#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qij h GLU 5 N 0.00 0.00 -0.11 -1.46 4.81 -2.03 -2.07 114.58 113.73 1qij h GLU 5 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1qij h GLU 5 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1qij h GLU 5 CO 0.00 0.09 0.00 1.28 -0.73 0.00 0.00 179.01 179.65 1qij n LEU 6 N -3.61 1.93 -4.40 1.64 4.77 -1.26 -4.81 117.00 111.26 1qij n LEU 6 Ca -0.02 -0.72 -0.34 0.00 -0.03 0.00 0.00 56.01 54.89 1qij n LEU 6 Cb 0.20 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.10 1qij n LEU 6 CO 0.29 0.36 -0.37 -0.22 -1.33 0.00 0.00 177.39 176.12 1qij s LEU 7 N -1.79 3.05 -0.01 2.23 2.96 -0.78 0.24 118.68 124.58 1qij s LEU 7 Ca 0.35 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.02 1qij s LEU 7 Cb 0.20 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 1qij s LEU 7 CO 0.30 0.07 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.58 1qij s VAL 8 N 0.97 1.01 -0.38 1.68 1.01 -0.27 -4.78 120.40 119.64 1qij s VAL 8 Ca 0.00 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.38 1qij s VAL 8 Cb -0.15 -0.86 0.06 0.00 0.00 0.00 0.00 36.38 35.44 1qij s VAL 8 CO 0.01 0.29 0.17 0.21 0.00 0.00 0.00 175.10 175.78 1qij s ASN 9 N -0.21 5.41 0.64 3.32 2.47 -1.26 0.22 114.94 125.52 1qij s ASN 9 Ca 0.03 -1.41 0.06 0.00 0.42 0.00 0.00 52.86 51.96 1qij s ASN 9 Cb -0.06 -1.90 0.11 0.00 -1.45 0.00 0.00 41.25 37.95 1qij s ASN 9 CO -0.00 -0.43 0.88 0.42 -3.72 0.00 0.00 177.10 174.24 1qij s THR 10 N 1.37 2.08 -1.32 -5.21 -4.23 -0.39 -4.94 115.64 103.00 1qij s THR 10 Ca 0.01 -0.86 0.23 0.00 -1.18 0.00 0.00 61.69 59.89 1qij s THR 10 Cb -0.21 -2.22 0.35 0.00 1.34 0.00 0.00 72.50 71.76 1qij s THR 10 CO 0.01 0.00 1.76 0.29 -0.54 0.00 0.00 174.62 176.15 1qij n LYS 11 N -2.48 0.25 -0.00 3.99 5.02 -1.26 -2.61 118.16 121.06 1qij n LYS 11 Ca 0.16 0.08 0.08 0.00 -2.02 0.00 0.00 58.31 56.61 1qij n LYS 11 Cb 0.61 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.01 1qij n LYS 11 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1qij n SER 12 N -1.34 0.92 0.00 4.39 7.64 -1.26 -4.93 113.62 119.04 1qij n SER 12 Ca 0.10 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.48 1qij n SER 12 Cb 0.21 1.34 0.00 0.00 -1.01 0.00 0.00 64.21 64.75 1qij n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qij n GLY 13 N 1.45 0.25 3.83 0.23 0.00 -1.07 -1.35 105.19 108.52 1qij n GLY 13 Ca 0.00 -1.83 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 1qij n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qij s LYS 14 N -1.22 4.17 -0.04 1.61 1.02 -1.25 -1.26 119.74 122.77 1qij s LYS 14 Ca 0.00 0.88 0.02 0.00 0.02 0.00 0.00 55.97 56.89 1qij s LYS 14 Cb 0.00 -2.51 0.01 0.00 -0.52 0.00 0.00 37.83 34.81 1qij s LYS 14 CO 0.00 0.18 -0.07 0.08 -0.92 0.00 0.00 175.35 174.62 1qij s VAL 15 N -1.89 0.67 -0.35 3.17 1.01 0.13 -0.55 120.40 122.59 1qij s VAL 15 Ca 0.53 -0.24 -0.09 0.00 0.00 0.00 0.00 61.98 62.18 1qij s VAL 15 Cb -0.12 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.64 1qij s VAL 15 CO 0.18 0.24 0.15 -0.32 0.00 0.00 0.00 175.10 175.35 1qij s MET 16 N 0.63 2.78 0.00 2.72 1.75 0.16 -1.12 119.30 126.22 1qij s MET 16 Ca -0.09 -1.09 0.00 0.00 -1.25 0.00 0.00 55.69 53.26 1qij s MET 16 Cb -0.13 -3.59 0.00 0.00 2.84 0.00 0.00 34.83 33.95 1qij s MET 16 CO 0.01 -0.66 0.00 0.41 -0.65 0.00 0.00 175.02 174.13 1qij n GLY 17 N 4.91 0.36 3.11 2.11 0.00 0.14 -0.41 105.19 115.41 1qij n GLY 17 Ca -0.12 -1.89 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 1qij n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1qij s THR 18 N -0.02 0.60 -0.04 2.61 -1.32 -0.24 -4.78 115.64 112.45 1qij s THR 18 Ca 0.00 -1.45 -0.19 0.00 -1.21 0.00 0.00 61.69 58.84 1qij s THR 18 Cb 0.00 -1.07 -0.05 0.00 -1.51 0.00 0.00 72.50 69.87 1qij s THR 18 CO 0.00 -0.60 0.53 -0.60 -2.21 0.00 0.00 174.62 171.75 1qij s ARG 19 N -2.55 4.27 0.03 7.08 3.52 -1.26 -0.70 118.95 129.34 1qij s ARG 