.22 -0.06 -1.11 0.00 0.00 175.55 173.88 1dqj s PHE 87 N 1.13 1.89 0.17 2.71 0.40 -0.44 -0.69 117.98 123.15 1dqj s PHE 87 Ca -0.06 -0.41 0.08 0.00 -0.60 0.00 0.00 56.93 55.94 1dqj s PHE 87 Cb -0.14 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 1dqj s PHE 87 CO -0.02 0.23 -0.03 0.00 0.70 0.00 0.00 175.22 176.11 1dqj s GLN 89 N -2.87 0.19 -0.04 0.00 0.74 0.69 -0.97 119.66 117.40 1dqj s GLN 89 Ca 0.27 0.39 -0.04 0.00 0.05 0.00 0.00 55.36 56.03 1dqj s GLN 89 Cb -0.09 -0.04 -0.04 0.00 1.10 0.00 0.00 33.01 33.94 1dqj s GLN 89 CO 0.18 -0.11 0.16 1.14 -0.55 0.00 0.00 175.29 176.10 1dqj s GLN 90 N 0.77 3.39 -0.06 1.67 1.03 -0.68 0.13 119.66 125.90 1dqj s GLN 90 Ca -0.05 -0.29 0.09 0.00 0.04 0.00 0.00 55.36 55.15 1dqj s GLN 90 Cb -0.07 -3.09 0.14 0.00 0.03 0.00 0.00 33.01 30.03 1dqj s GLN 90 CO -0.04 0.70 1.03 -1.13 -2.54 0.00 0.00 175.29 173.31 1dqj n SER 91 N 1.28 1.63 -0.05 12.60 3.41 -0.52 -3.41 113.62 128.55 1dqj n SER 91 Ca -0.14 -2.46 -0.12 0.00 -0.26 0.00 0.00 58.87 55.90 1dqj n SER 91 Cb 0.53 -0.25 0.01 0.00 -0.26 0.00 0.00 64.21 64.24 1dqj n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1dqj h ASN 92 N 0.00 0.83 -4.73 4.04 -0.73 -1.88 -3.46 115.58 109.65 1dqj h ASN 92 Ca 0.00 -0.43 -0.25 0.00 1.87 0.00 0.00 56.30 57.49 1dqj h ASN 92 Cb 0.96 -0.24 -0.22 0.00 0.27 0.00 0.00 38.32 39.09 1dqj h ASN 92 CO 0.00 1.19 -0.73 -0.44 -0.37 0.00 0.00 177.43 177.09 1dqj s SER 93 N -6.92 0.64 0.00 1.15 0.01 -1.26 -5.14 113.70 102.19 1dqj s SER 93 Ca -0.09 -0.49 -0.17 0.00 1.31 0.00 0.00 55.95 56.51 1dqj s SER 93 Cb 0.11 0.05 -0.06 0.00 0.21 0.00 0.00 66.02 66.33 1dqj s SER 93 CO 0.87 -0.21 0.47 0.86 0.41 0.00 0.00 173.24 175.65 1dqj s TRP 94 N -1.27 3.72 0.34 2.43 -0.11 -1.26 -3.35 118.94 119.43 1dqj s TRP 94 Ca -0.11 1.07 -0.27 0.00 1.22 0.00 0.00 56.10 58.02 1dqj s TRP 94 Cb -0.09 -2.40 -0.09 0.00 -1.50 0.00 0.00 33.47 29.38 1dqj s TRP 94 CO -0.00 0.54 1.06 -1.25 -4.62 0.00 0.00 176.95 172.68 1dqj s PRO 95 N -0.79 4.42 0.46 5.86 0.04 -1.26 -4.86 135.00 138.88 1dqj s PRO 95 Ca 0.26 1.64 -0.24 0.00 0.04 0.00 0.00 61.00 62.69 1dqj s PRO 95 Cb -0.17 -2.87 -0.07 0.00 0.04 0.00 0.00 34.50 31.42 1dqj s PRO 95 CO 0.15 0.06 1.35 0.71 0.04 0.00 0.00 177.00 179.31 1dqj s TYR 96 N -1.41 2.54 0.05 0.56 4.12 -1.21 -4.47 117.35 117.53 1dqj s TYR 96 Ca 0.51 1.35 0.01 0.00 0.02 0.00 0.00 57.07 58.96 1dqj s TYR 96 Cb -0.27 -3.78 -0.03 0.00 -1.52 0.00 0.00 41.96 36.37 1dqj s TYR 96 CO 0.34 -2.59 -0.06 0.95 0.02 0.00 0.00 175.55 174.21 1dqj s THR 97 N -1.27 0.46 0.17 -0.71 -4.23 -1.22 -4.97 115.64 103.86 1dqj s THR 97 Ca 0.63 -1.36 0.07 0.00 -1.18 0.00 0.00 61.69 59.86 1dqj s THR 97 Cb -0.40 -0.93 -0.04 0.00 1.34 0.00 0.00 72.50 72.47 1dqj s THR 97 CO 0.50 -0.61 0.00 -0.36 -0.54 0.00 0.00 174.62 173.62 1dqj s PHE 98 N -2.28 2.85 0.85 3.99 0.40 -1.26 -1.69 117.98 120.85 1dqj s PHE 98 Ca -0.03 -0.13 -0.13 0.00 -0.60 0.00 0.00 56.93 56.03 1dqj s PHE 98 Cb -0.04 -1.38 0.12 0.00 0.51 0.00 0.00 43.02 42.22 1dqj s PHE 98 CO -0.02 0.52 1.22 0.20 0.70 0.00 0.00 175.22 177.83 1dqj s GLY 99 N -2.93 1.65 0.10 4.36 0.00 -0.15 -4.51 107.32 105.85 1dqj s GLY 99 Ca 0.27 -0.81 0.22 0.00 0.00 0.00 0.00 44.72 44.40 1dqj s GLY 99 CO 0.19 -0.24 1.69 0.61 0.00 0.00 0.00 173.10 175.35 1dqj n GLY 100 N -3.45 -1.31 0.00 0.20 0.00 -1.25 -4.73 105.19 94.65 1dqj n GLY 100 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1dqj n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dqj n GLY 101 N 0.59 -0.43 3.08 -0.02 0.00 -1.26 -5.03 105.19 102.12 1dqj n GLY 101 Ca 0.04 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.20 1dqj n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dqj s THR 102 N -3.01 1.13 -0.28 2.61 2.01 0.14 -4.72 115.64 113.52 1dqj s THR 102 Ca 0.00 -0.56 -0.11 0.00 0.31 0.00 0.00 61.69 61.33 1dqj s THR 102 Cb 0.00 -0.98 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 1dqj s THR 102 CO 0.00 0.34 0.21 -0.75 -0.69 0.00 0.00 174.62 173.73 1dqj s LYS 103 N 0.09 3.94 -0.40 4.92 2.47 -0.35 -0.75 119.74 129.65 1dqj s LYS 103 Ca -0.03 -0.29 -0.18 0.00 -1.56 0.00 0.00 55.97 53.91 1dqj s LYS 103 Cb -0.10 -3.66 0.01 0.00 -1.46 0.00 0.00 37.83 32.62 1dqj s LYS 103 CO 0.01 -0.20 0.46 -1.17 0.16 0.00 0.00 175.35 174.62 1dqj s LEU 104 N 1.79 4.70 0.32 5.43 0.20 0.71 -0.39 118.68 131.45 1dqj s