#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oqj s VAL 2 N 0.00 2.42 0.04 2.62 1.01 -1.26 -4.63 120.40 120.60 2oqj s VAL 2 Ca 0.00 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.11 2oqj s VAL 2 Cb 0.00 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 2oqj s VAL 2 CO 0.00 0.00 -0.07 -1.10 0.00 0.00 0.00 175.10 173.94 2oqj s GLN 3 N 2.10 0.48 0.02 2.72 -0.21 -0.62 -4.98 119.66 119.16 2oqj s GLN 3 Ca 0.77 -0.72 0.02 0.00 0.02 0.00 0.00 55.36 55.46 2oqj s GLN 3 Cb -0.46 -0.20 -0.01 0.00 1.00 0.00 0.00 33.01 33.33 2oqj s GLN 3 CO 0.34 0.03 -0.07 -0.51 -2.12 0.00 0.00 175.29 172.96 2oqj s LEU 4 N -1.53 2.13 -0.10 2.90 1.02 -1.26 -0.69 118.68 121.14 2oqj s LEU 4 Ca -0.11 -0.32 -0.03 0.00 0.02 0.00 0.00 54.13 53.69 2oqj s LEU 4 Cb -0.10 -0.22 0.04 0.00 0.02 0.00 0.00 46.19 45.93 2oqj s LEU 4 CO 0.00 -0.07 0.05 0.54 0.02 0.00 0.00 176.35 176.89 2oqj s VAL 5 N -0.73 0.14 0.30 -1.59 0.11 0.02 -4.14 120.40 114.51 2oqj s VAL 5 Ca -0.04 0.04 -0.19 0.00 -2.93 0.00 0.00 61.98 58.87 2oqj s VAL 5 Cb -0.06 -0.50 -0.09 0.00 -1.53 0.00 0.00 36.38 34.20 2oqj s VAL 5 CO 0.00 0.04 0.79 -1.61 -3.33 0.00 0.00 175.10 170.99 2oqj s GLU 6 N 2.05 4.19 0.07 1.54 8.01 -1.26 -1.49 118.70 131.81 2oqj s GLU 6 Ca 0.03 0.88 -0.05 0.00 0.01 0.00 0.00 54.97 55.84 2oqj s GLU 6 Cb -0.14 -2.59 -0.02 0.00 -4.31 0.00 0.00 34.13 27.08 2oqj s GLU 6 CO -0.06 0.22 0.08 -1.54 0.01 0.00 0.00 175.26 173.97 2oqj s SER 7 N -1.98 0.30 0.00 -0.19 1.04 0.11 -4.82 113.70 108.16 2oqj s SER 7 Ca 0.51 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 56.13 2oqj s SER 7 Cb -0.13 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2oqj s SER 7 CO 0.19 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.36 2oqj n GLY 8 N 0.07 1.36 2.03 7.32 0.00 -1.26 -1.10 105.19 113.61 2oqj n GLY 8 Ca -0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 2oqj n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oqj n GLY 9 N -0.58 -3.27 0.00 -0.02 0.00 -1.26 -4.72 105.19 95.34 2oqj n GLY 9 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2oqj n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oqj n GLY 10 N -2.75 0.89 3.69 -0.02 0.00 0.15 -4.99 105.19 102.16 2oqj n GLY 10 Ca 0.09 -1.96 -0.35 0.00 0.00 0.00 0.00 46.02 43.79 2oqj n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqj s LEU 11 N 0.00 3.89 0.13 0.99 1.02 -1.26 -1.77 118.68 121.67 2oqj s LEU 11 Ca 0.00 0.17 0.10 0.00 0.02 0.00 0.00 54.13 54.42 2oqj s LEU 11 Cb 0.00 -1.96 -0.04 0.00 0.02 0.00 0.00 46.19 44.21 2oqj s LEU 11 CO 0.00 0.25 -0.25 -0.69 0.02 0.00 0.00 176.35 175.68 2oqj s VAL 12 N -0.09 2.08 0.40 -1.59 1.01 -0.85 -4.99 120.40 116.37 2oqj s VAL 12 Ca 0.07 -1.71 -0.08 0.00 0.00 0.00 0.00 61.98 60.26 2oqj s VAL 12 Cb -0.12 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 2oqj s VAL 12 CO 0.01 0.02 0.72 -0.54 0.00 0.00 0.00 175.10 175.32 2oqj s LYS 13 N -2.06 3.68 0.29 2.72 1.02 -1.26 -1.46 119.74 122.67 2oqj s LYS 13 Ca 0.12 0.29 -0.30 0.00 0.02 0.00 0.00 55.97 56.10 2oqj s LYS 13 Cb -0.10 -2.44 -0.13 0.00 -0.52 0.00 0.00 37.83 34.64 2oqj s LYS 13 CO 0.06 -0.02 1.37 0.00 -0.92 0.00 0.00 175.35 175.83 2oqj n ALA 14 N -1.48 1.30 0.00 5.17 0.00 -1.10 -1.22 120.51 123.18 2oqj n ALA 14 Ca 0.01 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2oqj n ALA 14 Cb 0.54 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2oqj n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oqj n GLY 15 N 1.56 3.13 3.60 0.00 0.00 0.02 -4.63 105.19 108.86 2oqj n GLY 15 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2oqj n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oqj s GLY 16 N -1.92 1.59 0.11 -0.02 0.00 -0.36 -3.45 107.32 103.27 2oqj s GLY 16 Ca 0.00 -0.98 0.10 0.00 0.00 0.00 0.00 44.72 43.84 2oqj s GLY 16 CO 0.00 -0.09 -0.26 -0.56 0.00 0.00 0.00 173.10 172.20 2oqj s SER 17 N -3.94 3.15 -0.17 1.64 0.01 -1.26 -2.63 113.70 110.49 2oqj s SER 17 Ca 0.71 -0.71 -0.12 0.00 1.31 0.00 0.00 55.95 57.14 2oqj s SER 17 Cb -0.09 -0.21 0.05 0.00 0.21 0.00 0.00 66.02 65.98 2oqj s SER 17 CO 0.56 0.17 0.42 -0.22 0.41 0.00 0.00 173.24 174.58 2oqj s LEU 18 N -1.91 0.08 -0.15 2.44 2.96 -0.33 -4.99 118.68 116.78 2oqj s LEU 18 Ca 0.12 0.89 -0.00 0.00 -0.22 0.00 0.00 54.13 54.93 2oqj s LEU 18 Cb -0.10 1.42 -0.01 0.00 0.50 0.00 0.00 46.19 48.00 2oqj s LEU 18 CO 0.05 -0.18 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.14 2oqj s ILE 19 N 0.92 2.83 0.11 6.68 1.01 -1.26 -0.16 121.20 131.33 2oqj s ILE 19 Ca -0.06 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.91 2oqj s ILE 19 Cb -0.06 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 2oqj s ILE 19 CO -0.07 0.51 0.09 -0.76 0.00 0.00 0.00 174.94 174.71 2oqj s LEU 20 N 0.68 3.77 0.04 2.97 1.43 0.25 -4.66 118.68 123.16 2oqj s LEU 20 Ca -0.07 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 2oqj s LEU 20 Cb -0.16 -2.43 -0.02 0.00 0.03 0.00 0.00 46.19 43.61 2oqj s LEU 20 CO 0.02 0.14 -0.08 -0.94 0.23 0.00 0.00 176.35 175.72 2oqj s SER 21 N -2.60 0.94 -0.05 2.29 1.04 -0.26 -0.19 113.70 114.86 2oqj s SER 21 Ca 0.29 -0.54 0.04 0.00 0.48 0.00 0.00 55.95 56.22 2oqj s SER 21 Cb -0.11 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.03 2oqj s SER 21 CO 0.22 -0.18 -0.16 0.00 0.98 0.00 0.00 173.24 174.10 2oqj s GLY 23 N 0.23 0.89 0.30 0.00 0.00 -0.55 -0.61 107.32 107.59 2oqj s GLY 23 Ca -0.08 -0.86 0.09 0.00 0.00 0.00 0.00 44.72 43.87 2oqj s GLY 23 CO 0.03 -0.79 0.03 -1.34 0.00 0.00 0.00 173.10 171.03 2oqj s VAL 24 N -0.68 3.08 -0.03 1.40 -7.23 -1.23 -0.80 120.40 114.91 2oqj s VAL 24 Ca 0.05 -1.90 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2oqj s VAL 24 Cb -0.08 -2.84 0.03 0.00 0.56 0.00 0.00 36.38 34.05 2oqj s VAL 24 CO 0.01 -0.28 0.00 -0.55 -0.31 0.00 0.00 175.10 173.97 2oqj s SER 25 N -3.72 0.36 -1.11 4.85 0.15 0.13 -4.87 113.70 109.49 2oqj s SER 25 Ca 0.34 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.97 2oqj s SER 25 Cb -0.04 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 2oqj s SER 25 CO 0.20 -0.09 0.00 0.59 1.20 0.00 0.00 173.24 175.14 2oqj n ASN 26 N 4.05 -4.03 -3.69 5.45 3.02 -1.26 -1.58 115.26 117.22 2oqj n ASN 26 Ca -0.26 0.10 -0.06 0.00 -0.03 0.00 0.00 54.58 54.33 2oqj n ASN 26 Cb 0.51 -3.01 -0.02 0.00 -0.61 0.00 0.00 39.78 36.65 2oqj n ASN 26 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2oqj s PHE 27 N -2.54 -0.22 -0.16 3.10 -0.71 -1.26 -4.67 117.98 111.51 2oqj s PHE 27 Ca 0.00 -0.06 -0.06 0.00 -1.04 0.00 0.00 56.93 55.77 2oqj s PHE 27 Cb 0.00 0.62 -0.03 0.00 -1.21 0.00 0.00 43.02 42.40 2oqj s PHE 27 CO 0.00 -0.82 0.02 1.03 -1.34 0.00 0.00 175.22 174.11 2oqj s ARG 28 N -3.37 3.79 0.40 1.99 1.81 -1.26 -4.96 118.95 117.35 2oqj s ARG 28 Ca 0.10 -0.42 0.22 0.00 -1.72 0.00 0.00 55.73 53.91 2oqj s ARG 28 Cb -0.02 -3.06 0.68 0.00 -0.45 0.00 0.00 34.95 32.09 2oqj s ARG 28 CO -0.01 0.30 1.72 -0.84 -0.68 0.00 0.00 175.30 175.79 2oqj h ILE 29 N 4.93 0.60 0.00 1.52 3.07 -1.93 -3.24 117.51 122.45 2oqj h ILE 29 Ca -0.36 -1.38 0.00 0.00 1.55 0.00 0.00 64.86 64.68 2oqj h ILE 29 Cb 1.18 1.94 0.00 0.00 -0.27 0.00 0.00 36.82 39.67 2oqj h ILE 29 CO 0.66 0.27 0.19 -1.54 -1.05 0.00 0.00 178.15 176.69 2oqj n SER 30 N -3.34 0.41 0.04 2.16 3.41 -1.26 -0.17 113.62 114.87 2oqj n SER 30 Ca 0.01 0.63 0.12 0.00 -0.26 0.00 0.00 58.87 59.36 2oqj n SER 30 Cb 0.51 -0.62 0.17 0.00 -0.26 0.00 0.00 64.21 64.01 2oqj n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oqj n ALA 31 N -1.64 3.09 -2.64 7.33 0.00 -1.22 -4.69 120.51 120.74 