19 Ca -0.01 0.60 0.06 0.00 -0.13 0.00 0.00 55.73 56.24 1qij s ARG 19 Cb -0.03 -3.36 -0.02 0.00 -1.56 0.00 0.00 34.95 29.98 1qij s ARG 19 CO -0.02 0.34 -0.16 0.14 -0.81 0.00 0.00 175.30 174.78 1qij s VAL 20 N -0.02 1.31 0.30 7.11 -7.23 0.73 -4.96 120.40 117.64 1qij s VAL 20 Ca 0.28 -0.97 -0.24 0.00 -1.81 0.00 0.00 61.98 59.24 1qij s VAL 20 Cb -0.17 -1.14 -0.10 0.00 0.56 0.00 0.00 36.38 35.53 1qij s VAL 20 CO 0.14 0.15 0.89 -2.16 -0.31 0.00 0.00 175.10 173.82 1qij s PRO 21 N -0.95 4.49 -0.22 4.82 0.04 -1.26 -1.27 135.00 140.66 1qij s PRO 21 Ca 0.04 1.21 -0.10 0.00 0.04 0.00 0.00 61.00 62.19 1qij s PRO 21 Cb -0.08 -2.79 0.08 0.00 0.04 0.00 0.00 34.50 31.75 1qij s PRO 21 CO 0.01 0.29 0.50 0.54 0.04 0.00 0.00 177.00 178.38 1qij s VAL 22 N -1.62 -0.27 -1.55 -0.36 0.11 -0.49 -4.93 120.40 111.28 1qij s VAL 22 Ca 0.49 0.08 -0.02 0.00 -2.93 0.00 0.00 61.98 59.60 1qij s VAL 22 Cb -0.18 -0.76 0.02 0.00 -1.53 0.00 0.00 36.38 33.94 1qij s VAL 22 CO 0.23 0.03 0.13 0.18 -3.33 0.00 0.00 175.10 172.34 1qij n LEU 23 N 4.68 -1.19 -3.40 2.54 4.77 -1.26 -1.69 117.00 121.45 1qij n LEU 23 Ca -0.18 -1.22 -0.12 0.00 -0.03 0.00 0.00 56.01 54.46 1qij n LEU 23 Cb 0.54 -1.71 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 1qij n LEU 23 CO 0.03 0.44 0.08 -1.54 -1.33 0.00 0.00 177.39 175.06 1qij n SER 24 N -2.88 -6.45 0.00 -1.43 3.41 -1.26 -4.98 113.62 100.03 1qij n SER 24 Ca -0.29 -0.50 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 1qij n SER 24 Cb 0.68 -3.70 0.00 0.00 -0.26 0.00 0.00 64.21 60.92 1qij n SER 24 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1qij n SER 25 N -2.18 0.00 -3.80 4.04 2.88 -0.68 -5.20 113.62 108.68 1qij n SER 25 Ca -0.14 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.30 1qij n SER 25 Cb 0.59 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.97 1qij n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1qij s HIS 26 N -3.00 0.01 0.21 0.66 3.76 -1.26 -1.40 115.29 114.27 1qij s HIS 26 Ca 0.00 -0.29 -0.09 0.00 -0.15 0.00 0.00 55.06 54.53 1qij s HIS 26 Cb 0.00 0.03 -0.01 0.00 1.11 0.00 0.00 32.58 33.71 1qij s HIS 26 CO 0.00 -0.52 0.34 0.96 -0.85 0.00 0.00 174.74 174.67 1qij s ILE 27 N -3.17 0.02 0.23 0.60 -4.36 -0.39 -4.39 121.20 109.73 1qij s ILE 27 Ca -0.01 -1.54 -0.04 0.00 -0.26 0.00 0.00 60.65 58.81 1qij s ILE 27 Cb 0.01 -2.17 -0.05 0.00 1.25 0.00 0.00 42.46 41.50 1qij s ILE 27 CO -0.07 -0.08 0.46 -0.44 0.24 0.00 0.00 174.94 175.05 1qij s SER 28 N -3.04 6.45 -0.12 4.36 0.01 -0.33 -0.20 113.70 120.83 1qij s SER 28 Ca 0.25 0.60 -0.05 0.00 1.31 0.00 0.00 55.95 58.06 1qij s SER 28 Cb 0.02 -2.09 0.06 0.00 0.21 0.00 0.00 66.02 64.22 1qij s SER 28 CO 0.07 -0.09 0.26 0.00 0.41 0.00 0.00 173.24 173.89 1qij s ALA 29 N -1.91 -0.54 -0.43 1.44 0.00 0.13 -1.48 121.76 118.97 1qij s ALA 29 Ca 0.42 0.93 -0.06 0.00 0.00 0.00 0.00 51.96 53.25 1qij s ALA 29 Cb -0.11 -0.93 0.11 0.00 0.00 0.00 0.00 23.12 22.18 1qij s ALA 29 CO 0.28 -0.55 0.25 -0.06 0.00 0.00 0.00 175.76 175.68 1qij s PHE 30 N 2.18 3.50 -0.09 0.00 0.40 -0.15 -1.08 117.98 122.73 1qij s PHE 30 Ca -0.01 -2.13 -0.05 0.00 -0.60 0.00 0.00 56.93 54.14 1qij s PHE 30 Cb -0.12 -3.24 -0.04 0.00 0.51 0.00 0.00 43.02 40.14 1qij s PHE 30 CO -0.08 -0.96 0.13 -0.51 0.70 0.00 0.00 175.22 174.50 1qij s LEU 31 N 1.25 4.29 -0.72 -0.37 1.43 0.20 -1.17 118.68 123.60 1qij s LEU 31 Ca 0.06 0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 53.53 1qij s LEU 31 Cb -0.24 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.83 1qij s LEU 31 CO -0.02 0.37 0.41 0.61 0.23 0.00 0.00 176.35 177.95 1qij n GLY 32 N 1.77 0.15 3.71 -3.19 0.00 -1.10 -3.94 105.19 102.59 1qij n GLY 32 Ca -0.18 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 1qij n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qij s ILE 33 N -2.96 4.63 0.40 -0.61 1.01 -0.24 -4.75 121.20 118.67 1qij s ILE 33 Ca 0.20 1.94 -0.21 0.00 0.00 0.00 0.00 60.65 62.58 