LEU 104 Ca 0.08 -0.49 0.10 0.00 0.69 0.00 0.00 54.13 54.50 1dqj s LEU 104 Cb -0.16 -2.45 -0.06 0.00 -0.43 0.00 0.00 46.19 43.09 1dqj s LEU 104 CO 0.11 -0.56 -0.10 -1.61 -0.29 0.00 0.00 176.35 173.90 1dqj s GLU 105 N 2.24 1.86 0.06 1.98 2.02 0.14 -2.05 118.70 124.94 1dqj s GLU 105 Ca 0.14 -1.83 -0.28 0.00 0.02 0.00 0.00 54.97 53.02 1dqj s GLU 105 Cb -0.16 -1.79 -0.05 0.00 0.10 0.00 0.00 34.13 32.23 1dqj s GLU 105 CO 0.14 0.20 0.89 0.42 0.02 0.00 0.00 175.26 176.93 1dqj s ILE 106 N -2.55 4.67 0.08 -1.63 1.01 -1.26 -0.86 121.20 120.66 1dqj s ILE 106 Ca 0.32 1.90 -0.20 0.00 0.00 0.00 0.00 60.65 62.67 1dqj s ILE 106 Cb -0.01 -4.24 -0.07 0.00 0.01 0.00 0.00 42.46 38.16 1dqj s ILE 106 CO 0.17 0.30 0.60 -0.75 0.00 0.00 0.00 174.94 175.26 1dqj s LYS 107 N 0.23 4.26 0.35 2.79 2.47 0.07 -4.72 119.74 125.19 1dqj s LYS 107 Ca 0.45 0.80 -0.13 0.00 -1.56 0.00 0.00 55.97 55.53 1dqj s LYS 107 Cb -0.22 -3.25 0.03 0.00 -1.46 0.00 0.00 37.83 32.93 1dqj s LYS 107 CO 0.27 0.60 0.67 -0.98 0.16 0.00 0.00 175.35 176.06 1dqj s ARG 108 N -1.01 2.03 0.38 4.03 1.70 -1.26 -4.76 118.95 120.06 1dqj s ARG 108 Ca 0.30 -1.45 -0.26 0.00 -0.47 0.00 0.00 55.73 53.85 1dqj s ARG 108 Cb -0.20 0.56 -0.09 0.00 -0.57 0.00 0.00 34.95 34.65 1dqj s ARG 108 CO 0.20 -0.91 1.24 0.00 -1.08 0.00 0.00 175.30 174.74 1dqj s ALA 109 N -2.88 3.26 0.52 7.88 0.00 -1.26 -4.96 121.76 124.33 1dqj s ALA 109 Ca 0.20 1.11 -0.22 0.00 0.00 0.00 0.00 51.96 53.04 1dqj s ALA 109 Cb -0.04 -3.43 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1dqj s ALA 109 CO 0.13 -0.64 1.21 -0.25 0.00 0.00 0.00 175.76 176.21 1dqj n ASP 110 N 0.27 2.07 -3.76 0.00 8.00 -1.26 -4.80 116.55 117.07 1dqj n ASP 110 Ca 0.03 0.97 -0.13 0.00 0.71 0.00 0.00 54.79 56.38 1dqj n ASP 110 Cb 0.45 -1.49 -0.12 0.00 -0.02 0.00 0.00 41.12 39.93 1dqj n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dqj s ALA 111 N -1.32 -0.55 0.38 2.24 0.00 0.10 -4.90 121.76 117.71 1dqj s ALA 111 Ca 0.69 0.81 -0.24 0.00 0.00 0.00 0.00 51.96 53.23 1dqj s ALA 111 Cb -0.45 -0.50 -0.10 0.00 0.00 0.00 0.00 23.12 22.07 1dqj s ALA 111 CO 0.51 -0.15 0.98 0.00 0.00 0.00 0.00 175.76 177.11 1dqj s ALA 112 N 0.68 3.11 0.48 0.00 0.00 -1.26 -1.03 121.76 123.73 1dqj s ALA 112 Ca -0.05 0.55 -0.21 0.00 0.00 0.00 0.00 51.96 52.26 1dqj s ALA 112 Cb -0.06 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.77 1dqj s ALA 112 CO -0.04 0.02 1.04 -1.25 0.00 0.00 0.00 175.76 175.53 1dqj s PRO 113 N -2.57 3.81 -0.38 0.00 0.04 -1.26 -4.52 135.00 130.12 1dqj s PRO 113 Ca 0.57 1.39 -0.15 0.00 0.04 0.00 0.00 61.00 62.84 1dqj s PRO 113 Cb -0.17 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1dqj s PRO 113 CO 0.22 -0.43 0.34 0.99 0.04 0.00 0.00 177.00 178.16 1dqj s THR 114 N -1.94 5.20 -0.16 1.26 2.01 -0.44 -4.85 115.64 116.71 1dqj s THR 114 Ca 0.67 -0.30 -0.07 0.00 0.31 0.00 0.00 61.69 62.30 1dqj s THR 114 Cb -0.17 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 1dqj s THR 114 CO 0.21 -0.22 0.09 -0.69 -0.69 0.00 0.00 174.62 173.32 1dqj s VAL 115 N 1.90 5.02 -0.02 3.82 1.01 -1.26 -1.35 120.40 129.52 1dqj s VAL 115 Ca 0.09 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1dqj s VAL 115 Cb -0.17 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1dqj s VAL 115 CO 0.11 0.51 -0.07 -0.44 0.00 0.00 0.00 175.10 175.22 1dqj s SER 116 N -0.14 0.90 0.06 3.32 0.01 -0.33 -4.98 113.70 112.54 1dqj s SER 116 Ca 0.08 -0.13 0.08 0.00 1.31 0.00 0.00 55.95 57.29 1dqj s SER 116 Cb -0.12 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.87 1dqj s SER 116 CO 0.01 0.05 -0.22 -0.51 0.41 0.00 0.00 173.24 172.98 1dqj s ILE 117 N 0.16 2.50 -0.03 1.44 2.07 -1.26 -0.38 121.20 125.70 1dqj s ILE 117 Ca -0.02 -1.35 0.01 0.00 -1.41 0.00 0.00 60.65 57.89 1dqj s ILE 117 Cb -0.07 -2.04 0.01 0.00 0.13 0.00 0.00 42.46 40.49 1dqj s ILE 117 CO -0.00 0.30 -0.05 -0.36 -1.91 0.00 0.00 174.94 172.92 1dqj s PHE 118 N -0.91 0.67 0.83 3.50 0.40 0.17 -4.99 117.98 117.66 1dqj s PHE 118 Ca 0.14 -0.16 -0.12 0.00 -0.60 0.00 0.00 56.93 56.19 1dqj s PHE 118 Cb -0.10 -0.54 0.09 0.00 0.51 0.00 0.00 43.02 42.98 1dqj s PHE 118 CO 0.05 -0.11 1.14 -2.14 0.70 0.00 0.00 175.22 174.85 1dqj s PRO 119 N 0.47 1.78 0.58 0.24 0.02 -1.26 -1.66 135.00 135.16 1dqj s PRO 119 Ca -0.06 0.33 -0.19 0.00 0.02 0.00 0.00 61.00 61.10 1dqj s PRO 119 Cb -0.10 