2oqj n ALA 31 Ca -0.01 -0.29 -0.20 0.00 0.00 0.00 0.00 53.44 52.94 2oqj n ALA 31 Cb 0.21 -1.14 -0.13 0.00 0.00 0.00 0.00 19.45 18.40 2oqj n ALA 31 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2oqj s HIS 32 N -3.14 1.35 0.23 0.00 3.76 0.75 -5.01 115.29 113.23 2oqj s HIS 32 Ca 0.07 -0.41 -0.30 0.00 -0.15 0.00 0.00 55.06 54.27 2oqj s HIS 32 Cb 0.14 -0.77 -0.09 0.00 1.11 0.00 0.00 32.58 32.97 2oqj s HIS 32 CO 0.72 0.07 1.32 0.99 -0.85 0.00 0.00 174.74 177.00 2oqj s THR 33 N -1.07 3.06 0.02 1.30 2.01 -1.26 -4.32 115.64 115.38 2oqj s THR 33 Ca 0.01 0.90 0.02 0.00 0.31 0.00 0.00 61.69 62.94 2oqj s THR 33 Cb -0.09 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 2oqj s THR 33 CO 0.02 0.15 -0.01 -0.04 -0.69 0.00 0.00 174.62 174.05 2oqj s MET 34 N -0.42 2.71 0.08 4.92 1.00 -0.39 -1.49 119.30 125.71 2oqj s MET 34 Ca 0.56 -0.67 0.06 0.00 0.00 0.00 0.00 55.69 55.63 2oqj s MET 34 Cb -0.38 -2.62 -0.03 0.00 0.00 0.00 0.00 34.83 31.80 2oqj s MET 34 CO 0.41 0.61 -0.15 -0.80 0.00 0.00 0.00 175.02 175.09 2oqj s ASN 35 N -1.67 1.82 -0.12 3.03 0.01 0.64 -0.62 114.94 118.03 2oqj s ASN 35 Ca 0.20 -0.66 -0.00 0.00 -0.71 0.00 0.00 52.86 51.69 2oqj s ASN 35 Cb -0.11 -0.06 -0.02 0.00 0.41 0.00 0.00 41.25 41.47 2oqj s ASN 35 CO 0.11 -0.07 -0.12 0.26 -1.51 0.00 0.00 177.10 175.77 2oqj s TRP 36 N -1.42 2.84 0.08 2.20 0.52 0.41 -0.76 118.94 122.80 2oqj s TRP 36 Ca 0.01 -0.53 0.06 0.00 0.02 0.00 0.00 56.10 55.66 2oqj s TRP 36 Cb -0.09 -1.84 -0.03 0.00 -1.15 0.00 0.00 33.47 30.36 2oqj s TRP 36 CO 0.03 -0.13 -0.16 0.08 0.02 0.00 0.00 176.95 176.78 2oqj s VAL 37 N 0.22 1.28 0.03 4.03 1.01 0.73 -0.29 120.40 127.42 2oqj s VAL 37 Ca -0.07 -1.36 0.05 0.00 0.00 0.00 0.00 61.98 60.59 2oqj s VAL 37 Cb -0.15 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 2oqj s VAL 37 CO 0.05 -0.18 -0.13 0.00 0.00 0.00 0.00 175.10 174.84 2oqj s ARG 38 N -1.77 0.91 -0.38 2.72 1.70 0.34 -0.23 118.95 122.24 2oqj s ARG 38 Ca 0.00 -0.72 -0.10 0.00 -0.47 0.00 0.00 55.73 54.44 2oqj s ARG 38 Cb -0.10 -0.90 0.04 0.00 -0.57 0.00 0.00 34.95 33.42 2oqj s ARG 38 CO 0.03 0.22 0.19 0.50 -1.08 0.00 0.00 175.30 175.16 2oqj s ARG 39 N -1.08 2.73 0.81 3.89 3.52 -0.02 -0.71 118.95 128.08 2oqj s ARG 39 Ca 0.01 -1.18 -0.11 0.00 -0.13 0.00 0.00 55.73 54.33 2oqj s ARG 39 Cb -0.08 -3.68 0.08 0.00 -1.56 0.00 0.00 34.95 29.71 2oqj s ARG 39 CO 0.01 -0.74 1.10 0.14 -0.81 0.00 0.00 175.30 175.00 2oqj s VAL 40 N 1.49 3.05 0.66 7.11 -7.23 -1.05 -1.85 120.40 122.58 2oqj s VAL 40 Ca 0.01 0.34 0.40 0.00 -1.81 0.00 0.00 61.98 60.93 2oqj s VAL 40 Cb -0.20 -2.75 0.41 0.00 0.56 0.00 0.00 36.38 34.40 2oqj s VAL 40 CO 0.05 -0.45 2.29 1.55 -0.31 0.00 0.00 175.10 178.24 2oqj h PRO 41 N -1.31 0.00 -0.32 4.82 0.13 -1.91 -2.22 132.00 131.19 2oqj h PRO 41 Ca -0.44 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.74 2oqj h PRO 41 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2oqj h PRO 41 CO 0.50 0.00 0.22 0.78 -0.23 0.00 0.00 178.00 179.27 2oqj h GLY 42 N 0.00 0.26 0.00 1.56 0.00 -1.95 -3.47 103.07 99.46 2oqj h GLY 42 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2oqj h GLY 42 CO -0.00 0.07 0.00 0.61 0.00 0.00 0.00 176.54 177.22 2oqj n GLY 43 N -1.54 3.70 3.84 4.60 0.00 -0.84 -5.12 105.19 109.84 2oqj n GLY 43 Ca 0.03 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.79 2oqj n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oqj s GLY 44 N 0.00 1.67 0.01 -0.02 0.00 -1.26 -4.77 107.32 102.95 2oqj s GLY 44 Ca 0.00 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.84 2oqj s GLY 44 CO 0.00 -0.23 -0.09 1.08 0.00 0.00 0.00 173.10 173.86 2oqj s LEU 45 N -6.03 3.06 -0.11 0.66 1.43 -1.26 -2.52 118.68 113.90 2oqj s LEU 45 Ca 0.69 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.62 2oqj s LEU 45 Cb -0.08 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.39 2oqj s LEU 45 CO 0.53 0.28 -0.19 -1.61 0.23 0.00 0.00 176.35 175.59 2oqj s GLU 46 N -1.42 2.57 0.10 1.70 2.02 0.11 -4.98 118.70 118.81 2oqj s GLU 46 Ca 0.17 -0.69 -0.31 0.00 0.02 0.00 0.00 54.97 54.15 2oqj s GLU 46 Cb -0.11 -2.09 -0.08 0.00 0.10 0.00 0.00 34.13 31.95 2oqj s GLU 46 CO 0.07 -0.00 1.41 -0.46 0.02 0.00 0.00 175.26 176.30 2oqj s TRP 47 N 0.81 3.14 -0.17 1.61 -0.00 -1.26 -0.51 118.94 122.57 2oqj s TRP 47 Ca -0.09 0.88 -0.14 0.00 -0.00 0.00 0.00 56.10 56.75 2oqj s TRP 47 Cb -0.16 -3.71 -0.07 0.00 -0.00 0.00 0.00 33.47 29.54 2oqj s TRP 47 CO 0.00 -2.53 -0.30 0.28 -0.00 0.00 0.00 176.95 174.41 2oqj n VAL 48 N 4.08 1.41 -3.82 5.86 0.31 0.61 -4.62 118.33 122.14 2oqj n VAL 48 Ca 0.12 0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.38 2oqj n VAL 48 Cb 0.42 -2.11 -0.08 0.00 -0.91 0.00 0.00 33.84 31.17 2oqj n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oqj s ALA 49 N -2.66 -0.40 -0.01 3.52 0.00 -1.01 -0.65 121.76 120.55 2oqj s ALA 49 Ca -0.27 -0.34 -0.09 0.00 0.00 0.00 0.00 51.96 51.26 2oqj s ALA 49 Cb 0.06 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.57 2oqj s ALA 49 CO 0.38 -0.44 0.18 -1.54 0.00 0.00 0.00 175.76 174.34 2oqj s SER 50 N -2.40 -0.05 -0.05 0.00 1.04 0.02 -0.45 113.70 111.81 2oqj s SER 50 Ca -0.01 -0.08 -0.01 0.00 0.48 0.00 0.00 55.95 56.34 2oqj s SER 50 Cb 0.01 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.41 2oqj s SER 50 CO -0.07 -0.36 0.00 -0.51 0.98 0.00 0.00 173.24 173.29 2oqj s ILE 51 N -1.21 0.28 0.83 -1.02 2.07 0.21 -1.41 121.20 120.94 2oqj s ILE 51 Ca -0.13 0.11 -0.12 0.00 -1.41 0.00 0.00 60.65 59.11 2oqj s ILE 51 Cb -0.06 -0.41 0.09 0.00 0.13 0.00 0.00 42.46 42.21 2oqj s ILE 51 CO 0.02 0.21 1.12 -0.94 -1.91 0.00 0.00 174.94 173.44 2oqj s SER 52 N 1.55 4.23 0.31 4.50 1.04 -0.73 -1.27 113.70 123.34 2oqj s SER 52 Ca -0.02 1.10 -0.29 0.00 0.48 0.00 0.00 55.95 57.22 2oqj s SER 52 Cb -0.13 -1.76 -0.12 0.00 0.10 0.00 0.00 66.02 64.11 2oqj s SER 52 CO -0.03 -2.11 1.36 0.35 0.98 0.00 0.00 173.24 173.79 2oqj n THR 52 N -3.50 1.64 -4.08 2.02 -2.24 -1.26 -1.85 114.28 105.01 2oqj n THR 52 Ca 0.07 -0.41 -0.34 0.00 -2.27 0.00 0.00 64.05 61.10 2oqj n THR 52 Cb 0.58 -1.61 -0.04 0.00 -2.10 0.00 0.00 70.33 67.16 2oqj n THR 52 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2oqj n SER 53 N 1.23 -2.85 -2.34 3.42 3.41 -1.26 -3.37 113.62 111.87 2oqj n SER 53 Ca 0.07 -0.89 -0.18 0.00 -0.26 0.00 0.00 58.87 57.61 2oqj n SER 53 Cb 0.35 -2.37 -0.01 0.00 -0.26 0.00 0.00 64.21 61.91 2oqj n SER 53 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2oqj n SER 54 N -2.47 -5.25 -0.09 4.04 7.64 -0.77 -4.90 113.62 111.83 2oqj n SER 54 Ca 0.07 0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.91 2oqj n SER 54 Cb 0.49 -4.42 -0.05 0.00 -1.01 0.00 0.00 64.21 59.22 2oqj n SER 54 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2oqj h THR 55 N 0.00 1.31 -3.62 0.44 2.02 -1.72 -3.44 112.91 107.89 2oqj h THR 55 Ca -0.43 -1.32 -0.29 0.00 0.77 0.00 0.00 66.41 65.14 2oqj h THR 55 Cb 1.31 1.60 -0.31 0.00 -1.74 0.00 0.00 68.15 69.01 2oqj h THR 55 CO 0.51 0.42 -0.73 -0.47 0.37 0.00 0.00 175.52 175.62 2oqj s TYR 56 N -4.46 0.12 -0.09 3.16 5.04 -1.26 -5.03 117.35 114.83 2oqj s TYR 56 Ca -0.13 0.04 0.02 0.00 -2.44 0.00 0.00 57.07 54.56 2oqj s TYR 56 Cb 0.08 -0.20 -0.02 0.00 0.35 0.00 0.00 41.96 42.17 2oqj s TYR 56 CO 0.80 -0.06 -0.16 1.03 -1.34 0.00 0.00 175.55 175.81 2oqj s ARG 57 N 0.59 2.95 -0.02 4.97 0.52 -1.26 -1.78 118.95 124.91 2oqj s ARG 57 Ca -0.05 -0.74 0.05 0.00 -0.52 0.00 0.00 55.73 54.47 2oqj s ARG 57 Cb -0.08 -2.45 -0.01 0.00 0.52 0.00 0.00 34.95 32.93 2oqj s ARG 57 CO -0.01 0.36 -0.18 