1qij s ILE 33 Cb -0.09 -4.24 -0.11 0.00 0.01 0.00 0.00 42.46 38.04 1qij s ILE 33 CO 0.25 0.18 0.92 -2.16 0.00 0.00 0.00 174.94 174.13 1qij s PRO 34 N 0.82 4.27 0.00 2.79 0.04 -1.26 -0.05 135.00 141.60 1qij s PRO 34 Ca 0.52 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1qij s PRO 34 Cb -0.23 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 31.99 1qij s PRO 34 CO 0.29 0.05 0.16 1.97 0.04 0.00 0.00 177.00 179.50 1qij n PHE 35 N -0.40 0.00 -3.70 0.56 1.16 -1.18 -4.90 117.46 109.00 1qij n PHE 35 Ca 0.06 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.54 1qij n PHE 35 Cb 0.53 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.35 1qij n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1qij s ALA 36 N -0.13 -0.72 0.39 1.98 0.00 -1.26 -3.55 121.76 118.47 1qij s ALA 36 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 51.96 51.51 1qij s ALA 36 Cb 0.00 0.62 -0.09 0.00 0.00 0.00 0.00 23.12 23.65 1qij s ALA 36 CO 0.00 -0.60 1.12 -1.21 0.00 0.00 0.00 175.76 175.07 1qij s GLU 37 N -3.77 4.12 -0.19 0.00 0.41 0.45 -4.51 118.70 115.22 1qij s GLU 37 Ca 0.03 1.71 -0.35 0.00 -0.41 0.00 0.00 54.97 55.95 1qij s GLU 37 Cb 0.03 -2.65 -0.12 0.00 -1.78 0.00 0.00 34.13 29.61 1qij s GLU 37 CO -0.11 -0.23 1.97 -2.30 -0.49 0.00 0.00 175.26 174.10 1qij n PRO 38 N 0.07 1.76 -0.69 0.39 -0.02 -1.26 -4.69 135.00 130.57 1qij n PRO 38 Ca 0.04 0.61 -0.08 0.00 -2.02 0.00 0.00 63.50 62.05 1qij n PRO 38 Cb 0.48 -2.58 -0.11 0.00 -0.02 0.00 0.00 33.50 31.26 1qij n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1qij n PRO 39 N 7.04 1.38 -2.97 0.52 -0.04 -1.26 -4.89 135.00 134.78 1qij n PRO 39 Ca 0.28 -0.64 -0.20 0.00 -0.04 0.00 0.00 63.50 62.90 1qij n PRO 39 Cb 0.27 -1.77 0.07 0.00 -0.04 0.00 0.00 33.50 32.03 1qij n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1qij s VAL 40 N 1.38 2.12 0.00 0.52 -7.23 -1.26 -3.55 120.40 112.37 1qij s VAL 40 Ca 0.43 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.65 1qij s VAL 40 Cb 0.21 -2.17 0.00 0.00 0.56 0.00 0.00 36.38 34.97 1qij s VAL 40 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1qij n GLY 41 N -2.34 3.16 0.00 2.32 0.00 -1.26 -0.60 105.19 106.48 1qij n GLY 41 Ca 0.16 0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.23 1qij n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qij n ASN 42 N 3.60 0.00 -0.05 1.61 4.13 -1.26 -1.90 115.26 121.39 1qij n ASN 42 Ca 0.00 0.30 0.13 0.00 1.68 0.00 0.00 54.58 56.69 1qij n ASN 42 Cb 0.00 -0.37 0.38 0.00 -1.54 0.00 0.00 39.78 38.24 1qij n ASN 42 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1qij n MET 43 N -1.37 0.19 -1.72 3.52 2.81 0.24 -4.81 117.12 115.97 1qij n MET 43 Ca 0.03 -0.09 -0.42 0.00 -1.81 0.00 0.00 57.70 55.41 1qij n MET 43 Cb 0.08 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.08 1qij n MET 43 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 1qij n ARG 44 N -1.32 2.43 0.00 0.03 0.63 -0.80 -1.25 116.66 116.38 1qij n ARG 44 Ca 0.08 0.86 0.00 0.00 -0.92 0.00 0.00 57.85 57.87 1qij n ARG 44 Cb 0.33 -2.57 0.00 0.00 0.45 0.00 0.00 32.46 30.67 1qij n ARG 44 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1qij n PHE 45 N 1.46 0.00 -2.53 -0.14 3.72 -1.26 -4.92 117.46 113.79 1qij n PHE 45 Ca 0.07 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.20 1qij n PHE 45 Cb 0.36 -0.28 0.01 0.00 -0.94 0.00 0.00 39.48 38.63 1qij n PHE 45 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1qij s ARG 46 N 0.00 3.36 0.51 -1.08 3.52 -0.38 -4.12 118.95 120.75 1qij s ARG 46 Ca 0.00 0.16 -0.22 0.00 -0.13 0.00 0.00 55.73 55.53 1qij s ARG 46 Cb 0.00 -2.33 -0.06 0.00 -1.56 0.00 0.00 34.95 31.00 1qij s ARG 46 CO 0.00 -0.37 1.30 1.03 -0.81 0.00 0.00 175.30 176.45 1qij s ARG 47 N -4.83 3.40 0.40 5.12 0.52 -1.26 -4.95 118.95 117.34 1qij s ARG 47 Ca 0.50 2.10 -0.25 0.00 -0.52 0.00 0.00 55.73 57.56 1qij s ARG 47 Cb -0.10 -2.35 -0.08 0.00 0.52 0.00 0.00 34.95 32.93 1qij s ARG 