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1dqj s PRO 119 CO 0.00 -1.76 1.21 -2.14 -0.33 0.00 0.00 177.00 173.98 1dqj s PRO 120 N -5.35 3.06 0.59 5.54 0.02 -1.19 -4.78 135.00 132.89 1dqj s PRO 120 Ca 0.62 1.85 -0.13 0.00 0.02 0.00 0.00 61.00 63.36 1dqj s PRO 120 Cb -0.13 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.35 1dqj s PRO 120 CO 0.52 -1.14 1.02 -1.54 -0.33 0.00 0.00 177.00 175.53 1dqj s SER 121 N -1.53 6.29 0.37 2.53 1.04 -1.26 -4.93 113.70 116.20 1dqj s SER 121 Ca 0.76 1.49 0.05 0.00 0.48 0.00 0.00 55.95 58.72 1dqj s SER 121 Cb -0.31 -2.48 0.73 0.00 0.10 0.00 0.00 66.02 64.05 1dqj s SER 121 CO 0.34 -0.83 2.00 0.28 0.98 0.00 0.00 173.24 176.01 1dqj h SER 122 N 0.05 0.56 -0.49 7.02 0.02 -1.99 -2.29 113.55 116.42 1dqj h SER 122 Ca -0.45 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.42 1dqj h SER 122 Cb 1.19 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 1dqj h SER 122 CO 0.61 0.46 0.14 -0.33 -1.14 0.00 0.00 176.83 176.57 1dqj h GLU 123 N 0.64 0.77 -0.48 3.45 3.07 -1.99 -1.73 114.58 118.30 1dqj h GLU 123 Ca 0.17 -0.18 -0.13 0.00 -0.50 0.00 0.00 59.36 58.72 1dqj h GLU 123 Cb 0.02 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 1dqj h GLU 123 CO -0.03 0.74 -0.19 0.37 -1.40 0.00 0.00 179.01 178.50 1dqj h GLN 124 N 0.66 0.98 -0.90 2.33 4.15 -1.76 -2.91 115.11 117.66 1dqj h GLN 124 Ca 0.15 -0.41 -0.00 0.00 0.77 0.00 0.00 58.65 59.16 1dqj h GLN 124 Cb 0.30 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 1dqj h GLN 124 CO -0.00 1.09 0.56 -0.07 -1.93 0.00 0.00 178.83 178.48 1dqj h LEU 125 N 0.84 1.06 -1.89 -2.39 3.38 -1.29 -0.34 115.31 114.68 1dqj h LEU 125 Ca 0.11 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1dqj h LEU 125 Cb 0.77 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1dqj h LEU 125 CO 0.06 0.80 0.08 0.74 0.09 0.00 0.00 178.44 180.21 1dqj h THR 126 N 1.23 1.02 -0.18 0.22 2.02 -1.12 0.10 112.91 116.21 1dqj h THR 126 Ca 0.33 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.46 1dqj h THR 126 Cb -0.08 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1dqj h THR 126 CO -0.06 0.03 0.00 -1.54 0.37 0.00 0.00 175.52 174.31 1dqj n SER 127 N -4.52 1.71 0.00 4.18 3.41 -0.25 -4.92 113.62 113.24 1dqj n SER 127 Ca -0.01 -1.73 0.00 0.00 -0.26 0.00 0.00 58.87 56.87 1dqj n SER 127 Cb 0.09 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1dqj n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dqj n GLY 128 N 1.13 0.65 3.66 5.00 0.00 0.02 -5.05 105.19 110.61 1dqj n GLY 128 Ca 0.16 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1dqj n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dqj s GLY 129 N -2.16 2.28 -0.29 -0.02 0.00 -0.54 -1.66 107.32 104.93 1dqj s GLY 129 Ca 0.00 -2.11 0.05 0.00 0.00 0.00 0.00 44.72 42.66 1dqj s GLY 129 CO 0.00 -1.96 0.56 0.00 0.00 0.00 0.00 173.10 171.70 1dqj s ALA 130 N -2.60 -2.20 -0.15 3.20 0.00 -0.50 -2.89 121.76 116.61 1dqj s ALA 130 Ca 0.37 0.94 -0.05 0.00 0.00 0.00 0.00 51.96 53.22 1dqj s ALA 130 Cb 0.04 -2.45 -0.03 0.00 0.00 0.00 0.00 23.12 20.67 1dqj s ALA 130 CO 0.20 -1.80 0.01 -1.12 0.00 0.00 0.00 175.76 173.04 1dqj s SER 131 N 2.78 5.22 -0.21 0.00 0.01 -1.26 -0.33 113.70 119.92 1dqj s SER 131 Ca 0.10 0.01 -0.06 0.00 1.31 0.00 0.00 55.95 57.31 1dqj s SER 131 Cb -0.11 -1.81 -0.03 0.00 0.21 0.00 0.00 66.02 64.29 1dqj s SER 131 CO -0.27 0.21 0.02 -0.69 0.41 0.00 0.00 173.24 172.92 1dqj s VAL 132 N 0.15 4.06 -0.07 3.43 1.01 0.14 -3.15 120.40 125.97 1dqj s VAL 132 Ca 0.02 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1dqj s VAL 132 Cb -0.13 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1dqj s VAL 132 CO 0.02 0.41 -0.08 -0.69 0.00 0.00 0.00 175.10 174.76 1dqj s VAL 133 N 1.10 3.58 -0.08 2.92 1.01 -0.66 -0.31 120.40 127.95 1dqj s VAL 133 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.49 1dqj s VAL 133 Cb -0.14 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.80 1dqj s VAL 133 CO 0.02 0.59 -0.06 0.00 0.00 0.00 0.00 175.10 175.65 1dqj s PHE 135 N 1.44 3.22 -0.32 0.00 0.08 0.49 -0.72 117.98 122.17 1dqj s PHE 135 Ca -0.01 0.08 0.03 0.00 0.12 0.00 0.00 56.93 57.14 1dqj s PHE 135 Cb -0.13 -1.98 0.10 0.00 -0.57 0.00 0.00 43.02 40.43 1dqj s PHE 135 CO -0.04 0.24 0.05 -0.51 -0.10 0.00 0.00 175.22 174.86 1dqj s LEU 136 N -0.03 4.01 0.05 -0.37 1.02 0.45 -1.19 118.68 122.62 1dqj s LEU 136 Ca 0.05 -1.96 0.04 0.00 0.02 0.00 0.00 54.13 52.29 1dqj s LEU 136 Cb -0.12 -1.42 -0.04 0.00 0.02 0.00 0.00 46.19 44.62 1dqj s LEU 136 CO 0.01 -0.37 -0.04 0.20 0.02 0.00 0.00 176.35 176.17 1dqj s ASN 137 N 1.10 4.81 -1.07 2.29 0.01 -0.46 0.08 114.94 121.70 1dqj s ASN 137 Ca 0.09 -0.17 -0.18 0.00 -0.71 0.00 0.00 52.86 51.88 1dqj s ASN 137 Cb -0.19 -1.12 0.00 0.00 0.41 0.00 0.00 41.25 40.35 1dqj s ASN 137 CO -0.12 0.23 0.75 0.59 -1.51 0.00 0.00 177.10 177.04 1dqj n ASN 138 N 1.05 -5.33 -4.64 -1.22 4.13 -0.96 -1.33 115.26 106.97 1dqj n ASN 138 Ca -0.13 -0.97 -0.25 0.00 1.68 0.00 0.00 54.58 54.91 1dqj n ASN 138 Cb 0.52 -3.06 -0.09 0.00 -1.54 0.00 0.00 39.78 35.61 1dqj n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1dqj s PHE 139 N -3.37 2.54 -0.28 3.10 -0.71 0.32 -4.57 117.98 115.02 1dqj s PHE 139 Ca 0.37 -0.49 -0.22 0.00 -1.04 0.00 0.00 56.93 55.56 1dqj s PHE 139 Cb -0.15 -1.58 0.09 0.00 -1.21 0.00 0.00 43.02 40.17 1dqj s PHE 139 CO 0.87 0.44 0.80 -0.47 -1.34 0.00 0.00 175.22 175.52 1dqj s TYR 140 N -2.56 -0.77 1.21 3.49 6.14 -0.20 -0.43 117.35 124.23 1dqj s TYR 140 Ca 0.36 1.74 -0.20 0.00 0.64 0.00 0.00 57.07 59.61 1dqj s TYR 140 Cb 0.02 0.38 0.30 0.00 0.42 0.00 0.00 41.96 43.08 1dqj s TYR 140 CO 0.19 -0.37 1.00 -0.35 0.64 0.00 0.00 175.55 176.66 1dqj n PRO 141 N 3.07 -3.32 -0.08 4.97 -0.04 -1.26 0.00 135.00 138.34 1dqj n PRO 141 Ca -0.15 -1.62 -0.05 0.00 -0.04 0.00 0.00 63.50 61.64 1dqj n PRO 141 Cb 0.56 -1.60 0.15 0.00 -0.04 0.00 0.00 33.50 32.58 1dqj n PRO 141 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1dqj h LYS 142 N 0.00 0.72 -6.50 0.54 1.63 -1.98 -3.44 116.57 107.54 1dqj h LYS 142 Ca -0.39 -0.23 -0.53 0.00 -0.85 0.00 0.00 60.65 58.65 1dqj h LYS 142 Cb 1.20 -0.07 0.04 0.00 -0.60 0.00 0.00 32.23 32.81 1dqj h LYS 142 CO 0.25 0.81 1.09 0.16 -3.45 0.00 0.00 179.45 178.31 1dqj s ASP 143 N -6.71 6.45 -0.03 4.20 -4.77 -1.26 -4.98 116.67 109.59 1dqj s ASP 143 Ca -0.09 2.71 -0.28 0.00 -3.30 0.00 0.00 52.55 51.60 1dqj s ASP 143 Cb 0.14 -2.57 0.06 0.00 -1.09 0.00 0.00 42.92 39.47 1dqj s ASP 143 CO 0.81 -0.98 0.61 -0.51 0.70 0.00 0.00 175.17 175.80 1dqj s ILE 144 N 2.71 0.01 -0.11 2.11 2.07 -1.26 -4.61 121.20 122.12 1dqj s ILE 144 Ca 0.80 -0.08 0.02 0.00 -1.41 0.00 0.00 60.65 59.97 1dqj s ILE 144 Cb -0.45 -0.95 0.01 0.00 0.13 0.00 0.00 42.46 41.21 1dqj s ILE 144 CO 0.36 -0.05 -0.17 0.21 -1.91 0.00 0.00 174.94 173.38 1dqj s ASN 145 N -1.36 2.55 -0.16 4.50 3.84 -0.63 -4.99 114.94 118.69 1dqj s ASN 145 Ca -0.10 -0.46 -0.02 0.00 0.21 0.00 0.00 52.86 52.50 1dqj s ASN 145 Cb -0.01 -1.15 -0.01 0.00 -0.55 0.00 0.00 41.25 39.53 1dqj s ASN 145 CO 0.07 0.04 -0.10 0.54 -2.79 0.00 0.00 177.10 174.86 1dqj s VAL 146 N 0.90 3.15 -0.09 -5.21 0.11 -1.26 -0.51 120.40 117.49 1dqj s VAL 146 Ca -0.08 -0.60 0.03 0.00 -2.93 0.00 0.00 61.98 58.40 1dqj s VAL 146 Cb -0.15 -2.37 0.01 0.00 -1.53 0.00 0.00 36.38 32.34 1dqj s VAL 146 CO -0.01 0.49 -0.19 -0.75 -3.33 0.00 0.00 175.10 171.31 1dqj s LYS 147 N 0.78 2.53 -0.08 1.54 2.20 0.78 -4.97 119.74 122.52 1dqj s LYS 147 Ca -0.04 -0.70 -0.05 0.00 -0.36 0.00 0.00 55.97 54.82 1dqj s LYS 147 Cb -0.15 -1.96 -0.04 0.00 -1.51 0.00 0.00 37.83 34.17 1dqj s LYS 147 CO 0.01 0.11 0.15 -1.58 -0.36 0.00 0.00 175.35 173.69 1dqj s TRP 148 N 0.49 3.57 -0.04 4.03 0.52 -1.26 -0.49 118.94 125.77 1dqj s TRP 148 Ca -0.17 0.46 0.01 0.00 0.02 0.00 0.00 56.10 56.43 1dqj s TRP 148 Cb -0.17 -1.90 0.02 0.00 -1.15 0.00 0.00 33.47 30.27 1dqj s TRP 148 CO 0.06 0.70 -0.03 0.15 0.02 0.00 0.00 176.95 177.85 1dqj s LYS 149 N -1.36 0.66 -0.16 4.98 1.02 -0.30 -0.57 119.74 124.01 1dqj s LYS 149 Ca 0.19 -0.06 0.00 0.00 0.02 0.00 0.00 55.97 56.12 1dqj s LYS 149 Cb -0.12 -0.71 0.00 0.00 -0.52 0.00 0.00 37.83 36.48 1dqj s LYS 149 CO 0.09 -0.08 -0.15 0.42 -0.92 0.00 0.00 175.35 174.71 1dqj s ILE 150 N 0.86 2.62 -1.05 2.17 1.01 -0.16 -0.17 121.20 126.48 1dqj s ILE 150 Ca -0.11 -0.78 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 1dqj s ILE 150 Cb -0.14 -2.11 0.04 0.00 0.01 0.00 0.00 42.46 40.27 1dqj s ILE 150 CO -0.00 0.51 0.26 0.47 0.00 0.00 0.00 174.94 176.18 1dqj n ASP 151 N 4.20 -3.35 0.00 3.58 8.00 -0.15 -0.42 116.55 128.41 1dqj n ASP 151 Ca -0.19 -0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.21 1dqj n ASP 151 Cb 0.51 -2.83 