0.34 0.02 0.00 0.00 175.30 175.83 2oqj s ASP 58 N -0.06 2.11 0.09 0.23 2.15 -0.50 -5.00 116.67 115.69 2oqj s ASP 58 Ca -0.04 -0.33 0.07 0.00 0.43 0.00 0.00 52.55 52.68 2oqj s ASP 58 Cb -0.14 -0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.08 2oqj s ASP 58 CO 0.04 0.19 -0.19 -0.31 -0.17 0.00 0.00 175.17 174.74 2oqj s TYR 59 N -0.24 1.60 0.42 -5.34 2.02 -1.26 -0.80 117.35 113.74 2oqj s TYR 59 Ca 0.03 -0.42 -0.25 0.00 -0.37 0.00 0.00 57.07 56.05 2oqj s TYR 59 Cb -0.09 -0.89 -0.08 0.00 -0.40 0.00 0.00 41.96 40.50 2oqj s TYR 59 CO 0.00 0.15 1.24 0.00 -1.57 0.00 0.00 175.55 175.37 2oqj s ALA 60 N -1.15 3.16 0.39 3.71 0.00 0.18 -4.81 121.76 123.24 2oqj s ALA 60 Ca 0.04 1.11 0.16 0.00 0.00 0.00 0.00 51.96 53.27 2oqj s ALA 60 Cb -0.10 -3.44 1.03 0.00 0.00 0.00 0.00 23.12 20.61 2oqj s ALA 60 CO 0.03 -0.74 1.82 -0.44 0.00 0.00 0.00 175.76 176.44 2oqj h ASP 61 N 2.51 0.48 0.75 0.00 3.32 -1.94 0.22 116.42 121.75 2oqj h ASP 61 Ca -0.49 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2oqj h ASP 61 Cb 1.25 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2oqj h ASP 61 CO 0.62 0.17 0.00 0.00 -1.72 0.00 0.00 179.24 178.31 2oqj n ALA 62 N -2.48 2.03 -0.02 3.45 0.00 -1.26 -3.34 120.51 118.89 2oqj n ALA 62 Ca 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2oqj n ALA 62 Cb 0.72 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2oqj n ALA 62 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2oqj n VAL 63 N -1.49 0.00 -1.79 0.00 0.24 -0.11 -5.01 118.33 110.18 2oqj n VAL 63 Ca 0.06 -0.43 -0.42 0.00 -2.04 0.00 0.00 64.34 61.51 2oqj n VAL 63 Cb 0.26 1.02 -0.02 0.00 -1.47 0.00 0.00 33.84 33.63 2oqj n VAL 63 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2oqj s LYS 64 N -0.71 4.14 0.00 7.34 2.20 -0.21 -1.55 119.74 130.96 2oqj s LYS 64 Ca 0.00 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 2oqj s LYS 64 Cb 0.00 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 2oqj s LYS 64 CO 0.00 -0.66 0.00 0.41 -0.36 0.00 0.00 175.35 174.74 2oqj n GLY 65 N 3.03 1.71 0.00 5.54 0.00 -1.26 -4.79 105.19 109.42 2oqj n GLY 65 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.13 2oqj n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqj n ARG 66 N -2.00 2.95 -4.36 1.61 1.74 -0.71 -5.04 116.66 110.85 2oqj n ARG 66 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 2oqj n ARG 66 Cb 0.00 -1.01 -0.09 0.00 -1.02 0.00 0.00 32.46 30.34 2oqj n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2oqj s PHE 67 N -2.01 3.14 -0.04 -1.55 0.40 -0.59 -1.62 117.98 115.71 2oqj s PHE 67 Ca -0.00 0.16 0.04 0.00 -0.60 0.00 0.00 56.93 56.53 2oqj s PHE 67 Cb 0.00 -1.76 -0.00 0.00 0.51 0.00 0.00 43.02 41.77 2oqj s PHE 67 CO 0.02 0.46 -0.14 0.95 0.70 0.00 0.00 175.22 177.21 2oqj s THR 68 N -0.93 1.21 -0.07 0.64 -4.23 -0.79 -4.88 115.64 106.59 2oqj s THR 68 Ca 0.15 -0.59 -0.03 0.00 -1.18 0.00 0.00 61.69 60.04 2oqj s THR 68 Cb -0.11 -1.06 -0.04 0.00 1.34 0.00 0.00 72.50 72.63 2oqj s THR 68 CO 0.04 0.36 0.08 0.54 -0.54 0.00 0.00 174.62 175.10 2oqj s VAL 69 N 0.13 4.86 0.08 2.29 0.11 -1.26 -1.67 120.40 124.94 2oqj s VAL 69 Ca -0.04 -0.14 -0.00 0.00 -2.93 0.00 0.00 61.98 58.86 2oqj s VAL 69 Cb -0.11 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 31.57 2oqj s VAL 69 CO 0.02 0.53 -0.02 -0.44 -3.33 0.00 0.00 175.10 171.86 2oqj s SER 70 N -1.20 0.62 0.01 3.54 0.01 -0.73 -4.98 113.70 110.97 2oqj s SER 70 Ca 0.17 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2oqj s SER 70 Cb -0.12 0.19 -0.01 0.00 0.21 0.00 0.00 66.02 66.29 2oqj s SER 70 CO 0.07 -0.59 -0.03 0.00 0.41 0.00 0.00 173.24 173.10 2oqj s ARG 71 N -3.92 0.24 -0.43 12.44 1.70 -1.26 -0.72 118.95 126.99 2oqj s ARG 71 Ca 0.12 -0.34 0.03 0.00 -0.47 0.00 0.00 55.73 55.07 2oqj s ARG 71 Cb 0.07 -0.05 0.12 0.00 -0.57 0.00 0.00 34.95 34.52 2oqj s ARG 71 CO -0.06 0.00 0.17 0.34 -1.08 0.00 0.00 175.30 174.67 2oqj s ASP 72 N -0.74 4.39 0.30 -2.89 -1.08 0.59 -4.99 116.67 112.25 2oqj s ASP 72 Ca -0.07 -2.55 0.06 0.00 -0.52 0.00 0.00 52.55 49.47 2oqj s ASP 72 Cb -0.05 -1.51 0.48 0.00 -1.46 0.00 0.00 42.92 40.38 2oqj s ASP 72 CO -0.00 -0.30 1.73 0.44 0.52 0.00 0.00 175.17 177.55 2oqj h ASP 73 N 7.06 0.32 0.33 -0.34 3.32 -1.97 0.95 116.42 126.09 2oqj h ASP 73 Ca -0.06 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 56.78 2oqj h ASP 73 Cb 0.95 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 2oqj h ASP 73 CO 0.59 0.64 -0.41 -0.07 -1.72 0.00 0.00 179.24 178.27 2oqj h LEU 74 N 0.27 0.10 -1.05 1.55 3.38 -1.96 -3.25 115.31 114.36 2oqj h LEU 74 Ca 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2oqj h LEU 74 Cb 0.73 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2oqj h LEU 74 CO 0.06 0.50 0.00 1.21 0.09 0.00 0.00 178.44 180.30 2oqj n GLU 75 N -4.04 -0.76 -2.66 1.13 2.13 -1.20 -5.05 120.64 110.19 2oqj n GLU 75 Ca -0.02 -0.53 -0.09 0.00 0.66 0.00 0.00 57.16 57.19 2oqj n GLU 75 Cb 0.45 -0.98 0.04 0.00 0.27 0.00 0.00 31.44 31.23 2oqj n GLU 75 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2oqj n ASP 76 N -0.02 -5.21 -4.16 4.31 8.00 0.26 -4.93 116.55 114.79 2oqj n ASP 76 Ca 0.00 -0.43 -0.20 0.00 0.71 0.00 0.00 54.79 54.87 2oqj n ASP 76 Cb 0.02 -3.70 -0.13 0.00 -0.02 0.00 0.00 41.12 37.30 2oqj n ASP 76 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2oqj s PHE 77 N -3.24 1.26 -0.00 1.24 0.08 -0.76 -3.47 117.98 113.08 2oqj s PHE 77 Ca 0.28 -0.40 0.07 0.00 0.12 0.00 0.00 56.93 56.99 2oqj s PHE 77 Cb -0.04 -0.73 -0.02 0.00 -0.57 0.00 0.00 43.02 41.67 2oqj s PHE 77 CO 0.50 0.05 -0.20 0.08 -0.10 0.00 0.00 175.22 175.55 2oqj s VAL 78 N -1.05 1.63 0.11 -0.44 1.01 0.22 -0.30 120.40 121.58 2oqj s VAL 78 Ca 0.00 -0.95 0.10 0.00 0.00 0.00 0.00 61.98 61.13 2oqj s VAL 78 Cb -0.09 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2oqj s VAL 78 CO 0.02 0.39 -0.25 -0.31 0.00 0.00 0.00 175.10 174.95 2oqj s TYR 79 N -0.56 2.37 -0.17 5.22 2.02 0.10 0.11 117.35 126.44 2oqj s TYR 79 Ca 0.08 -0.36 -0.04 0.00 -0.37 0.00 0.00 57.07 56.38 2oqj s TYR 79 Cb -0.08 -1.29 0.06 0.00 -0.40 0.00 0.00 41.96 40.24 2oqj s TYR 79 CO -0.00 0.32 0.07 -1.17 -1.57 0.00 0.00 175.55 173.20 2oqj s LEU 80 N -1.96 0.66 -0.18 -1.29 2.96 0.73 -1.77 118.68 117.82 2oqj s LEU 80 Ca 0.15 -0.65 -0.10 0.00 -0.22 0.00 0.00 54.13 53.31 2oqj s LEU 80 Cb -0.10 -0.38 -0.05 0.00 0.50 0.00 0.00 46.19 46.16 2oqj s LEU 80 CO 0.06 -0.33 0.14 0.00 -1.32 0.00 0.00 176.35 174.91 2oqj s GLN 81 N 2.03 4.07 -0.19 1.98 -2.07 -0.67 0.85 119.66 125.66 2oqj s GLN 81 Ca 0.01 -0.18 -0.00 0.00 -1.82 0.00 0.00 55.36 53.37 2oqj s GLN 81 Cb -0.16 -3.38 0.01 0.00 -1.09 0.00 0.00 33.01 28.39 2oqj s GLN 81 CO -0.08 0.38 -0.16 -1.64 -1.32 0.00 0.00 175.29 172.46 2oqj s MET 82 N 0.12 3.08 0.30 9.60 -1.94 0.78 -1.88 119.30 129.36 2oqj s MET 82 Ca 0.10 -0.78 0.10 0.00 -1.71 0.00 0.00 55.69 53.40 2oqj s MET 82 Cb -0.11 -2.67 -0.05 0.00 2.01 0.00 0.00 34.83 34.01 2oqj s MET 82 CO -0.01 -0.21 -0.08 -1.01 -0.01 0.00 0.00 175.02 173.71 2oqj s HIS 82 N 1.33 2.47 -1.13 -0.03 3.76 -0.64 -1.18 115.29 119.87 2oqj s HIS 82 Ca 0.05 -0.35 -0.26 0.00 -0.15 0.00 0.00 55.06 54.34 2oqj s HIS 82 Cb -0.13 -1.22 0.03 0.00 1.11 0.00 0.00 32.58 32.36 2oqj s HIS 82 CO -0.11 0.61 0.69 1.63 -0.85 0.00 0.00 174.74 176.71 2oqj n LYS 82 N -0.80 -0.61 -2.54 1.40 5.02 -1.19 -4.74 118.16 114.69 2oqj n LYS 82 Ca -0.05 0.27 -0.41 0.00 -2.02 0.00 0.00 58.31 56.10 2oqj n LYS 82 Cb 0.61 -2.73 -0.04 0.00 -0.02 0.00 0.00 35.03 32.84 2oqj n LYS 82 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2oqj