47 CO 0.45 -0.94 1.15 -1.25 0.02 0.00 0.00 175.30 174.73 1qij s PRO 48 N -2.78 4.07 0.02 3.54 0.04 -1.26 -5.04 135.00 133.58 1qij s PRO 48 Ca 0.68 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.54 1qij s PRO 48 Cb -0.37 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.47 1qij s PRO 48 CO 0.44 -0.29 -0.04 -1.21 0.04 0.00 0.00 177.00 175.94 1qij s GLU 49 N -2.32 2.60 0.38 4.56 0.41 -1.26 -5.00 118.70 118.07 1qij s GLU 49 Ca 0.57 -0.72 -0.26 0.00 -0.41 0.00 0.00 54.97 54.15 1qij s GLU 49 Cb -0.29 -2.55 -0.11 0.00 -1.78 0.00 0.00 34.13 29.40 1qij s GLU 49 CO 0.37 0.60 1.19 -2.30 -0.49 0.00 0.00 175.26 174.63 1qij n PRO 50 N 1.37 1.81 -2.14 0.39 -0.02 -1.26 -0.41 135.00 134.74 1qij n PRO 50 Ca -0.15 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1qij n PRO 50 Cb 0.52 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 1qij n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1qij s LYS 51 N -1.98 4.32 0.17 -0.52 2.47 -1.23 -4.20 119.74 118.77 1qij s LYS 51 Ca 0.59 2.12 -0.30 0.00 -1.56 0.00 0.00 55.97 56.82 1qij s LYS 51 Cb -0.56 -3.22 -0.08 0.00 -1.46 0.00 0.00 37.83 32.52 1qij s LYS 51 CO 0.59 -0.41 1.22 0.15 0.16 0.00 0.00 175.35 177.06 1qij s LYS 52 N 0.73 4.47 0.83 4.03 1.02 -1.26 -4.94 119.74 124.61 1qij s LYS 52 Ca 0.63 1.89 -0.15 0.00 0.02 0.00 0.00 55.97 58.35 1qij s LYS 52 Cb -0.38 -3.25 -0.05 0.00 -0.52 0.00 0.00 37.83 33.63 1qij s LYS 52 CO 0.33 -0.14 0.17 -2.30 -0.92 0.00 0.00 175.35 172.49 1qij n PRO 53 N 2.76 0.03 -4.22 -1.68 -0.02 -1.26 -5.01 135.00 125.60 1qij n PRO 53 Ca 0.05 0.04 -0.15 0.00 -2.02 0.00 0.00 63.50 61.43 1qij n PRO 53 Cb 0.45 -1.60 -0.10 0.00 -0.02 0.00 0.00 33.50 32.22 1qij n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 1qij s TRP 54 N -2.09 1.20 0.17 6.00 -2.14 -0.46 -5.03 118.94 116.60 1qij s TRP 54 Ca 0.57 -0.69 0.04 0.00 2.66 0.00 0.00 56.10 58.68 1qij s TRP 54 Cb -0.29 -0.63 -0.04 0.00 -3.10 0.00 0.00 33.47 29.42 1qij s TRP 54 CO 0.66 0.06 0.24 -1.12 -2.66 0.00 0.00 176.95 174.13 1qij s SER 55 N -2.78 6.00 0.00 -2.66 0.01 -1.26 -4.52 113.70 108.48 1qij s SER 55 Ca 0.11 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.39 1qij s SER 55 Cb -0.01 -1.71 0.00 0.00 0.21 0.00 0.00 66.02 64.52 1qij s SER 55 CO 0.01 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.30 1qij n GLY 56 N -0.65 -1.79 3.32 3.44 0.00 -1.26 -4.86 105.19 103.41 1qij n GLY 56 Ca -0.08 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 1qij n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qij s VAL 57 N 0.00 3.10 0.12 1.61 1.01 -1.26 -3.78 120.40 121.20 1qij s VAL 57 Ca 0.00 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 1qij s VAL 57 Cb 0.00 -2.35 -0.06 0.00 0.00 0.00 0.00 36.38 33.97 1qij s VAL 57 CO 0.00 0.49 1.05 0.86 0.00 0.00 0.00 175.10 177.49 1qij s TRP 58 N 0.89 3.66 -0.71 5.22 -0.11 0.28 -4.82 118.94 123.36 1qij s TRP 58 Ca -0.02 1.65 -0.23 0.00 1.22 0.00 0.00 56.10 58.71 1qij s TRP 58 Cb -0.15 -3.20 0.07 0.00 -1.50 0.00 0.00 33.47 28.69 1qij s TRP 58 CO 0.00 -0.33 1.07 1.21 -4.62 0.00 0.00 176.95 174.28 1qij s ASN 59 N 0.18 6.22 -0.76 5.86 3.84 -1.26 0.36 114.94 129.38 1qij s ASN 59 Ca 0.50 -0.97 0.00 0.00 0.21 0.00 0.00 52.86 52.60 1qij s ASN 59 Cb -0.26 -2.46 0.36 0.00 -0.55 0.00 0.00 41.25 38.34 1qij s ASN 59 CO 0.32 -1.51 1.70 0.00 -2.79 0.00 0.00 177.10 174.82 1qij n ALA 60 N 8.04 5.98 0.61 1.71 0.00 0.45 -4.63 120.51 132.68 1qij n ALA 60 Ca 0.01 -4.29 0.07 0.00 0.00 0.00 0.00 53.44 49.23 1qij n ALA 60 Cb 0.47 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1qij n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1qij n SER 61 N -0.43 1.52 -4.08 0.00 3.41 -1.25 0.62 113.62 113.40 1qij n SER 61 Ca 0.48 -1.26 -0.14 0.00 -0.26 0.00 0.00 58.87 57.69 1qij n SER 61 Cb 0.35 0.44 -0.11 0.00 -0.26 0.00 0.00 64.21 64.62 1qij n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1qij s THR 62 N -1.67 0.65 0.64 