0.00 0.00 -0.02 0.00 0.00 41.12 38.79 1dqj n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dqj n GLY 152 N -0.95 1.13 3.65 0.44 0.00 -1.26 -5.03 105.19 103.17 1dqj n GLY 152 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 1dqj n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dqj s SER 153 N -3.07 5.64 0.28 1.61 0.01 0.44 -5.04 113.70 113.55 1dqj s SER 153 Ca 0.00 0.11 -0.30 0.00 1.31 0.00 0.00 55.95 57.07 1dqj s SER 153 Cb 0.00 -1.93 -0.11 0.00 0.21 0.00 0.00 66.02 64.19 1dqj s SER 153 CO 0.00 0.21 1.50 -0.70 0.41 0.00 0.00 173.24 174.66 1dqj s GLU 154 N 0.18 4.20 -0.15 12.44 2.12 -1.26 -0.99 118.70 135.24 1dqj s GLU 154 Ca 0.04 2.42 0.01 0.00 0.36 0.00 0.00 54.97 57.81 1dqj s GLU 154 Cb -0.12 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.21 1dqj s GLU 154 CO 0.00 -0.50 -0.18 0.50 -0.54 0.00 0.00 175.26 174.54 1dqj s ARG 155 N -0.55 3.12 -0.20 4.30 6.06 0.27 -4.90 118.95 127.05 1dqj s ARG 155 Ca 0.60 -0.79 -0.06 0.00 -2.50 0.00 0.00 55.73 52.98 1dqj s ARG 155 Cb -0.44 -2.56 -0.10 0.00 0.06 0.00 0.00 34.95 31.90 1dqj s ARG 155 CO 0.46 -0.03 -0.23 1.04 -2.50 0.00 0.00 175.30 174.04 1dqj n GLN 156 N 4.14 0.45 -2.16 5.12 3.00 -1.26 -4.31 117.38 122.36 1dqj n GLN 156 Ca -0.20 0.16 -0.40 0.00 -0.01 0.00 0.00 57.00 56.56 1dqj n GLN 156 Cb 0.51 -1.28 -0.02 0.00 0.00 0.00 0.00 30.24 29.45 1dqj n GLN 156 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 1dqj s ASN 157 N -6.52 6.61 0.00 1.08 0.01 -1.26 -3.12 114.94 111.74 1dqj s ASN 157 Ca -0.28 2.57 0.00 0.00 -0.71 0.00 0.00 52.86 54.45 1dqj s ASN 157 Cb 0.10 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 39.12 1dqj s ASN 157 CO 0.39 -0.64 0.00 0.61 -1.51 0.00 0.00 177.10 175.95 1dqj n GLY 158 N 0.75 0.80 3.69 0.66 0.00 -1.26 -4.90 105.19 104.94 1dqj n GLY 158 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1dqj n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dqj s VAL 159 N -3.15 5.35 -0.05 1.61 1.01 -1.18 -1.17 120.40 122.82 1dqj s VAL 159 Ca 0.00 0.29 0.03 0.00 0.00 0.00 0.00 61.98 62.30 1dqj s VAL 159 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1dqj s VAL 159 CO 0.00 0.37 -0.14 -0.76 0.00 0.00 0.00 175.10 174.57 1dqj s LEU 160 N 0.78 1.82 0.20 3.92 1.43 -0.43 -4.98 118.68 121.41 1dqj s LEU 160 Ca 0.10 -0.31 0.10 0.00 -1.03 0.00 0.00 54.13 52.99 1dqj s LEU 160 Cb -0.13 -0.86 -0.04 0.00 0.03 0.00 0.00 46.19 45.19 1dqj s LEU 160 CO 0.03 0.10 -0.17 0.20 0.23 0.00 0.00 176.35 176.74 1dqj s ASN 161 N 0.24 3.81 -0.03 2.29 0.01 -1.26 -0.98 114.94 119.02 1dqj s ASN 161 Ca -0.07 -0.76 -0.01 0.00 -0.71 0.00 0.00 52.86 51.31 1dqj s ASN 161 Cb -0.12 -0.46 0.02 0.00 0.41 0.00 0.00 41.25 41.10 1dqj s ASN 161 CO 0.02 0.10 0.07 -0.55 -1.51 0.00 0.00 177.10 175.24 1dqj s SER 162 N -2.83 -0.02 -0.02 -1.22 0.15 -0.21 -5.00 113.70 104.54 1dqj s SER 162 Ca 0.23 0.13 0.08 0.00 0.70 0.00 0.00 55.95 57.09 1dqj s SER 162 Cb -0.08 0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.27 1dqj s SER 162 CO 0.13 -0.10 -0.25 0.26 1.20 0.00 0.00 173.24 174.48 1dqj s TRP 163 N 0.73 2.37 0.51 3.44 0.51 -1.26 -1.13 118.94 124.11 1dqj s TRP 163 Ca -0.06 -0.41 -0.03 0.00 -2.12 0.00 0.00 56.10 53.48 1dqj s TRP 163 Cb -0.08 -1.51 -0.00 0.00 -0.81 0.00 0.00 33.47 31.06 1dqj s TRP 163 CO -0.03 -0.01 0.79 0.95 -0.51 0.00 0.00 176.95 178.14 1dqj s THR 164 N -0.63 4.03 0.71 2.01 -4.23 -1.01 -5.04 115.64 111.48 1dqj s THR 164 Ca 0.10 -0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 60.34 1dqj s THR 164 Cb -0.10 -3.54 0.02 0.00 1.34 0.00 0.00 72.50 70.22 1dqj s THR 164 CO -0.01 -0.48 1.07 -1.81 -0.54 0.00 0.00 174.62 172.85 1dqj s ASP 165 N -4.23 5.31 -0.04 3.99 1.01 -1.26 -4.60 116.67 116.86 1dqj s ASP 165 Ca 0.50 1.44 -0.38 0.00 0.71 0.00 0.00 52.55 54.83 1dqj s ASP 165 Cb -0.10 -2.30 -0.16 0.00 1.01 0.00 0.00 42.92 41.36 1dqj s ASP 165 CO 0.42 -1.46 1.49 1.67 0.21 0.00 0.00 175.17 177.50 1dqj n GLN 166 N -3.12 1.19 -1.68 8.23 7.27 -1.26 -4.77 117.38 123.25 1dqj n GLN 166 Ca 0.07 0.43 -0.47 0.00 0.07 0.00 0.00 57.00 57.10 1dqj n GLN 166 Cb 0.55 -2.10 -0.04 0.00 2.41 0.00 0.00 30.24 31.06 1dqj n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1dqj n ASP 167 N 3.57 3.55 0.17 1.69 4.64 0.13 -4.89 116.55 125.41 1dqj n ASP 167 Ca 0.21 0.97 0.06 0.00 -1.38 0.00 0.00 54.79 54.66 1dqj n ASP 167 Cb 0.17 -1.41 0.55 0.00 -1.04 0.00 0.00 41.12 39.39 1dqj n ASP 167 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1dqj h SER 168 N 9.04 0.16 0.01 1.67 0.02 -1.89 0.23 113.55 122.79 1dqj h SER 168 Ca -0.48 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.26 1dqj h SER 168 Cb 1.26 -0.04 0.02 0.00 0.14 0.00 0.00 62.40 63.78 1dqj h SER 168 CO 0.94 0.15 -0.80 0.11 -1.14 0.00 0.00 176.83 176.09 1dqj h LYS 169 N 0.19 0.53 0.00 3.45 1.57 -1.97 -3.41 116.57 116.93 1dqj h LYS 169 Ca 0.05 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1dqj h LYS 169 Cb 0.03 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1dqj h LYS 169 CO -0.01 1.20 0.00 -0.40 -0.57 0.00 0.00 179.45 179.68 1dqj n ASP 170 N -4.06 0.39 -0.89 0.86 5.68 -1.20 -5.02 116.55 112.31 1dqj n ASP 170 Ca -0.11 -1.15 -0.12 0.00 -0.50 0.00 0.00 54.79 52.91 1dqj n ASP 170 Cb 0.77 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.70 1dqj n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1dqj n SER 171 N -0.08 -4.79 -4.31 -1.12 7.64 0.81 -4.99 113.62 106.79 1dqj n SER 171 Ca 0.00 0.29 -0.20 0.00 1.01 0.00 0.00 58.87 59.97 1dqj n SER 171 Cb 0.35 -3.31 0.10 0.00 -1.01 0.00 0.00 64.21 60.34 1dqj n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1dqj n THR 172 N -2.53 0.00 -4.32 0.44 -2.24 -1.26 -4.59 114.28 99.77 1dqj n THR 172 Ca -0.12 -1.45 -0.23 0.00 -2.27 0.00 0.00 64.05 59.99 1dqj n THR 172 Cb 0.45 -0.89 -0.12 0.00 -2.10 0.00 0.00 70.33 67.67 1dqj n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1dqj s TYR 173 N -2.64 1.83 0.08 4.78 2.02 0.43 0.21 117.35 124.07 1dqj s TYR 173 Ca 0.58 -0.45 0.03 0.00 -0.37 0.00 0.00 57.07 56.86 1dqj s TYR 173 Cb -0.03 -0.95 -0.03 0.00 -0.40 0.00 0.00 41.96 40.54 1dqj s TYR 173 CO 0.38 0.29 -0.08 -1.12 -1.57 0.00 0.00 175.55 173.45 1dqj s SER 174 N -2.40 1.17 -0.01 2.29 0.01 -1.26 -0.52 113.70 112.98 1dqj s SER 174 Ca 0.13 -0.80 -0.12 0.00 1.31 0.00 0.00 55.95 56.46 1dqj s SER 174 Cb -0.07 0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.22 1dqj s SER 174 CO 0.06 -0.32 0.25 -0.32 0.41 0.00 0.00 173.24 173.32 1dqj s MET 175 N -2.80 0.60 -0.06 12.44 1.75 0.11 -2.40 119.30 128.94 1dqj s MET 175 Ca 0.03 -0.27 0.03 0.00 -1.25 0.00 0.00 55.69 54.23 1dqj s MET 175 Cb -0.02 0.26 0.01 0.00 2.84 0.00 0.00 34.83 37.92 1dqj s MET 175 CO -0.02 -0.16 -0.15 0.45 -0.65 0.00 0.00 175.02 174.50 1dqj s SER 176 N -1.35 1.99 -0.09 1.11 0.15 -0.28 -0.41 113.70 114.82 1dqj s SER 176 Ca -0.14 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.19 1dqj s SER 176 Cb -0.06 -0.77 0.02 0.00 -1.71 0.00 0.00 66.02 63.49 1dqj s SER 176 CO 0.03 0.09 -0.13 -0.55 1.20 0.00 0.00 173.24 173.88 1dqj s SER 177 N 0.39 2.13 -0.08 5.45 0.15 0.10 -1.04 113.70 120.80 1dqj s SER 177 Ca -0.11 -0.36 0.03 0.00 0.70 0.00 0.00 55.95 56.22 1dqj s SER 177 Cb -0.14 -0.95 0.01 0.00 -1.71 0.00 0.00 66.02 63.23 1dqj s SER 177 CO 0.04 0.01 -0.18 -0.89 1.20 0.00 0.00 173.24 173.42 1dqj s THR 178 N 0.93 1.56 -0.30 6.45 2.01 -0.15 -0.43 115.64 125.72 1dqj s THR 178 Ca -0.09 -0.73 -0.08 0.00 0.31 0.00 0.00 61.69 61.10 1dqj s THR 178 Cb -0.15 -1.38 -0.00 0.00 0.01 0.00 0.00 72.50 70.97 1dqj s THR 178 CO 0.00 0.45 0.11 -0.22 -0.69 0.00 0.00 174.62 174.27 1dqj s LEU 179 N 0.54 3.94 -0.23 4.42 2.96 0.57 -1.32 118.68 129.57 1dqj s LEU 179 Ca -0.16 -0.59 -0.07 0.00 -0.22 0.00 0.00 54.13 53.09 1dqj s LEU 179 Cb -0.17 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 1dqj s LEU 179 CO 0.06 -0.18 0.05 -0.89 -1.32 0.00 0.00 176.35 174.06 1dqj s THR 180 N 1.56 4.27 0.35 3.68 2.01 -0.32 0.27 115.64 127.46 1dqj s THR 180 Ca 0.04 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.88 1dqj s THR 180 Cb -0.17 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 1dqj s THR 180 CO 0.04 0.38 0.10 -0.76 -0.69 0.00 0.00 174.62 173.69 1dqj s LEU 181 N 1.28 2.00 0.57 4.42 1.43 0.55 -4.72 118.68 124.21 1dqj s LEU 181 Ca 0.04 -1.52 -0.04 0.00 -1.03 0.00 0.00 54.13 51.58 1dqj s LEU 181 Cb -0.15 -0.18 0.01 0.00 0.03 0.00 0.00 46.19 45.90 1dqj s LEU 181 CO 0.03 -0.78 0.85 0.42 0.23 0.00 0.00 176.35 177.09 1dqj s THR 182 N -3.33 3.57 0.24 5.49 -4.23 -1.26 -1.42 115.64 114.71 1dqj s THR 182 Ca 0.31 -0.17 -0.06 0.00 -1.18 0.00 0.00 61.69 60.59 1dqj s THR 182 Cb 0.06 -3.40 0.24 0.00 1.34 0.00 0.00 72.50 70.74 1dqj s THR 182 CO 0.15 -0.37 1.91 0.50 -0.54 0.00 0.00 174.62 176.27 1dqj h LYS 183 N -0.07 1.23 -0.17 3.99 3.64 -1.51 -1.72 116.57 121.97 1dqj h LYS 183 Ca -0.45 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1dqj h LYS 183 Cb 1.26 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1dqj h LYS 183 CO 0.59 0.81 0.11 -0.44 -2.27 0.00 0.00 179.45 178.25 1dqj h ASP 184 N 1.27 0.20 0.29 4.20 3.45 -1.93 -0.86 116.42 123.03 1dqj h ASP 184 Ca 0.36 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.79 1dqj h ASP 184 Cb -0.11 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1dqj h ASP 184 CO -0.09 0.16 -0.20 -0.33 -1.57 0.00 0.00 179.24 177.21 1dqj h GLU 185 N 0.21 -0.47 -0.64 3.56 5.08 -1.88 -2.33 114.58 118.11 1dqj h GLU 185 Ca 0.06 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.58 1dqj h GLU 185 Cb -0.00 0.11 -0.10 0.00 0.50 0.00 0.00 28.75 29.26 1dqj h GLU 185 CO -0.01 -0.31 0.10 -0.92 -1.00 0.00 0.00 179.01 176.86 1dqj h TYR 186 N -0.49 0.14 0.00 4.33 3.20 -1.17 -0.16 116.97 122.82 1dqj h TYR 186 Ca -0.02 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1dqj h TYR 186 Cb 0.42 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.73 1dqj h TYR 186 CO -0.11 -0.09 0.00 0.39 -1.64 0.00 0.00 178.16 176.71 1dqj n GLU 187 N -5.19 0.30 0.09 1.82 1.02 -0.34 -2.63 120.64 115.71 1dqj n GLU 187 Ca 0.10 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.44 1dqj n GLU 187 Cb 0.37 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.48 1dqj n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dqj h ARG 188 N 0.00 0.00 -5.75 3.49 3.08 -0.47 -3.47 114.38 111.26 1dqj h ARG 188 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1dqj h ARG 188 Cb 0.22 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.14 1dqj h ARG 188 CO 0.00 0.00 -0.60 -1.01 -1.07 0.00 0.00 179.97 177.29 1dqj s HIS 189 N -3.19 2.51 -0.04 3.04 3.76 -1.08 -5.10 115.29 115.20 1dqj s HIS 189 Ca 0.06 -0.62 -0.06 0.00 -0.15 0.00 0.00 55.06 54.29 1dqj s HIS 189 Cb 0.12 -1.72 -0.03 0.00 1.11 0.00 0.00 32.58 32.06 1dqj s HIS 189 CO 0.70 0.44 -0.12 -1.71 -0.85 0.00 0.00 174.74 173.21 1dqj n ASN 190 N -0.97 1.10 -4.74 1.40 5.15 -1.26 -4.77 115.26 111.17 1dqj n ASN 190 Ca -0.05 0.17 -0.37 0.00 -0.60 0.00 0.00 54.58 53.73 1dqj n ASN 190 Cb 0.66 -0.40 -0.07 0.00 -0.53 0.00 0.00 39.78 39.45 1dqj n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1dqj s SER 191 N -5.93 6.55 -0.13 1.20 1.04 -1.26 -1.17 113.70 114.00 1dqj s SER 191 Ca -0.12 0.64 0.02 0.00 0.48 0.00 0.00 55.95 56.98 1dqj s SER 191 Cb 0.03 -2.22 0.01 0.00 0.10 0.00 0.00 66.02 63.95 1dqj s SER 191 CO 0.16 0.09 -0.17 -0.31 0.98 0.00 0.00 173.24 173.99 1dqj s TYR 192 N 0.36 2.25 -0.03 5.02 1.51 -0.61 -0.97 117.35 124.89 1dqj s TYR 192 Ca 0.20 -1.13 0.05 0.00 -1.01 0.00 0.00 57.07 55.19 1dqj s TYR 192 Cb -0.14 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.11 1dqj s TYR 192 CO 0.07 -0.56 -0.17 0.99 -1.11 0.00 0.00 175.55 174.77 1dqj s THR 193 N 1.00 1.41 -0.27 -0.71 2.01 0.76 -2.35 115.64 117.49 1dqj s THR 193 Ca -0.05 -0.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.19 1dqj s THR 193 Cb -0.15 -1.19 0.03 0.00 0.01 0.00 0.00 72.50 71.20 1dqj s THR 193 CO -0.03 0.40 -0.02 0.00 -0.69 0.00 0.00 174.62 174.28 1dqj s GLU 195 N 1.34 3.31 -0.19 0.00 2.02 0.35 -1.56 118.70 123.97 1dqj s GLU 195 Ca -0.01 -0.69 -0.02 0.00 0.02 0.00 0.00 54.97 54.28 1dqj s GLU 195 Cb -0.17 -2.76 -0.00 0.00 0.10 0.00 0.00 34.13 31.30 1dqj s GLU 195 CO -0.03 -0.01 -0.10 0.00 0.02 0.00 0.00 175.26 175.14 1dqj s ALA 196 N 0.93 2.64 -0.20 5.21 0.00 0.20 -0.15 121.76 130.39 1dqj s ALA 196 Ca -0.02 -1.14 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 1dqj s ALA 196 Cb -0.15 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.47 1dqj s ALA 196 CO -0.01 -0.30 0.04 0.99 0.00 0.00 0.00 175.76 176.48 1dqj s THR 197 N 1.25 4.35 0.04 0.00 2.01 0.33 -0.45 115.64 123.15 1dqj s THR 197 Ca 0.03 -0.18 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 1dqj s THR 197 Cb -0.14 -2.97 -0.02 0.00 0.01 0.00 0.00 72.50 69.38 1dqj s THR 197 CO -0.05 0.42 0.06 -2.28 -0.69 0.00 0.00 174.62 172.09 1dqj s HIS 198 N 0.87 0.24 0.55 4.92 2.46 -1.26 -1.60 115.29 121.47 1dqj s HIS 198 Ca 0.02 -0.57 0.30 0.00 0.47 0.00 0.00 55.06 55.29 1dqj s HIS 198 Cb -0.14 -0.18 1.46 0.00 -0.13 0.00 0.00 32.58 33.60 