s MET 82 N -6.73 4.62 0.32 1.97 -1.94 -1.08 -4.67 119.30 111.79 2oqj s MET 82 Ca 0.40 1.69 0.07 0.00 -1.71 0.00 0.00 55.69 56.13 2oqj s MET 82 Cb -0.21 -3.28 -0.02 0.00 2.01 0.00 0.00 34.83 33.34 2oqj s MET 82 CO 0.94 0.13 0.39 1.03 -0.01 0.00 0.00 175.02 177.50 2oqj s ARG 83 N -0.50 3.04 0.38 2.03 0.52 -1.26 -0.80 118.95 122.36 2oqj s ARG 83 Ca 0.48 -1.06 0.07 0.00 -0.52 0.00 0.00 55.73 54.70 2oqj s ARG 83 Cb -0.29 -2.72 0.75 0.00 0.52 0.00 0.00 34.95 33.21 2oqj s ARG 83 CO 0.35 0.14 1.94 0.28 0.02 0.00 0.00 175.30 178.04 2oqj h VAL 84 N 1.07 1.16 -0.01 3.52 2.07 -1.93 -2.16 116.25 119.97 2oqj h VAL 84 Ca -0.46 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.45 2oqj h VAL 84 Cb 1.25 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2oqj h VAL 84 CO 0.56 0.21 0.00 -1.84 0.02 0.00 0.00 177.57 176.52 2oqj n GLU 85 N -4.34 1.04 0.10 1.57 0.00 -1.26 -2.57 120.64 115.18 2oqj n GLU 85 Ca 0.01 -0.06 0.13 0.00 0.00 0.00 0.00 57.16 57.24 2oqj n GLU 85 Cb 0.20 -1.37 0.45 0.00 0.00 0.00 0.00 31.44 30.72 2oqj n GLU 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2oqj n ASP 86 N -0.81 0.66 -4.61 -1.84 8.00 -0.81 -4.81 116.55 112.33 2oqj n ASP 86 Ca 0.18 0.59 -0.43 0.00 0.71 0.00 0.00 54.79 55.84 2oqj n ASP 86 Cb 0.10 -0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 40.41 2oqj n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2oqj n THR 87 N -2.15 0.45 -3.84 -3.53 -1.04 -1.06 -4.88 114.28 98.22 2oqj n THR 87 Ca 0.05 -0.37 -0.04 0.00 -2.04 0.00 0.00 64.05 61.65 2oqj n THR 87 Cb 0.35 -2.45 0.01 0.00 -1.82 0.00 0.00 70.33 66.42 2oqj n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2oqj s ALA 88 N 7.26 -1.46 -0.09 2.41 0.00 -0.21 -4.33 121.76 125.33 2oqj s ALA 88 Ca 0.98 -0.30 -0.18 0.00 0.00 0.00 0.00 51.96 52.46 2oqj s ALA 88 Cb -0.39 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.40 2oqj s ALA 88 CO 0.38 -1.05 0.46 0.42 0.00 0.00 0.00 175.76 175.97 2oqj s ILE 89 N -2.46 5.15 -0.22 0.00 1.01 -0.77 -1.26 121.20 122.65 2oqj s ILE 89 Ca 0.19 0.93 -0.07 0.00 0.00 0.00 0.00 60.65 61.70 2oqj s ILE 89 Cb -0.03 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 2oqj s ILE 89 CO 0.06 0.38 0.06 -0.31 0.00 0.00 0.00 174.94 175.12 2oqj s TYR 90 N 0.30 3.12 -0.07 3.97 1.51 0.88 -0.85 117.35 126.22 2oqj s TYR 90 Ca 0.25 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 56.09 2oqj s TYR 90 Cb -0.15 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 2oqj s TYR 90 CO 0.11 -0.18 -0.16 0.71 -1.11 0.00 0.00 175.55 174.92 2oqj s TYR 91 N 1.16 2.68 0.01 2.71 1.51 0.68 -0.50 117.35 125.61 2oqj s TYR 91 Ca 0.04 -0.32 -0.08 0.00 -1.01 0.00 0.00 57.07 55.69 2oqj s TYR 91 Cb -0.14 -1.67 -0.05 0.00 -0.11 0.00 0.00 41.96 39.99 2oqj s TYR 91 CO 0.03 0.06 0.30 0.00 -1.11 0.00 0.00 175.55 174.83 2oqj s ALA 93 N -1.26 -0.66 0.24 0.00 0.00 0.06 -2.10 121.76 118.04 2oqj s ALA 93 Ca 0.27 0.57 -0.07 0.00 0.00 0.00 0.00 51.96 52.73 2oqj s ALA 93 Cb -0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.64 2oqj s ALA 93 CO 0.15 -0.17 0.53 -0.98 0.00 0.00 0.00 175.76 175.29 2oqj s ARG 94 N -0.34 3.72 -0.43 0.00 1.70 -0.88 -0.26 118.95 122.46 2oqj s ARG 94 Ca -0.05 0.14 -0.20 0.00 -0.47 0.00 0.00 55.73 55.15 2oqj s ARG 94 Cb -0.03 -2.67 0.02 0.00 -0.57 0.00 0.00 34.95 31.69 2oqj s ARG 94 CO 0.01 0.30 0.60 0.21 -1.08 0.00 0.00 175.30 175.34 2oqj s LYS 95 N -3.04 3.29 0.13 3.89 2.20 -0.55 -3.26 119.74 122.39 2oqj s LYS 95 Ca 0.45 -0.41 -0.16 0.00 -0.36 0.00 0.00 55.97 55.49 2oqj s LYS 95 Cb -0.11 -3.94 0.06 0.00 -1.51 0.00 0.00 37.83 32.33 2oqj s LYS 95 CO 0.25 -0.94 0.78 0.41 -0.36 0.00 0.00 175.35 175.48 2oqj n GLY 96 N 5.02 0.75 3.79 5.54 0.00 -0.33 -4.35 105.19 115.61 2oqj n GLY 96 Ca -0.03 -1.08 -0.03 0.00 0.00 0.00 0.00 46.02 44.87 2oqj n GLY 96 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oqj s SER 97 N -2.83 -0.12 0.09 1.61 0.15 -1.26 -3.86 113.70 107.48 2oqj s SER 97 Ca 0.17 -0.50 -0.27 0.00 0.70 0.00 0.00 55.95 56.06 2oqj s SER 97 Cb -0.02 0.50 -0.11 0.00 -1.71 0.00 0.00 66.02 64.68 2oqj s SER 97 CO 0.04 -0.94 1.43 0.44 1.20 0.00 0.00 173.24 175.41 2oqj h ASP 98 N 2.00 -1.33 -3.66 5.45 3.32 -2.01 -3.34 116.42 116.84 2oqj h ASP 98 Ca -0.25 0.15 -0.68 0.00 0.02 0.00 0.00 57.03 56.27 2oqj h ASP 98 Cb 1.23 0.51 -0.21 0.00 0.22 0.00 0.00 39.33 41.07 2oqj h ASP 98 CO 0.29 -0.40 -0.52 -0.13 -1.72 0.00 0.00 179.24 176.75 2oqj s ARG 99 N -5.14 3.33 0.19 3.56 0.52 -1.26 -5.07 118.95 115.08 2oqj s ARG 99 Ca -0.12 -0.74 -0.32 0.00 -0.52 0.00 0.00 55.73 54.03 2oqj s ARG 99 Cb 0.05 -3.68 -0.12 0.00 0.52 0.00 0.00 34.95 31.72 2oqj s ARG 99 CO 0.48 -0.46 1.71 1.28 0.02 0.00 0.00 175.30 178.33 2oqj n LEU 100 N 5.03 3.84 0.00 2.53 4.77 -1.26 -5.01 117.00 126.91 2oqj n LEU 100 Ca -0.13 1.06 -0.05 0.00 -0.03 0.00 0.00 56.01 56.85 2oqj n LEU 100 Cb 0.49 -1.54 -0.01 0.00 -2.33 0.00 0.00 43.42 40.02 2oqj n LEU 100 CO 0.35 0.10 -0.04 -1.54 -1.33 0.00 0.00 177.39 174.93 2oqj n SER 100 N 4.09 1.53 0.08 -1.43 3.41 -1.26 -5.05 113.62 114.98 2oqj n SER 100 Ca 0.16 -1.42 -0.03 0.00 -0.26 0.00 0.00 58.87 57.32 2oqj n SER 100 Cb 0.34 0.14 0.19 0.00 -0.26 0.00 0.00 64.21 64.62 2oqj n SER 100 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2oqj h ASP 100 N 0.28 0.30 -3.19 4.04 3.32 -2.05 -3.41 116.42 115.70 2oqj h ASP 100 Ca -0.07 -0.14 -0.49 0.00 0.02 0.00 0.00 57.03 56.35 2oqj h ASP 100 Cb 0.24 -0.08 -0.40 0.00 0.22 0.00 0.00 39.33 39.30 2oqj h ASP 100 CO 0.11 0.71 -0.76 0.21 -1.72 0.00 0.00 179.24 177.80 2oqj s ASN 100 N -6.88 2.65 0.08 6.45 2.47 -1.26 -5.14 114.94 113.31 2oqj s ASN 100 Ca -0.05 -0.72 0.07 0.00 0.42 0.00 0.00 52.86 52.59 2oqj s ASN 100 Cb 0.13 -0.46 -0.04 0.00 -1.45 0.00 0.00 41.25 39.43 2oqj s ASN 100 CO 0.78 -0.32 -0.14 -1.81 -3.72 0.00 0.00 177.10 171.89 2oqj s ASP 100 N 1.97 4.11 1.06 -4.21 1.01 -1.26 -5.09 116.67 114.26 2oqj s ASP 100 Ca 0.00 -0.42 -0.08 0.00 0.71 0.00 0.00 52.55 52.77 2oqj s ASP 100 Cb -0.17 -0.72 0.12 0.00 1.01 0.00 0.00 42.92 43.16 2oqj s ASP 100 CO -0.08 0.21 0.51 -0.81 0.21 0.00 0.00 175.17 175.21 2oqj n PRO 100 N 1.07 -1.35 -3.18 8.23 -0.04 -1.25 -4.58 135.00 133.91 2oqj n PRO 100 Ca -0.15 -0.80 -0.45 0.00 -0.04 0.00 0.00 63.50 62.06 2oqj n PRO 100 Cb 0.52 -0.65 -0.04 0.00 -0.04 0.00 0.00 33.50 33.29 2oqj n PRO 100 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2oqj s PHE 100 N -2.01 3.11 -1.18 0.54 0.08 -1.26 -1.18 117.98 116.08 2oqj s PHE 100 Ca 0.31 -1.12 0.25 0.00 0.12 0.00 0.00 56.93 56.49 2oqj s PHE 100 Cb -0.02 -3.95 0.49 0.00 -0.57 0.00 0.00 43.02 38.97 2oqj s PHE 100 CO 0.23 -1.20 1.40 -0.40 -0.10 0.00 0.00 175.22 175.15 2oqj n ASP 101 N 5.90 0.68 -3.72 1.36 5.75 -1.20 -4.85 116.55 120.47 2oqj n ASP 101 Ca -0.09 -0.47 -0.14 0.00 -0.01 0.00 0.00 54.79 54.08 2oqj n ASP 101 Cb 0.42 0.29 -0.14 0.00 -1.03 0.00 0.00 41.12 40.66 2oqj n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oqj s ALA 102 N -2.88 -0.38 0.15 2.12 0.00 -1.26 -5.05 121.76 114.45 2oqj s ALA 102 Ca 0.14 0.80 0.08 0.00 0.00 0.00 0.00 51.96 52.98 2oqj s ALA 102 Cb 0.18 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2oqj s ALA 102 CO 0.67 -0.29 -0.17 -1.58 0.00 0.00 0.00 175.76 174.39 2oqj s TRP 103 N 1.52 1.71 0.72 0.00 0.52 -1.26 -2.08 118.94 120.07 2oqj s TRP 103 Ca -0.06 -0.49 -0.08 0.00 0.02 0.00 0.00 56.10 55.50 2oqj s TRP 103 Cb -0.11 -0.87 0.06 0.00 -1.15 0.00 0.00 33.47 31.40 2oqj s TRP 103 CO -0.07 0.27 1.04 0.20 0.02 0.00 0.00 176.95 178.41 2oqj s GLY 104 N -2.53 1.66 