6.66 -4.23 -1.26 -4.87 115.64 111.56 1qij s THR 62 Ca 0.12 -1.14 -0.18 0.00 -1.18 0.00 0.00 61.69 59.31 1qij s THR 62 Cb 0.11 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 73.21 1qij s THR 62 CO 0.34 -0.36 1.06 -1.22 -0.54 0.00 0.00 174.62 173.89 1qij n TYR 63 N 1.40 1.11 -1.91 3.99 4.01 -1.26 -4.05 117.16 120.45 1qij n TYR 63 Ca -0.22 0.42 -0.20 0.00 -0.16 0.00 0.00 57.90 57.74 1qij n TYR 63 Cb 0.55 -2.16 0.13 0.00 -0.31 0.00 0.00 39.34 37.54 1qij n TYR 63 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1qij n PRO 64 N -1.42 -0.66 -1.77 -0.72 -0.04 -1.26 -4.88 135.00 124.24 1qij n PRO 64 Ca 0.15 -1.64 -0.29 0.00 -0.04 0.00 0.00 63.50 61.67 1qij n PRO 64 Cb 0.48 -0.86 0.12 0.00 -0.04 0.00 0.00 33.50 33.20 1qij n PRO 64 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1qij s ASN 65 N -4.40 3.88 0.02 3.54 0.01 -1.26 -4.88 114.94 111.84 1qij s ASN 65 Ca 0.53 0.75 0.01 0.00 -0.71 0.00 0.00 52.86 53.45 1qij s ASN 65 Cb -0.02 -1.19 -0.04 0.00 0.41 0.00 0.00 41.25 40.41 1qij s ASN 65 CO 0.37 -2.30 0.06 0.20 -1.51 0.00 0.00 177.10 173.92 1qij s ASN 66 N -4.44 5.47 0.63 -1.22 0.02 -0.74 -4.84 114.94 109.82 1qij s ASN 66 Ca 0.65 0.06 -0.18 0.00 -1.02 0.00 0.00 52.86 52.37 1qij s ASN 66 Cb -0.11 -1.50 -0.03 0.00 0.02 0.00 0.00 41.25 39.63 1qij s ASN 66 CO 0.51 0.25 1.16 0.00 0.02 0.00 0.00 177.10 179.04 1qij s GLN 68 N -3.13 4.17 0.26 0.00 -1.52 -1.21 -4.56 119.66 113.67 1qij s GLN 68 Ca 0.80 2.39 -0.08 0.00 -1.95 0.00 0.00 55.36 56.52 1qij s GLN 68 Cb -0.39 -3.88 -0.01 0.00 -0.22 0.00 0.00 33.01 28.51 1qij s GLN 68 CO 0.43 -0.84 0.42 1.14 -0.25 0.00 0.00 175.29 176.18 1qij s GLN 69 N 3.61 1.57 0.21 2.91 -2.07 -1.26 -4.72 119.66 119.91 1qij s GLN 69 Ca 0.79 -1.43 -0.30 0.00 -1.82 0.00 0.00 55.36 52.59 1qij s GLN 69 Cb -0.39 0.43 -0.08 0.00 -1.09 0.00 0.00 33.01 31.88 1qij s GLN 69 CO 0.34 -0.64 1.03 -0.47 -1.32 0.00 0.00 175.29 174.24 1qij s TYR 70 N -3.81 3.74 -0.11 9.60 5.04 -1.25 -5.04 117.35 125.53 1qij s TYR 70 Ca 0.27 1.75 0.02 0.00 -2.44 0.00 0.00 57.07 56.66 1qij s TYR 70 Cb 0.01 -3.16 -0.01 0.00 0.35 0.00 0.00 41.96 39.15 1qij s TYR 70 CO 0.12 -0.15 -0.16 0.08 -1.34 0.00 0.00 175.55 174.10 1qij s VAL 71 N -0.66 2.78 -0.03 3.14 1.01 -1.26 -4.87 120.40 120.51 1qij s VAL 71 Ca 0.46 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.37 1qij s VAL 71 Cb -0.28 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 1qij s VAL 71 CO 0.35 0.54 1.13 -0.62 0.00 0.00 0.00 175.10 176.50 1qij s ASP 72 N 0.18 7.14 -0.09 3.32 2.15 -1.26 -4.90 116.67 123.21 1qij s ASP 72 Ca -0.09 1.79 0.14 0.00 0.43 0.00 0.00 52.55 54.81 1qij s ASP 72 Cb -0.16 -2.56 0.30 0.00 -0.30 0.00 0.00 42.92 40.20 1qij s ASP 72 CO 0.06 -0.49 1.14 -0.62 -0.17 0.00 0.00 175.17 175.09 1qij n GLU 73 N 4.70 0.77 0.19 4.34 1.02 -1.26 -4.79 120.64 125.61 1qij n GLU 73 Ca 0.09 -2.29 0.03 0.00 -0.02 0.00 0.00 57.16 54.97 1qij n GLU 73 Cb 0.47 -0.95 0.36 0.00 -0.02 0.00 0.00 31.44 31.31 1qij n GLU 73 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1qij h GLN 74 N 0.52 0.00 -2.23 3.49 5.75 -2.00 -3.36 115.11 117.28 1qij h GLN 74 Ca -0.06 0.00 -0.58 0.00 -0.15 0.00 0.00 58.65 57.87 1qij h GLN 74 Cb 1.31 0.00 -0.38 0.00 1.07 0.00 0.00 27.48 29.47 1qij h GLN 74 CO 0.02 0.38 -1.03 1.19 -2.65 0.00 0.00 178.83 176.74 1qij n PHE 75 N -4.04 -0.74 -1.64 3.99 3.72 -1.26 -5.12 117.46 112.37 1qij n PHE 75 Ca -0.02 -3.39 -0.49 0.00 -0.05 0.00 0.00 57.45 53.50 1qij n PHE 75 Cb 0.42 0.05 -0.05 0.00 -0.94 0.00 0.00 39.48 38.95 1qij n PHE 75 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1qij n PRO 76 N 2.32 1.71 0.00 -1.08 -0.02 -1.26 -1.86 135.00 134.81 1qij n PRO 76 Ca 0.27 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1qij n PRO 76 Cb 0.50 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1qij n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qij n GLY 77 N 3.14 2.03 3.58 -1.23 0.00 -1.26 -4.99 105.19 