1dqj s HIS 198 CO 0.02 -0.34 1.90 -0.22 -2.47 0.00 0.00 174.74 173.64 1dqj h LYS 199 N 3.76 0.00 0.00 2.88 3.64 -1.94 -2.30 116.57 122.61 1dqj h LYS 199 Ca -0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1dqj h LYS 199 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1dqj h LYS 199 CO 0.51 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.94 1dqj n THR 200 N -4.13 0.40 -3.64 1.00 -2.24 -1.26 -4.73 114.28 99.68 1dqj n THR 200 Ca 0.14 0.10 -0.09 0.00 -2.27 0.00 0.00 64.05 61.93 1dqj n THR 200 Cb 0.83 -0.92 -0.07 0.00 -2.10 0.00 0.00 70.33 68.08 1dqj n THR 200 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1dqj s SER 201 N -2.32 -0.47 0.44 3.42 1.04 -0.87 -4.98 113.70 109.97 1dqj s SER 201 Ca 0.14 0.90 0.24 0.00 0.48 0.00 0.00 55.95 57.71 1dqj s SER 201 Cb 0.08 0.93 0.87 0.00 0.10 0.00 0.00 66.02 68.00 1dqj s SER 201 CO 0.16 -0.15 1.80 0.71 0.98 0.00 0.00 173.24 176.73 1dqj h THR 202 N 3.70 0.50 -3.31 2.02 1.35 -1.85 -3.40 112.91 111.92 1dqj h THR 202 Ca -0.28 -1.14 -0.60 0.00 -0.55 0.00 0.00 66.41 63.84 1dqj h THR 202 Cb 1.18 1.80 -0.11 0.00 -1.73 0.00 0.00 68.15 69.28 1dqj h THR 202 CO 0.11 0.21 -0.41 -0.94 -0.25 0.00 0.00 175.52 174.24 1dqj s SER 203 N -6.17 6.31 0.45 5.36 1.04 -1.26 -5.04 113.70 114.38 1dqj s SER 203 Ca 0.01 0.35 -0.24 0.00 0.48 0.00 0.00 55.95 56.55 1dqj s SER 203 Cb 0.10 -2.14 -0.08 0.00 0.10 0.00 0.00 66.02 64.01 1dqj s SER 203 CO 0.64 0.13 1.21 -2.16 0.98 0.00 0.00 173.24 174.04 1dqj s PRO 204 N 0.49 3.79 0.02 4.02 0.04 -1.26 -4.88 135.00 137.22 1dqj s PRO 204 Ca 0.12 1.91 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 1dqj s PRO 204 Cb -0.12 -2.51 -0.04 0.00 0.04 0.00 0.00 34.50 31.87 1dqj s PRO 204 CO 0.01 -0.57 1.01 0.42 0.04 0.00 0.00 177.00 177.92 1dqj s ILE 205 N -1.43 4.70 -0.15 0.56 1.01 0.40 -4.85 121.20 121.43 1dqj s ILE 205 Ca 0.62 1.97 0.02 0.00 0.00 0.00 0.00 60.65 63.26 1dqj s ILE 205 Cb -0.32 -4.26 0.02 0.00 0.01 0.00 0.00 42.46 37.90 1dqj s ILE 205 CO 0.40 0.17 -0.19 -0.69 0.00 0.00 0.00 174.94 174.63 1dqj s VAL 206 N 0.87 1.88 -0.08 2.92 1.01 -1.26 -0.62 120.40 125.11 1dqj s VAL 206 Ca 0.52 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.70 1dqj s VAL 206 Cb -0.23 -1.69 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 1dqj s VAL 206 CO 0.29 0.51 -0.23 -0.54 0.00 0.00 0.00 175.10 175.13 1dqj s LYS 207 N 1.11 2.76 0.31 2.72 -0.14 -0.60 -5.01 119.74 120.88 1dqj s LYS 207 Ca -0.01 -0.84 -0.12 0.00 -1.36 0.00 0.00 55.97 53.64 1dqj s LYS 207 Cb -0.14 -2.16 0.01 0.00 -1.68 0.00 0.00 37.83 33.86 1dqj s LYS 207 CO -0.07 0.23 0.57 0.45 -0.76 0.00 0.00 175.35 175.77 1dqj s SER 208 N 0.21 0.18 0.03 2.83 0.15 -1.26 -0.72 113.70 115.12 1dqj s SER 208 Ca -0.14 -1.09 -0.28 0.00 0.70 0.00 0.00 55.95 55.15 1dqj s SER 208 Cb -0.16 0.68 0.07 0.00 -1.71 0.00 0.00 66.02 64.90 1dqj s SER 208 CO 0.07 -1.32 0.67 0.72 1.20 0.00 0.00 173.24 174.57 1dqj s PHE 209 N -3.39 -0.59 -0.00 3.44 -0.12 -0.99 -5.02 117.98 111.31 1dqj s PHE 209 Ca 0.22 0.75 0.08 0.00 -0.05 0.00 0.00 56.93 57.92 1dqj s PHE 209 Cb -0.02 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.82 1dqj s PHE 209 CO 0.12 -0.70 -0.25 -0.80 -0.05 0.00 0.00 175.22 173.55 1dqj s ASN 210 N -1.88 3.22 0.45 1.98 0.01 -1.26 -1.57 114.94 115.90 1dqj s ASN 210 Ca -0.05 -0.48 0.25 0.00 -0.71 0.00 0.00 52.86 51.88 1dqj s ASN 210 Cb -0.00 -0.39 0.72 0.00 0.41 0.00 0.00 41.25 41.99 1dqj s ASN 210 CO -0.01 0.30 1.74 0.03 -1.51 0.00 0.00 177.10 177.66 1dqj h ARG 211 N 5.22 0.00 0.00 -0.60 3.08 -1.44 -2.95 114.38 117.70 1dqj h ARG 211 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1dqj h ARG 211 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1dqj h ARG 211 CO 0.46 0.12 0.00 0.27 -1.07 0.00 0.00 179.97 179.75 1dqj n ASN 212 N -3.18 0.00 -1.49 7.04 0.23 -1.26 -4.75 115.26 111.85 1dqj n ASN 212 Ca 0.02 -0.55 -0.03 0.00 -0.53 0.00 0.00 54.58 53.48 1dqj n ASN 212 Cb 0.47 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.17 1dqj n ASN 212 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1dqj n GLU 213 N -0.93 0.20 0.00 -3.83 0.28 -1.11 -5.25 120.64 110.00 1dqj n GLU 213 Ca 0.10 -0.67 0.00 0.00 -0.16 0.00 0.00 57.16 56.43 1dqj n GLU 213 Cb 0.05 0.68 0.00 0.00 1.43 0.00 0.00 31.44 33.60 1dqj n GLU 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97