0.55 0.98 0.00 -0.89 -4.47 107.32 102.62 2oqj s GLY 104 Ca 0.13 -0.85 0.34 0.00 0.00 0.00 0.00 44.72 44.34 2oqj s GLY 104 CO 0.05 -0.44 1.99 -0.56 0.00 0.00 0.00 173.10 174.14 2oqj h PRO 105 N -0.66 0.00 0.00 2.90 0.13 -1.93 -3.46 132.00 128.98 2oqj h PRO 105 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2oqj h PRO 105 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2oqj h PRO 105 CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 2oqj n GLY 106 N 0.03 2.55 3.16 1.56 0.00 -1.26 -5.01 105.19 106.22 2oqj n GLY 106 Ca 0.01 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 2oqj n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2oqj s THR 107 N -1.58 1.69 -0.16 2.61 -1.32 0.35 -4.87 115.64 112.36 2oqj s THR 107 Ca 0.00 -0.82 -0.29 0.00 -1.21 0.00 0.00 61.69 59.37 2oqj s THR 107 Cb 0.00 -1.47 -0.00 0.00 -1.51 0.00 0.00 72.50 69.52 2oqj s THR 107 CO 0.00 0.48 1.01 -0.69 -2.21 0.00 0.00 174.62 173.21 2oqj s VAL 108 N 0.31 4.74 -0.11 5.08 1.01 -1.26 -0.08 120.40 130.09 2oqj s VAL 108 Ca -0.13 2.02 0.03 0.00 0.00 0.00 0.00 61.98 63.90 2oqj s VAL 108 Cb -0.16 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.93 2oqj s VAL 108 CO 0.06 -0.07 -0.18 -0.69 0.00 0.00 0.00 175.10 174.21 2oqj s VAL 109 N 2.52 1.69 -0.05 2.92 1.01 -0.39 -0.67 120.40 127.42 2oqj s VAL 109 Ca 0.46 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 2oqj s VAL 109 Cb -0.17 -1.51 0.03 0.00 0.00 0.00 0.00 36.38 34.73 2oqj s VAL 109 CO 0.13 0.48 0.00 0.28 0.00 0.00 0.00 175.10 175.99 2oqj s THR 110 N 0.74 0.30 -0.38 3.92 -1.32 -0.73 -1.04 115.64 117.12 2oqj s THR 110 Ca -0.11 0.11 -0.12 0.00 -1.21 0.00 0.00 61.69 60.36 2oqj s THR 110 Cb -0.16 -0.43 0.02 0.00 -1.51 0.00 0.00 72.50 70.42 2oqj s THR 110 CO 0.02 0.22 0.23 -0.69 -2.21 0.00 0.00 174.62 172.19 2oqj s VAL 111 N 1.61 4.78 0.17 5.08 1.01 -1.26 -2.00 120.40 129.80 2oqj s VAL 111 Ca -0.01 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 60.89 2oqj s VAL 111 Cb -0.13 -3.66 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 2oqj s VAL 111 CO -0.03 -0.25 1.12 -0.94 0.00 0.00 0.00 175.10 175.00 2oqj s SER 112 N 1.59 7.22 0.23 3.32 1.04 -0.53 -4.64 113.70 121.93 2oqj s SER 112 Ca 0.03 2.12 -0.07 0.00 0.48 0.00 0.00 55.95 58.51 2oqj s SER 112 Cb -0.19 -2.60 0.35 0.00 0.10 0.00 0.00 66.02 63.68 2oqj s SER 112 CO 0.08 -0.26 1.76 -0.65 0.98 0.00 0.00 173.24 175.15 2oqj h PRO 113 N 5.19 0.53 -6.33 4.02 0.11 -1.97 -2.91 132.00 130.63 2oqj h PRO 113 Ca -0.44 -0.03 -0.57 0.00 0.11 0.00 0.00 66.00 65.07 2oqj h PRO 113 Cb 1.21 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 2oqj h PRO 113 CO 0.73 0.35 1.21 0.00 -0.21 0.00 0.00 178.00 180.08 2oqj s ALA 114 N -6.06 2.86 -0.43 -0.75 0.00 -1.26 -4.63 121.76 111.50 2oqj s ALA 114 Ca -0.13 0.02 0.23 0.00 0.00 0.00 0.00 51.96 52.09 2oqj s ALA 114 Cb 0.18 -4.02 0.23 0.00 0.00 0.00 0.00 23.12 19.51 2oqj s ALA 114 CO 0.76 -2.68 1.30 0.66 0.00 0.00 0.00 175.76 175.80 2oqj h SER 115 N 12.31 0.00 -3.73 0.00 4.64 -1.82 -3.39 113.55 121.57 2oqj h SER 115 Ca -0.31 -0.06 -0.24 0.00 -0.47 0.00 0.00 61.79 60.71 2oqj h SER 115 Cb 1.15 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.95 2oqj h SER 115 CO 1.07 0.03 -0.72 0.28 -0.87 0.00 0.00 176.83 176.61 2oqj s THR 116 N -3.26 0.04 -0.07 2.95 -1.32 -1.26 -4.57 115.64 108.15 2oqj s THR 116 Ca 0.04 -0.01 0.02 0.00 -1.21 0.00 0.00 61.69 60.53 2oqj s THR 116 Cb 0.10 -0.05 0.01 0.00 -1.51 0.00 0.00 72.50 71.05 2oqj s THR 116 CO 0.73 0.02 -0.13 -0.75 -2.21 0.00 0.00 174.62 172.28 2oqj s LYS 117 N 0.06 1.75 0.39 7.08 2.20 0.29 -4.95 119.74 126.57 2oqj s LYS 117 Ca -0.00 -0.43 -0.23 0.00 -0.36 0.00 0.00 55.97 54.94 2oqj s LYS 117 Cb -0.01 -1.45 -0.10 0.00 -1.51 0.00 0.00 37.83 34.76 2oqj s LYS 117 CO -0.00 0.02 0.97 0.20 -0.36 0.00 0.00 175.35 176.18 2oqj s GLY 118 N 0.68 2.60 0.59 5.54 0.00 -1.26 -1.13 107.32 114.34 2oqj s GLY 118 Ca -0.14 0.50 -0.05 0.00 0.00 0.00 0.00 44.72 45.02 2oqj s GLY 118 CO 0.04 0.86 0.89 2.56 0.00 0.00 0.00 173.10 177.45 2oqj s PRO 119 N -2.66 2.83 -0.07 2.90 0.04 -1.26 -4.61 135.00 132.17 2oqj s PRO 119 Ca 0.57 -0.10 0.01 0.00 0.04 0.00 0.00 61.00 61.52 2oqj s PRO 119 Cb -0.15 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 2oqj s PRO 119 CO 0.19 -0.73 -0.08 -1.54 0.04 0.00 0.00 177.00 174.88 2oqj s SER 120 N -4.33 4.53 -0.27 6.66 1.04 -0.82 -4.97 113.70 115.55 2oqj s SER 120 Ca 0.54 -0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.85 2oqj s SER 120 Cb -0.10 -1.19 0.01 0.00 0.10 0.00 0.00 66.02 64.84 2oqj s SER 120 CO 0.44 0.34 0.03 -0.69 0.98 0.00 0.00 173.24 174.34 2oqj s VAL 121 N -0.65 3.64 -0.08 5.02 1.01 -1.26 -1.65 120.40 126.43 2oqj s VAL 121 Ca 0.10 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2oqj s VAL 121 Cb -0.11 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 2oqj s VAL 121 CO 0.02 0.18 -0.03 -0.36 0.00 0.00 0.00 175.10 174.90 2oqj s PHE 122 N 1.46 3.05 0.40 5.22 0.08 0.10 -4.94 117.98 123.35 2oqj s PHE 122 Ca 0.03 0.08 -0.23 0.00 0.12 0.00 0.00 56.93 56.93 2oqj s PHE 122 Cb -0.16 -1.76 -0.10 0.00 -0.57 0.00 0.00 43.02 40.42 2oqj s PHE 122 CO -0.00 0.37 0.98 -2.14 -0.10 0.00 0.00 175.22 174.33 2oqj s PRO 123 N -0.76 4.28 -0.72 0.24 0.02 -1.26 0.31 135.00 137.10 2oqj s PRO 123 Ca 0.12 1.28 -0.08 0.00 0.02 0.00 0.00 61.00 62.33 2oqj s PRO 123 Cb -0.11 -2.43 0.19 0.00 0.02 0.00 0.00 34.50 32.17 2oqj s PRO 123 CO 0.02 0.00 0.60 -0.51 -0.33 0.00 0.00 177.00 176.78 2oqj s LEU 124 N -2.76 5.98 0.26 -5.54 1.43 0.19 -4.81 118.68 113.43 2oqj s LEU 124 Ca 0.58 -2.78 -0.29 0.00 -1.03 0.00 0.00 54.13 50.61 2oqj s LEU 124 Cb -0.15 -2.03 -0.09 0.00 0.03 0.00 0.00 46.19 43.95 2oqj s LEU 124 CO 0.20 -0.47 1.21 0.00 0.23 0.00 0.00 176.35 177.52 2oqj s ALA 125 N 0.04 3.46 0.57 4.21 0.00 -1.26 -1.85 121.76 126.93 2oqj s ALA 125 Ca 0.17 1.04 -0.18 0.00 0.00 0.00 0.00 51.96 53.00 2oqj s ALA 125 Cb -0.15 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 2oqj s ALA 125 CO -0.06 -0.40 1.10 -1.25 0.00 0.00 0.00 175.76 175.15 2oqj s PRO 126 N -1.02 3.29 -0.37 0.00 0.04 -1.26 -4.96 135.00 130.72 2oqj s PRO 126 Ca 0.50 1.46 -0.27 0.00 0.04 0.00 0.00 61.00 62.73 2oqj s PRO 126 Cb -0.35 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.20 2oqj s PRO 126 CO 0.43 -0.87 0.97 0.45 0.04 0.00 0.00 177.00 178.02 2oqj s SER 127 N -2.15 6.71 0.00 6.66 0.15 -1.26 -4.61 113.70 119.20 2oqj s SER 127 Ca 0.69 0.64 0.21 0.00 0.70 0.00 0.00 55.95 58.20 2oqj s SER 127 Cb -0.21 -2.48 0.96 0.00 -1.71 0.00 0.00 66.02 62.58 2oqj s SER 127 CO 0.31 -0.90 1.69 -1.54 1.20 0.00 0.00 173.24 174.00 2oqj n SER 128 N 6.89 0.00 -3.92 5.45 3.41 -1.26 -3.87 113.62 120.32 2oqj n SER 128 Ca 0.08 0.38 -0.30 0.00 -0.26 0.00 0.00 58.87 58.77 2oqj n SER 128 Cb 0.48 -0.45 -0.14 0.00 -0.26 0.00 0.00 64.21 63.84 2oqj n SER 128 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2oqj s LYS 129 N -2.90 1.81 0.00 4.33 2.20 -1.26 -5.08 119.74 118.83 2oqj s LYS 129 Ca 0.13 -2.44 0.00 0.00 -0.36 0.00 0.00 55.97 53.30 2oqj s LYS 129 Cb 0.14 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2oqj s LYS 129 CO 0.38 -1.10 0.00 -1.13 -0.36 0.00 0.00 175.35 173.14 2oqj n SER 130 N 3.31 0.25 -4.34 1.43 3.41 -1.25 -5.04 113.62 111.39 2oqj n SER 130 Ca 0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.29 2oqj n SER 130 Cb 0.34 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 2oqj n SER 130 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2oqj n THR 133 N 0.00 2.80 -4.25 6.66 -2.24 -1.26 -4.88 114.28 111.11 2oqj n THR 133 Ca 0.00 -2.80 0.04 0.00 -2.27 0.00 0.00 64.05 59.02 2oqj n THR 133 Cb 0.00 -2.31 -0.01 0.00 -2.10 0.00 0.00 70.33 65.91 2oqj n THR 133 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2oqj n SER 134 N 10.30 -6.57 -3.25 3.42 2.88 -1.26 -3.91 113.62 115.22 2oqj n SER 134 Ca 0.48 0.33 -0.37 0.00 -1.33 0.00 0.00 58.87 57.98 2oqj n SER 134 Cb 0.45 -0.94 -0.03 0.00 -0.75 0.00 0.00 64.21 62.94 2oqj n SER 134 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2oqj n GLY 135 N -0.91 4.63 0.00 0.46 0.00 -1.26 -4.71 105.19 103.40 2oqj n GLY 135 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2oqj n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oqj n GLY 136 N 2.49 0.47 3.28 -0.02 0.00 -1.25 -4.66 105.19 105.49 2oqj n GLY 136 Ca 0.67 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.37 2oqj n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oqj s THR 137 N 0.92 2.47 0.16 2.61 2.01 -1.26 -2.00 115.64 120.55 2oqj s THR 137 Ca 0.00 -0.87 0.10 0.00 0.31 0.00 0.00 61.69 61.23 2oqj s THR 137 Cb 0.00 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 2oqj s THR 137 CO 0.00 0.55 -0.21 0.00 -0.69 0.00 0.00 174.62 174.26 2oqj s ALA 138 N 0.35 2.60 -0.04 7.40 0.00 0.79 -4.84 121.76 128.01 2oqj s ALA 138 Ca -0.16 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.33 2oqj s ALA 138 Cb -0.17 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 2oqj s ALA 138 CO 0.08 0.49 -0.19 0.00 0.00 0.00 0.00 175.76 176.13 2oqj s ALA 139 N -1.44 1.69 0.21 0.00 0.00 -1.26 0.06 121.76 121.01 2oqj s ALA 139 Ca 0.19 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.29 2oqj s ALA 139 Cb -0.09 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2oqj s ALA 139 CO 0.10 0.34 0.24 -0.48 0.00 0.00 0.00 175.76 175.96 2oqj s LEU 140 N -0.13 0.93 0.00 0.00 0.05 -0.76 -4.13 118.68 114.65 2oqj s LEU 140 Ca -0.01 -1.20 -0.12 0.00 0.05 0.00 0.00 54.13 52.85 2oqj s LEU 140 Cb -0.11 0.85 0.04 0.00 -2.05 0.00 0.00 46.19 44.92 2oqj s LEU 140 CO 0.02 -0.93 0.54 0.61 -0.55 0.00 0.00 176.35 176.05 2oqj n GLY 141 N -0.29 0.34 3.24 -3.48 0.00 -0.77 -1.27 105.19 102.96 2oqj n GLY 141 Ca -0.00 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 2oqj n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqj s LEU 143 N -0.08 4.08 -0.43 0.00 2.96 0.15 -1.72 118.68 123.64 2oqj s LEU 143 Ca -0.05 0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.85 2oqj s LEU 143 Cb -0.14 -2.11 0.10 0.00 0.50 0.00 0.00 46.19 44.53 2oqj s LEU 143 CO 0.04 0.02 0.26 -0.69 -1.32 0.00 0.00 176.35 174.65 2oqj s VAL 144 N 1.35 3.94 -0.03 1.68 1.01 0.01 -0.72 120.40 127.64 2oqj s VAL 144 Ca 0.07 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.40 2oqj s VAL 144 Cb -0.15 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2oqj s VAL 144 CO 0.07 -0.61 -0.01 -0.54 0.00 0.00 0.00 175.10 174.02 2oqj s LYS 145 N 1.33 2.82 -0.80 2.72 1.02 -0.66 -2.13 119.74 124.05 2oqj s LYS 145 Ca 0.04 -0.56 -0.04 0.00 0.02 0.00 0.00 55.97 55.44 2oqj s LYS 145 Cb -0.24 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 2oqj s LYS 145 CO -0.00 0.65 0.71 -0.25 -0.92 0.00 0.00 175.35 175.53 2oqj n ASP 146 N 1.67 -6.03 -4.43 2.83 8.00 -0.81 -1.93 116.55 115.86 2oqj n ASP 146 Ca -0.16 -0.45 -0.22 0.00 0.71 0.00 0.00 54.79 54.66 2oqj n ASP 146 Cb 0.53 -4.39 -0.10 0.00 -0.02 0.00 0.00 41.12 37.14 2oqj n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2oqj s TYR 147 N -3.24 2.10 -0.26 1.24 1.13 -1.08 -4.12 117.35 113.12 2oqj s TYR 147 Ca 0.29 -0.41 -0.17 0.00 -1.41 0.00 0.00 57.07 55.36 2oqj s TYR 147 Cb -0.04 -0.93 0.07 0.00 -1.10 0.00 0.00 41.96 39.96 2oqj s TYR 147 CO 0.61 0.59 0.66 0.12 -2.51 0.00 0.00 175.55 175.02 2oqj s PHE 148 N -2.62 -0.94 0.00 -3.49 5.36 -0.28 -1.75 117.98 114.27 2oqj s PHE 148 Ca 0.27 1.97 0.00 0.00 -0.96 0.00 0.00 56.93 58.21 2oqj s PHE 148 Cb -0.04 0.50 0.00 0.00 -0.34 0.00 0.00 43.02 43.14 2oqj s PHE 148 CO 0.12 -0.47 0.00 -0.35 -1.46 0.00 0.00 175.22 173.07 2oqj n PRO 149 N 3.89 1.47 -1.49 10.12 -0.04 -1.26 0.11 135.00 147.78 2oqj n PRO 149 Ca -0.19 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.97 2oqj n PRO 149 Cb 0.58 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.13 2oqj n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2oqj s GLU 150 N -0.38 2.02 0.52 0.54 2.02 -1.26 -4.82 118.70 117.33 2oqj s GLU 150 Ca 0.00 0.70 0.08 0.00 0.02 0.00 0.00 54.97 55.77 2oqj s GLU 150 Cb 0.00 -1.91 0.05 0.00 0.10 0.00 0.00 34.13 32.38 2oqj s GLU 150 CO 0.00 -1.68 0.71 -1.25 0.02 0.00 0.00 175.26 173.06 2oqj s PRO 151 N -5.11 2.50 0.03 0.39 0.04 -1.26 -4.93 135.00 126.66 2oqj s PRO 151 Ca 0.61 -1.38 0.07 0.00 0.04 0.00 0.00 61.00 60.35 2oqj s PRO 151 Cb -0.15 -2.66 -0.02 0.00 0.04 0.00 0.00 34.50 31.70 2oqj s PRO 151 CO 0.55 -0.64 -0.21 0.08 0.04 0.00 0.00 177.00 176.82 2oqj s VAL 152 N -2.57 1.71 -0.11 -0.36 1.01 -1.26 -4.47 120.40 114.35 2oqj s VAL 152 Ca 0.59 -1.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2oqj s VAL 152 Cb -0.08 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2oqj s VAL 152 CO 0.37 0.30 0.10 -0.89 0.00 0.00 0.00 175.10 174.98 2oqj s THR 153 N -0.71 5.20 -0.04 3.92 2.01 0.25 -4.97 115.64 121.29 2oqj s THR 153 Ca 0.08 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2oqj s THR 153 Cb -0.09 -3.25 0.01 0.00 0.01 0.00 0.00 72.50 69.19 2oqj s THR 153 CO 0.01 0.62 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.78 2oqj s VAL 154 N -0.99 0.82 0.18 3.82 1.01 -1.26 -1.24 120.40 122.74 2oqj s VAL 154 Ca 0.15 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.80 2oqj s VAL 154 Cb -0.12 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 2oqj s VAL 154 CO 0.04 0.27 0.02 -0.94 0.00 0.00 0.00 175.10 174.49 2oqj s SER 156 N 0.47 1.11 -0.06 3.32 1.04 -0.28 -4.94 113.70 114.35 2oqj s SER 156 Ca -0.08 -1.21 0.05 0.00 0.48 0.00 0.00 55.95 55.19 2oqj s SER 156 Cb -0.12 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 2oqj s SER 156 CO 0.01 -0.61 -0.22 0.26 0.98 0.00 0.00 173.24 173.66 2oqj s TRP 157 N -3.72 2.20 -1.34 5.02 0.52 -1.26 0.12 118.94 120.48 2oqj s TRP 157 Ca 0.26 -0.70 -0.02 0.00 0.02 0.00 0.00 56.10 55.66 2oqj s TRP 157 Cb 0.06 -1.46 0.01 0.00 -1.15 0.00 0.00 33.47 30.94 2oqj s TRP 157 CO 0.05 -0.24 0.77 0.09 0.02 0.00 0.00 176.95 177.65 2oqj n ASN 162 N 3.13 -1.86 -3.83 2.95 3.02 0.22 -1.93 115.26 116.97 2oqj n ASN 162 Ca -0.18 -0.80 -0.30 0.00 -0.03 0.00 0.00 54.58 53.28 2oqj n ASN 162 Cb 0.52 -4.12 0.02 0.00 -0.61 0.00 0.00 39.78 35.59 2oqj n ASN 162 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2oqj n SER 163 N -3.03 -4.63 0.00 6.41 2.88 -1.26 -1.75 113.62 112.24 2oqj n SER 163 Ca -0.24 -0.73 0.00 0.00 -1.33 0.00 0.00 58.87 56.57 2oqj n SER 163 Cb 0.65 -3.72 0.00 0.00 -0.75 0.00 0.00 64.21 60.39 2oqj n SER 163 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2oqj n GLY 164 N -1.59 1.05 0.18 0.46 0.00 -1.00 -4.93 105.19 99.36 2oqj n GLY 164 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 2oqj n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqj h ALA 165 N 0.00 0.87 -3.08 4.61 0.00 -1.18 -3.42 119.26 117.07 2oqj h ALA 165 Ca 0.00 -0.34 -0.70 0.00 0.00 0.00 0.00 54.91 53.87 2oqj h ALA 165 Cb 0.00 -0.06 -0.31 0.00 0.00 0.00 0.00 17.79 17.42 2oqj h ALA 165 CO 0.00 0.47 -0.56 -1.17 0.00 0.00 0.00 179.25 177.99 2oqj s LEU 166 N -6.72 4.79 -0.09 0.00 2.96 -0.81 -4.90 118.68 113.90 2oqj s LEU 166 Ca 0.02 -1.52 0.03 0.00 -0.22 0.00 0.00 54.13 52.44 2oqj s