106.46 1qij n GLY 77 Ca 0.18 -0.41 -0.54 0.00 0.00 0.00 0.00 46.02 45.25 1qij n GLY 77 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1qij n PHE 78 N 0.00 1.88 -0.07 1.61 7.35 -0.78 -4.82 117.46 122.63 1qij n PHE 78 Ca 0.00 0.37 -0.00 0.00 -0.76 0.00 0.00 57.45 57.06 1qij n PHE 78 Cb 0.00 -2.51 0.27 0.00 0.35 0.00 0.00 39.48 37.59 1qij n PHE 78 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1qij h SER 79 N 9.60 0.63 -0.79 -2.13 4.64 -1.94 -2.30 113.55 121.26 1qij h SER 79 Ca -0.37 -0.09 0.23 0.00 -0.47 0.00 0.00 61.79 61.09 1qij h SER 79 Cb 1.32 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 63.21 1qij h SER 79 CO 0.99 0.61 0.59 1.23 -0.87 0.00 0.00 176.83 179.38 1qij h GLY 80 N 0.86 0.00 0.00 -0.77 0.00 -1.95 -1.66 103.07 99.56 1qij h GLY 80 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 1qij h GLY 80 CO -0.01 0.00 -1.50 -1.14 0.00 0.00 0.00 176.54 173.89 1qij n SER 81 N -4.21 2.69 0.13 0.19 3.41 -1.07 -4.58 113.62 110.17 1qij n SER 81 Ca 0.16 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.79 1qij n SER 81 Cb 0.88 1.30 0.01 0.00 -0.26 0.00 0.00 64.21 66.13 1qij n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1qij h GLU 82 N 0.00 0.00 0.00 4.33 5.08 -1.04 -3.15 114.58 119.80 1qij h GLU 82 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1qij h GLU 82 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1qij h GLU 82 CO 0.00 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 1qij n MET 83 N -3.18 0.09 -0.01 2.33 0.00 -0.66 -0.70 117.12 115.00 1qij n MET 83 Ca 0.01 0.16 0.06 0.00 0.00 0.00 0.00 57.70 57.92 1qij n MET 83 Cb 0.75 -1.50 -0.09 0.00 0.00 0.00 0.00 33.22 32.37 1qij n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 1qij n TRP 84 N -1.18 0.00 -1.23 3.17 7.02 -1.19 -4.70 117.44 119.32 1qij n TRP 84 Ca 0.02 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.20 1qij n TRP 84 Cb 0.03 -0.25 0.10 0.00 -2.42 0.00 0.00 31.31 28.77 1qij n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1qij s ASN 85 N -3.28 4.27 0.19 -0.99 0.01 0.12 -4.76 114.94 110.50 1qij s ASN 85 Ca -0.04 1.77 -0.31 0.00 -0.71 0.00 0.00 52.86 53.57 1qij s ASN 85 Cb 0.08 -2.46 -0.10 0.00 0.41 0.00 0.00 41.25 39.18 1qij s ASN 85 CO 0.50 -2.18 1.48 -2.84 -1.51 0.00 0.00 177.10 172.55 1qij s PRO 86 N -4.90 4.26 -0.29 -0.60 0.02 -1.26 -4.91 135.00 127.31 1qij s PRO 86 Ca 0.62 2.28 0.11 0.00 0.02 0.00 0.00 61.00 64.03 1qij s PRO 86 Cb -0.17 -3.16 0.66 0.00 0.02 0.00 0.00 34.50 31.85 1qij s PRO 86 CO 0.56 -0.50 1.67 0.27 -0.33 0.00 0.00 177.00 178.68 1qij n ASN 87 N 3.33 4.20 -3.97 2.53 6.94 -1.26 -4.96 115.26 122.07 1qij n ASN 87 Ca 0.11 -3.29 -0.09 0.00 -0.02 0.00 0.00 54.58 51.29 1qij n ASN 87 Cb 0.40 -0.69 -0.08 0.00 -2.36 0.00 0.00 39.78 37.06 1qij n ASN 87 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1qij s ARG 88 N -3.02 1.03 0.17 -3.83 1.81 -1.26 -5.10 118.95 108.75 1qij s ARG 88 Ca 0.51 -1.16 -0.34 0.00 -1.72 0.00 0.00 55.73 53.02 1qij s ARG 88 Cb 0.42 0.34 -0.14 0.00 -0.45 0.00 0.00 34.95 35.12 1qij s ARG 88 CO 0.10 -0.35 1.51 -1.91 -0.68 0.00 0.00 175.30 173.97 1qij n GLU 89 N -0.15 2.00 -3.12 3.54 4.07 -1.26 -4.53 120.64 121.18 1qij n GLU 89 Ca -0.09 0.72 -0.35 0.00 -0.06 0.00 0.00 57.16 57.38 1qij n GLU 89 Cb 0.63 -2.44 -0.06 0.00 -0.06 0.00 0.00 31.44 29.50 1qij n GLU 89 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 1qij s MET 90 N 0.56 4.15 -0.11 5.31 -1.94 -1.26 -1.80 119.30 124.21 1qij s MET 90 Ca 0.77 0.79 -0.30 0.00 -1.71 0.00 0.00 55.69 55.24 1qij s MET 90 Cb -0.71 -2.71 0.09 0.00 2.01 0.00 0.00 34.83 33.52 1qij s MET 90 CO 0.42 0.30 0.81 0.45 -0.01 0.00 0.00 175.02 176.99 1qij s SER 91 N -1.89 -0.56 0.38 3.03 0.15 -0.25 -4.89 113.70 109.67 1qij s SER 91 Ca 0.47 0.67 0.28 0.00 0.70 0.00 0.00 55.95 58.07 1qij s SER 91 Cb -0.14 0.54 1.23 0.00 -1.71 0.00 0.00 66.02 65.94 1qij s SER 91 CO 0.20 -0.47 1.84 -0.33 1.20 0.00 0.00 173.24 175.67 1qij h GLU 92 N 3.05 0.00 -4.48 5.44 5.08 -1.94 -3.21 114.58 118.52 1qij h GLU 92 Ca -0.24 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.37 1qij h GLU 92 Cb 1.15 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.22 1qij h GLU 92 CO 0.32 0.00 1.41 -3.47 -1.00 0.00 0.00 179.01 176.27 1qij n ASP 93 N -2.56 5.24 -0.00 1.42 2.03 -1.26 -4.33 116.55 117.09 1qij n ASP 93 Ca 0.01 -3.01 0.04 0.00 0.52 0.00 0.00 54.79 52.35 1qij n ASP 93 Cb 0.22 -1.54 -0.06 0.00 -0.72 0.00 0.00 41.12 39.02 1qij n ASP 93 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qij s LEU 95 N -3.24 2.99 0.18 0.00 1.43 -1.26 -4.76 118.68 114.01 1qij s LEU 95 Ca -0.01 -1.60 0.03 0.00 -1.03 0.00 0.00 54.13 51.51 1qij s LEU 95 Cb 0.05 -2.59 -0.05 0.00 0.03 0.00 0.00 46.19 43.64 1qij s LEU 95 CO 0.33 -3.24 -0.02 -0.31 0.23 0.00 0.00 176.35 173.34 1qij s TYR 96 N 11.59 1.30 0.14 0.29 1.51 -1.26 -3.13 117.35 127.79 1qij s TYR 96 Ca 0.70 -0.95 0.05 0.00 -1.01 0.00 0.00 57.07 55.86 1qij s TYR 96 Cb -0.01 -0.73 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 1qij s TYR 96 CO 0.14 -0.12 -0.11 -0.48 -1.11 0.00 0.00 175.55 173.87 1qij s LEU 97 N -3.20 2.49 -0.03 -1.29 0.05 0.93 -3.27 118.68 114.36 1qij s LEU 97 Ca 0.23 -0.95 0.07 0.00 0.05 0.00 0.00 54.13 53.54 1qij s LEU 97 Cb 0.05 -0.40 -0.02 0.00 -2.05 0.00 0.00 46.19 43.77 1qij s LEU 97 CO 0.04 -0.27 -0.24 0.20 -0.55 0.00 0.00 176.35 175.53 1qij s ASN 98 N -2.95 2.88 -0.09 1.48 0.01 0.07 -1.08 114.94 115.27 1qij s ASN 98 Ca 0.14 -0.45 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 1qij s ASN 98 Cb 0.00 -0.45 0.01 0.00 0.41 0.00 0.00 41.25 41.23 1qij s ASN 98 CO 0.01 0.28 -0.15 -0.63 -1.51 0.00 0.00 177.10 175.11 1qij s ILE 99 N -0.46 1.38 -0.29 0.60 1.01 -0.31 -0.53 121.20 122.61 1qij s ILE 99 Ca 0.06 -0.60 -0.06 0.00 0.00 0.00 0.00 60.65 60.06 1qij s ILE 99 Cb -0.10 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.12 1qij s ILE 99 CO 0.00 0.41 0.06 0.26 0.00 0.00 0.00 174.94 175.67 1qij s TRP 100 N 0.81 3.15 -0.10 3.97 0.51 0.28 -0.98 118.94 126.59 1qij s TRP 100 Ca -0.11 -1.13 0.01 0.00 -2.12 0.00 0.00 56.10 52.75 1qij s TRP 100 Cb -0.16 -2.22 -0.02 0.00 -0.81 0.00 0.00 33.47 30.26 1qij s TRP 100 CO 0.02 -0.62 -0.12 0.08 -0.51 0.00 0.00 176.95 175.80 1qij s VAL 101 N 1.46 3.20 1.09 4.03 1.01 -0.55 -1.91 120.40 128.72 1qij s VAL 101 Ca 0.02 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 1qij s VAL 101 Cb -0.17 -2.31 0.22 0.00 0.00 0.00 0.00 36.38 34.11 1qij s VAL 101 CO 0.01 0.55 0.93 -2.65 0.00 0.00 0.00 175.10 173.95 1qij n PRO 102 N 2.96 -1.71 -3.91 2.72 -0.02 -1.26 -1.18 135.00 132.60 1qij n PRO 102 Ca -0.18 -0.46 -0.20 0.00 -2.02 0.00 0.00 63.50 60.64 1qij n PRO 102 Cb 0.53 -2.17 -0.17 0.00 -0.02 0.00 0.00 33.50 31.67 1qij n PRO 102 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1qij s SER 103 N -2.40 1.10 0.67 2.55 0.15 -1.26 -3.16 113.70 111.35 1qij s SER 103 Ca 0.66 -0.07 -0.16 0.00 0.70 0.00 0.00 55.95 57.09 1qij s SER 103 Cb -0.23 -0.37 0.01 0.00 -1.71 0.00 0.00 66.02 63.71 1qij s SER 103 CO 0.63 -0.14 1.15 -2.16 1.20 0.00 0.00 173.24 173.93 1qij s PRO 104 N 1.46 2.60 0.12 5.44 0.04 -1.26 -4.98 135.00 138.42 1qij s PRO 104 Ca -0.03 1.57 -0.35 0.00 0.04 0.00 0.00 61.00 62.23 1qij s PRO 104 Cb -0.13 -1.91 -0.15 0.00 0.04 0.00 0.00 34.50 32.35 1qij s PRO 104 CO -0.03 -1.44 1.52 -2.13 0.04 0.00 0.00 177.00 174.97 1qij n ARG 105 N -2.40 1.84 -1.17 4.56 0.63 -1.19 -4.95 116.66 113.97 1qij n ARG 105 Ca 0.12 0.66 -0.30 0.00 -0.92 0.00 0.00 57.85 57.41 1qij n ARG 105 Cb 0.51 -2.40 0.14 0.00 0.45 0.00 0.00 32.46 31.16 1qij n ARG 105 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1qij s PRO 106 N 0.96 1.32 -0.19 -0.14 0.02 -1.26 -5.00 135.00 130.71 1qij s PRO 106 Ca 0.81 0.90 -0.09 0.00 0.02 0.00 0.00 61.00 62.64 1qij s PRO 106 Cb -0.77 -1.81 -0.21 0.00 0.02 0.00 0.00 34.50 31.73 1qij s PRO 106 CO 