LEU 166 Cb 0.09 -1.88 -0.08 0.00 0.50 0.00 0.00 46.19 44.83 2oqj s LEU 166 CO 0.69 -0.45 -0.05 0.35 -1.32 0.00 0.00 176.35 175.58 2oqj n THR 167 N 4.76 0.56 -1.84 3.68 -2.24 -1.26 -4.16 114.28 113.78 2oqj n THR 167 Ca -0.09 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.01 2oqj n THR 167 Cb 0.43 -0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 67.81 2oqj n THR 167 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2oqj s SER 168 N -4.59 6.46 0.00 3.42 0.15 -1.26 -2.95 113.70 114.93 2oqj s SER 168 Ca -0.10 2.83 0.00 0.00 0.70 0.00 0.00 55.95 59.38 2oqj s SER 168 Cb 0.03 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2oqj s SER 168 CO 0.26 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.45 2oqj n GLY 169 N 2.71 2.08 3.71 9.45 0.00 -1.26 -4.86 105.19 117.02 2oqj n GLY 169 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2oqj n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oqj s VAL 171 N -2.84 4.94 -0.22 1.61 1.01 -1.15 -3.17 120.40 120.58 2oqj s VAL 171 Ca 0.00 1.75 0.01 0.00 0.00 0.00 0.00 61.98 63.75 2oqj s VAL 171 Cb 0.00 -4.18 0.05 0.00 0.00 0.00 0.00 36.38 32.25 2oqj s VAL 171 CO 0.00 0.18 -0.09 -1.00 0.00 0.00 0.00 175.10 174.19 2oqj s HIS 172 N 1.07 2.65 -0.26 5.22 3.76 0.45 -5.00 115.29 123.19 2oqj s HIS 172 Ca 0.44 -1.84 -0.12 0.00 -0.15 0.00 0.00 55.06 53.40 2oqj s HIS 172 Cb -0.19 -1.71 -0.05 0.00 1.11 0.00 0.00 32.58 31.74 2oqj s HIS 172 CO 0.22 -0.79 0.23 0.99 -0.85 0.00 0.00 174.74 174.54 2oqj s THR 173 N 1.31 5.30 0.46 1.30 2.01 -1.26 -0.72 115.64 124.04 2oqj s THR 173 Ca -0.04 0.29 -0.10 0.00 0.31 0.00 0.00 61.69 62.14 2oqj s THR 173 Cb -0.18 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 68.71 2oqj s THR 173 CO -0.07 0.27 0.84 -0.36 -0.69 0.00 0.00 174.62 174.61 2oqj s PHE 174 N 1.50 3.50 0.69 4.92 0.40 -0.48 -5.01 117.98 123.51 2oqj s PHE 174 Ca 0.10 1.09 -0.17 0.00 -0.60 0.00 0.00 56.93 57.36 2oqj s PHE 174 Cb -0.15 -2.50 0.01 0.00 0.51 0.00 0.00 43.02 40.89 2oqj s PHE 174 CO 0.08 -0.25 1.25 -2.14 0.70 0.00 0.00 175.22 174.86 2oqj s PRO 175 N -4.21 2.34 0.88 0.24 0.02 -1.26 -4.61 135.00 128.39 2oqj s PRO 175 Ca 0.52 1.91 -0.11 0.00 0.02 0.00 0.00 61.00 63.34 2oqj s PRO 175 Cb -0.10 -1.84 0.12 0.00 0.02 0.00 0.00 34.50 32.70 2oqj s PRO 175 CO 0.37 -1.72 1.09 0.00 -0.33 0.00 0.00 177.00 176.41 2oqj s ALA 176 N -1.69 1.63 -0.03 -1.55 0.00 -1.26 -4.74 121.76 114.12 2oqj s ALA 176 Ca 0.78 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.81 2oqj s ALA 176 Cb -0.33 -3.23 0.02 0.00 0.00 0.00 0.00 23.12 19.58 2oqj s ALA 176 CO 0.42 -2.30 -0.05 0.08 0.00 0.00 0.00 175.76 173.91 2oqj s VAL 177 N -2.89 0.52 -0.29 0.00 1.01 -0.71 -4.92 120.40 113.13 2oqj s VAL 177 Ca 0.63 -0.15 -0.21 0.00 0.00 0.00 0.00 61.98 62.24 2oqj s VAL 177 Cb -0.18 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 2oqj s VAL 177 CO 0.57 0.21 0.68 -0.22 0.00 0.00 0.00 175.10 176.34 2oqj s LEU 178 N 0.67 4.10 0.58 3.92 2.96 -1.26 -0.61 118.68 129.04 2oqj s LEU 178 Ca -0.09 0.61 -0.04 0.00 -0.22 0.00 0.00 54.13 54.39 2oqj s LEU 178 Cb -0.12 -2.92 0.02 0.00 0.50 0.00 0.00 46.19 43.67 2oqj s LEU 178 CO 0.00 -0.49 0.86 -1.10 -1.32 0.00 0.00 176.35 174.30 2oqj s GLN 179 N 2.69 2.79 0.05 1.98 -0.21 0.02 -4.97 119.66 122.00 2oqj s GLN 179 Ca 0.28 -0.24 0.13 0.00 0.02 0.00 0.00 55.36 55.56 2oqj s GLN 179 Cb -0.15 -2.34 0.58 0.00 1.00 0.00 0.00 33.01 32.10 2oqj s GLN 179 CO 0.11 -0.70 1.42 -1.13 -2.12 0.00 0.00 175.29 172.87 2oqj n SER 180 N -2.51 0.12 -0.06 5.90 3.41 -1.26 -1.53 113.62 117.69 2oqj n SER 180 Ca 0.05 0.53 0.14 0.00 -0.26 0.00 0.00 58.87 59.33 2oqj n SER 180 Cb 0.58 -0.56 0.58 0.00 -0.26 0.00 0.00 64.21 64.56 2oqj n SER 180 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2oqj n SER 182 N -1.64 0.32 0.00 4.04 3.41 -1.26 -4.91 113.62 113.59 2oqj n SER 182 Ca 0.02 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 2oqj n SER 182 Cb 0.14 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2oqj n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oqj n GLY 183 N 1.35 0.63 3.74 5.00 0.00 -0.58 -5.06 105.19 110.27 2oqj n GLY 183 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 2oqj n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqj s LEU 184 N 0.00 3.58 0.28 0.99 2.01 -1.26 -4.90 118.68 119.38 2oqj s LEU 184 Ca 0.00 -0.24 -0.02 0.00 0.01 0.00 0.00 54.13 53.88 2oqj s LEU 184 Cb 0.00 -2.22 -0.04 0.00 0.01 0.00 0.00 46.19 43.94 2oqj s LEU 184 CO 0.00 0.08 0.50 -0.31 1.01 0.00 0.00 176.35 177.63 2oqj s TYR 185 N -1.72 3.49 -0.21 0.29 2.02 -0.72 -0.80 117.35 119.70 2oqj s TYR 185 Ca 0.29 0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 57.36 2oqj s TYR 185 Cb -0.10 -1.95 0.09 0.00 -0.40 0.00 0.00 41.96 39.60 2oqj s TYR 185 CO 0.21 0.23 0.45 0.45 -1.57 0.00 0.00 175.55 175.32 2oqj s SER 186 N -3.43 -0.39 0.35 2.29 0.15 0.23 -1.92 113.70 110.98 2oqj s SER 186 Ca 0.41 1.05 0.05 0.00 0.70 0.00 0.00 55.95 58.16 2oqj s SER 186 Cb -0.10 1.36 -0.07 0.00 -1.71 0.00 0.00 66.02 65.50 2oqj s SER 186 CO 0.31 -0.23 0.03 -1.48 1.20 0.00 0.00 173.24 173.08 2oqj s LEU 187 N 2.46 2.46 0.05 3.45 0.05 -0.90 -1.73 118.68 124.51 2oqj s LEU 187 Ca -0.03 -1.36 0.04 0.00 0.05 0.00 0.00 54.13 52.83 2oqj s LEU 187 Cb -0.11 -0.59 -0.02 0.00 -2.05 0.00 0.00 46.19 43.41 2oqj s LEU 187 CO -0.14 -0.52 -0.11 -0.94 -0.55 0.00 0.00 176.35 174.09 2oqj s SER 188 N -3.56 1.31 -0.12 1.48 1.04 -1.26 -0.81 113.70 111.77 2oqj s SER 188 Ca 0.35 -0.53 -0.00 0.00 0.48 0.00 0.00 55.95 56.25 2oqj s SER 188 Cb 0.09 -0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.20 2oqj s SER 188 CO 0.16 -0.09 -0.08 -0.55 0.98 0.00 0.00 173.24 173.66 2oqj s SER 189 N -1.46 2.30 0.30 7.02 0.15 -0.70 -1.38 113.70 119.92 2oqj s SER 189 Ca -0.04 -0.36 0.10 0.00 0.70 0.00 0.00 55.95 56.36 2oqj s SER 189 Cb -0.09 -0.89 -0.05 0.00 -1.71 0.00 0.00 66.02 63.28 2oqj s SER 189 CO 0.01 -0.12 -0.06 0.68 1.20 0.00 0.00 173.24 174.96 2oqj s VAL 190 N 1.68 2.86 -0.10 4.45 -7.23 0.10 -1.56 120.40 120.60 2oqj s VAL 190 Ca 0.05 -2.09 -0.09 0.00 -1.81 0.00 0.00 61.98 58.04 2oqj s VAL 190 Cb -0.13 -2.66 0.03 0.00 0.56 0.00 0.00 36.38 34.18 2oqj s VAL 190 CO -0.08 -0.32 0.27 0.54 -0.31 0.00 0.00 175.10 175.20 2oqj s VAL 191 N -2.45 -0.00 -0.18 1.32 0.11 -0.40 -0.41 120.40 118.38 2oqj s VAL 191 Ca 0.32 0.02 -0.09 0.00 -2.93 0.00 0.00 61.98 59.30 2oqj s VAL 191 Cb -0.04 -0.39 -0.05 0.00 -1.53 0.00 0.00 36.38 34.38 2oqj s VAL 191 CO 0.18 0.01 0.13 0.42 -3.33 0.00 0.00 175.10 172.51 2oqj s THR 192 N 0.29 5.40 0.11 5.04 -4.23 -1.19 -1.82 115.64 119.24 2oqj s THR 192 Ca -0.01 0.18 0.01 0.00 -1.18 0.00 0.00 61.69 60.70 2oqj s THR 192 Cb -0.03 -3.44 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 2oqj s THR 192 CO -0.01 0.47 -0.04 0.68 -0.54 0.00 0.00 174.62 175.18 2oqj s VAL 193 N 0.10 0.62 0.41 2.29 -7.23 0.11 -4.78 120.40 111.93 2oqj s VAL 193 Ca 0.09 -1.93 -0.27 0.00 -1.81 0.00 0.00 61.98 58.06 2oqj s VAL 193 Cb -0.11 -1.77 -0.10 0.00 0.56 0.00 0.00 36.38 34.96 2oqj s VAL 193 CO -0.01 -0.79 1.46 -2.84 -0.31 0.00 0.00 175.10 172.61 2oqj s PRO 194 N -3.87 3.91 0.36 4.82 0.02 -1.26 -0.15 135.00 138.83 2oqj s PRO 194 Ca 0.14 2.50 0.08 0.00 0.02 0.00 0.00 61.00 63.74 2oqj s PRO 194 Cb 0.06 -2.82 0.67 0.00 0.02 0.00 0.00 34.50 32.43 2oqj s PRO 194 CO -0.03 -0.67 1.86 0.77 -0.33 0.00 0.00 177.00 178.60 2oqj h SER 195 N 2.68 0.29 0.46 2.53 0.02 -1.67 -2.85 113.55 115.02 2oqj h SER 195 Ca -0.51 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.30 2oqj h SER 195 Cb 1.25 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 2oqj h SER 195 CO 0.63 0.48 -0.33 0.77 -1.14 0.00 0.00 176.83 177.23 2oqj h SER 196 N 0.29 0.00 1.26 3.07 4.64 -1.84 -2.92 113.55 118.05 2oqj h SER 196 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2oqj h SER 196 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2oqj h SER 196 CO 0.03 0.33 0.00 0.77 -0.87 0.00 0.00 176.83 177.09 2oqj h SER 197 N 0.00 0.00 -0.44 4.97 4.64 -1.89 -3.32 113.55 117.51 2oqj h SER 197 Ca -0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 2oqj h SER 197 Cb 0.65 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.71 2oqj h SER 197 CO 0.04 0.00 0.22 -0.07 -0.87 0.00 0.00 176.83 176.16 2oqj h LEU 198 N 0.00 0.33 0.00 5.97 3.38 -1.61 0.91 115.31 124.30 2oqj h LEU 198 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2oqj h LEU 198 Cb 0.63 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2oqj h LEU 198 CO 0.00 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.38 2oqj n GLY 199 N -1.23 -0.82 1.83 0.83 0.00 -1.25 -4.15 105.19 100.40 2oqj n GLY 199 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2oqj n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oqj n THR 200 N -0.57 0.20 -2.36 2.61 -2.24 -1.06 -5.09 114.28 105.77 2oqj n THR 200 Ca 0.03 0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 2oqj n THR 200 Cb 0.01 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 67.57 2oqj n THR 200 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2oqj s GLN 203 N -1.91 4.31 0.42 -0.78 2.00 0.29 -5.03 119.66 118.96 2oqj s GLN 203 Ca 0.00 1.79 -0.13 0.00 -2.00 0.00 0.00 55.36 55.02 2oqj s GLN 203 Cb 0.00 -3.59 -0.07 0.00 0.80 0.00 0.00 33.01 30.15 2oqj s GLN 203 CO 0.00 -0.53 0.83 0.95 -0.50 0.00 0.00 175.29 176.05 2oqj s THR 205 N 2.43 4.68 -0.09 -0.34 -4.23 -1.26 -4.63 115.64 112.20 2oqj s THR 205 Ca 0.59 0.88 -0.00 0.00 -1.18 0.00 0.00 61.69 61.98 2oqj s THR 205 Cb -0.27 -3.70 0.02 0.00 1.34 0.00 0.00 72.50 69.89 2oqj s THR 205 CO 0.23 -0.51 -0.05 -0.31 -0.54 0.00 0.00 174.62 173.44 2oqj s TYR 206 N -2.37 1.16 -0.10 3.99 2.02 -1.26 -5.01 117.35 115.78 2oqj s TYR 206 Ca 0.54 -0.49 0.04 0.00 -0.37 0.00 0.00 57.07 56.79 2oqj s TYR 206 Cb -0.10 -1.03 0.00 0.00 -0.40 0.00 0.00 41.96 40.43 2oqj s TYR 206 CO 0.28 -0.40 -0.22 0.42 -1.57 0.00 0.00 175.55 174.06 2oqj s ILE 207 N 1.59 1.95 -0.12 2.71 1.01 -1.26 -1.35 121.20 125.73 2oqj s ILE 207 Ca 0.01 -0.95 -0.15 0.00 0.00 0.00 0.00 60.65 59.56 2oqj s ILE 207 Cb -0.13 -1.69 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 2oqj s ILE 207 CO -0.05 0.54 0.35 0.00 0.00 0.00 0.00 174.94 175.77 2oqj s ASN 209 N 0.22 5.69 -0.25 0.00 -0.87 0.32 -1.96 114.94 118.09 2oqj s ASN 209 Ca 0.20 -1.43 -0.09 0.00 -1.57 0.00 0.00 52.86 49.97 2oqj s ASN 209 Cb -0.14 -2.01 -0.04 0.00 -0.02 0.00 0.00 41.25 39.04 2oqj s ASN 209 CO 0.07 -0.53 0.12 -0.69 -2.57 0.00 0.00 177.10 173.50 2oqj s VAL 210 N 1.46 4.82 -0.15 1.60 1.01 0.99 -1.13 120.40 129.00 2oqj s VAL 210 Ca 0.03 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.03 2oqj s VAL 210 Cb -0.23 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.91 2oqj s VAL 210 CO 0.03 0.33 -0.21 0.21 0.00 0.00 0.00 175.10 175.46 2oqj s ASN 211 N 1.42 3.19 -0.47 3.32 2.47 -0.37 -0.24 114.94 124.25 2oqj s ASN 211 Ca 0.06 -0.59 0.04 0.00 0.42 0.00 0.00 52.86 52.79 2oqj s ASN 211 Cb -0.15 -1.46 0.12 0.00 -1.45 0.00 0.00 41.25 38.31 2oqj s ASN 211 CO 0.06 0.07 0.20 -2.28 -3.72 0.00 0.00 177.10 171.43 2oqj s HIS 212 N 0.87 3.29 0.26 0.43 5.65 0.12 -0.59 115.29 125.33 2oqj s HIS 212 Ca -0.05 -3.09 -0.05 0.00 0.25 0.00 0.00 55.06 52.11 2oqj s HIS 212 Cb -0.15 -2.81 0.32 0.00 -1.18 0.00 0.00 32.58 28.75 2oqj s HIS 212 CO -0.03 -0.80 1.94 0.87 -0.65 0.00 0.00 174.74 176.07 2oqj h LYS 213 N 6.82 1.26 -0.51 2.88 1.79 -1.82 -2.35 116.57 124.65 2oqj h LYS 213 Ca -0.07 -0.08 0.10 0.00 -2.18 0.00 0.00 60.65 58.43 2oqj h LYS 213 Cb 0.93 -0.28 -0.09 0.00 -1.58 0.00 0.00 32.23 31.21 2oqj h LYS 213 CO 0.63 0.83 -0.01 -1.35 -1.08 0.00 0.00 179.45 178.48 2oqj h PRO 214 N 1.30 0.10 -0.26 3.15 0.11 -1.91 -2.79 132.00 131.70 2oqj h PRO 214 Ca 0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2oqj h PRO 214 Cb -0.14 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 30.95 2oqj h PRO 214 CO -0.08 0.07 0.00 -1.13 -0.21 0.00 0.00 178.00 176.65 2oqj n SER 215 N -5.25 2.57 -3.73 -2.05 3.41 -1.14 -4.95 113.62 102.48 2oqj n SER 215 Ca 0.06 -1.86 -0.23 0.00 -0.26 0.00 0.00 58.87 56.58 2oqj n SER 215 Cb 0.28 -0.16 0.03 0.00 -0.26 0.00 0.00 64.21 64.10 2oqj n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2oqj n ASN 216 N 0.92 -1.97 -4.17 4.04 5.15 -0.98 -4.93 115.26 113.33 2oqj n ASN 216 Ca 0.17 -0.80 -0.33 0.00 -0.60 0.00 0.00 54.58 53.03 2oqj n ASN 216 Cb 0.47 -4.09 -0.16 0.00 -0.53 0.00 0.00 39.78 35.47 2oqj n ASN 216 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2oqj s THR 217 N -3.59 2.15 -0.09 -0.44 2.01 -0.92 -5.03 115.64 109.73 2oqj s THR 217 Ca 0.13 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 61.23 2oqj s THR 217 Cb -0.07 -1.87 -0.01 0.00 0.01 0.00 0.00 72.50 70.56 2oqj s THR 217 CO 0.81 0.54 -0.21 -0.54 -0.69 0.00 0.00 174.62 174.53 2oqj s LYS 218 N 0.94 2.98 -0.05 4.92 1.02 -1.26 -0.71 119.74 127.59 2oqj s LYS 218 Ca -0.04 -0.83 0.02 0.00 0.02 0.00 0.00 55.97 55.14 2oqj s LYS 218 Cb -0.15 -2.35 0.02 0.00 -0.52 0.00 0.00 37.83 34.82 2oqj s LYS 218 CO -0.04 0.26 -0.08 0.08 -0.92 0.00 0.00 175.35 174.65 2oqj s VAL 219 N 0.16 0.81 -0.21 3.17 1.01 0.67 -5.00 120.40 121.01 2oqj s VAL 219 Ca -0.12 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 2oqj s VAL 219 Cb -0.16 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 2oqj s VAL 219 CO 0.06 0.28 -0.05 -1.81 0.00 0.00 0.00 175.10 173.58 2oqj s ASP 220 N 0.69 4.28 -0.10 3.32 1.01 -1.26 -0.00 116.67 124.61 2oqj s ASP 220 Ca -0.12 -0.37 0.02 0.00 0.71 0.00 0.00 52.55 52.80 2oqj s ASP 220 Cb -0.14 -1.72 -0.01 0.00 1.01 0.00 0.00 42.92 42.05 2oqj s ASP 220 CO 0.02 0.01 -0.18 -0.75 0.21 0.00 0.00 175.17 174.48 2oqj s LYS 221 N 1.28 3.10 -0.08 8.23 2.47 -0.83 -4.96 119.74 128.95 2oqj s LYS 221 Ca 0.03 -0.78 -0.26 0.00 -1.56 0.00 0.00 55.97 53.41 2oqj s LYS 221 Cb -0.14 -2.44 -0.03 0.00 -1.46 0.00 0.00 37.83 33.76 2oqj s LYS 221 CO -0.02 0.26 0.82 0.21 0.16 0.00 0.00 175.35 176.78 2oqj s LYS 222 N 0.19 4.43 -0.24 4.03 2.20 -1.26 -1.72 119.74 127.37 2oqj s LYS 222 Ca -0.11 1.08 -0.01 0.00 -0.36 0.00 0.00 55.97 56.57 2oqj s LYS 222 Cb -0.16 -3.49 0.03 0.00 -1.51 0.00 0.00 37.83 32.70 2oqj s LYS 222 CO 0.06 -0.08 -0.09 0.08 -0.36 0.00 0.00 175.35 174.96 2oqj s VAL 225 N 1.25 2.70 0.02 4.02 1.01 -0.46 -4.91 120.40 124.03 2oqj s VAL 225 Ca 0.42 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2oqj s VAL 225 Cb -0.18 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 2oqj s VAL 225 CO 0.19 0.25 0.07 -1.61 0.00 0.00 0.00 175.10 174.00 2oqj s GLU 226 N 1.31 0.46 0.68 2.72 2.02 -1.26 -4.20 118.70 120.42 2oqj s GLU 226 Ca 0.00 -0.59 -0.15 0.00 0.02 0.00 0.00 54.97 54.25 2oqj s GLU 226 Cb -0.16 0.18 0.01 0.00 0.10 0.00 0.00 34.13 34.26 2oqj s GLU 226 CO -0.06 -0.10 1.15 -1.25 0.02 0.00 0.00 175.26 175.02 2oqj s PRO 227 N -1.81 2.55 0.00 0.39 0.04 -1.26 -4.75 135.00 130.16 2oqj s PRO 227 Ca -0.12 1.57 0.13 0.00 0.04 0.00 0.00 61.00 62.62 2oqj s PRO 227 Cb -0.06 -1.90 0.76 0.00 0.04 0.00 0.00 34.50 33.34 2oqj s PRO 227 CO -0.01 -1.47 1.19 1.63 0.04 0.00 0.00 177.00 178.38