0.42 -2.22 0.11 1.63 -0.33 0.00 0.00 177.00 176.60 1qij n LYS 107 N -3.88 0.67 -2.76 5.54 4.76 -1.26 -4.18 118.16 117.05 1qij n LYS 107 Ca 0.07 0.31 -0.08 0.00 -2.87 0.00 0.00 58.31 55.74 1qij n LYS 107 Cb 0.55 -1.65 0.04 0.00 -1.84 0.00 0.00 35.03 32.13 1qij n LYS 107 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1qij n SER 108 N -3.75 -2.92 -4.96 4.39 2.88 -0.99 -4.58 113.62 103.68 1qij n SER 108 Ca -0.38 -3.24 -0.20 0.00 -1.33 0.00 0.00 58.87 53.72 1qij n SER 108 Cb 0.93 1.77 0.04 0.00 -0.75 0.00 0.00 64.21 66.20 1qij n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1qij s THR 109 N 0.69 2.65 0.32 2.46 -1.32 0.32 -4.58 115.64 116.18 1qij s THR 109 Ca 0.32 -0.83 -0.29 0.00 -1.21 0.00 0.00 61.69 59.68 1qij s THR 109 Cb 0.20 -2.82 -0.10 0.00 -1.51 0.00 0.00 72.50 68.26 1qij s THR 109 CO -0.22 0.00 1.33 -0.89 -2.21 0.00 0.00 174.62 172.63 1qij s THR 110 N -2.63 2.68 -0.04 5.08 2.01 -1.26 -0.49 115.64 120.98 1qij s THR 110 Ca 0.58 0.67 0.01 0.00 0.31 0.00 0.00 61.69 63.26 1qij s THR 110 Cb -0.09 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 1qij s THR 110 CO 0.37 0.15 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.74 1qij s VAL 111 N -0.99 3.99 -0.11 3.82 1.01 -0.85 -1.58 120.40 125.69 1qij s VAL 111 Ca 0.50 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1qij s VAL 111 Cb -0.40 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.30 1qij s VAL 111 CO 0.52 0.50 -0.06 -0.04 0.00 0.00 0.00 175.10 176.02 1qij s MET 112 N -1.14 1.37 -0.24 2.72 -1.94 -0.39 -1.14 119.30 118.54 1qij s MET 112 Ca 0.15 -0.19 -0.07 0.00 -1.71 0.00 0.00 55.69 53.87 1qij s MET 112 Cb -0.11 -1.48 -0.03 0.00 2.01 0.00 0.00 34.83 35.22 1qij s MET 112 CO 0.05 -0.27 0.05 0.08 -0.01 0.00 0.00 175.02 174.92 1qij s VAL 113 N 1.75 4.19 -0.19 -6.03 1.01 0.70 -0.21 120.40 121.63 1qij s VAL 113 Ca 0.05 -0.21 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 1qij s VAL 113 Cb -0.12 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 1qij s VAL 113 CO -0.08 0.35 0.18 0.86 0.00 0.00 0.00 175.10 176.42 1qij s TRP 114 N 1.56 3.43 -0.29 5.22 -0.11 0.39 -1.22 118.94 127.92 1qij s TRP 114 Ca 0.06 0.42 -0.02 0.00 1.22 0.00 0.00 56.10 57.78 1qij s TRP 114 Cb -0.15 -2.22 0.04 0.00 -1.50 0.00 0.00 33.47 29.64 1qij s TRP 114 CO 0.03 0.27 -0.01 0.42 -4.62 0.00 0.00 176.95 173.04 1qij s ILE 115 N 0.40 3.02 0.70 5.86 1.01 -0.84 -2.94 121.20 128.40 1qij s ILE 115 Ca 0.11 -1.25 -0.15 0.00 0.00 0.00 0.00 60.65 59.36 1qij s ILE 115 Cb -0.12 -2.67 0.02 0.00 0.01 0.00 0.00 42.46 39.71 1qij s ILE 115 CO -0.00 -0.02 1.16 -0.72 0.00 0.00 0.00 174.94 175.36 1qij s TYR 116 N 1.29 2.30 0.24 3.97 -0.85 -1.26 -3.65 117.35 119.38 1qij s TYR 116 Ca -0.03 1.58 0.04 0.00 -0.52 0.00 0.00 57.07 58.14 1qij s TYR 116 Cb -0.19 -3.33 0.04 0.00 0.38 0.00 0.00 41.96 38.86 1qij s TYR 116 CO -0.02 -2.19 0.30 0.41 -1.52 0.00 0.00 175.55 172.53 1qij n GLY 117 N -0.02 2.15 0.00 5.49 0.00 -1.19 -3.76 105.19 107.86 1qij n GLY 117 Ca 0.12 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.96 1qij n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qij n GLY 118 N 2.14 0.00 2.49 -0.02 0.00 -1.26 -4.39 105.19 104.15 1qij n GLY 118 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 1qij n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qij n GLY 119 N 0.00 1.66 3.05 -0.02 0.00 -1.26 -2.11 105.19 106.50 1qij n GLY 119 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1qij n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1qij n PHE 120 N -2.51 0.00 -0.04 1.61 3.72 -1.26 -4.73 117.46 114.25 1qij n PHE 120 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1qij n PHE 120 Cb 0.55 -1.48 0.00 0.00 -0.94 0.00 0.00 39.48 37.60 1qij n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1qij n TYR 121 N -2.15 0.00 -3.81 1.38 0.18 -0.90 -0.31 117.16 111.55 1qij n TYR 121 Ca 0.00 -0.06 -0.05 0.00 1.88 0.00 0.00 57.90 59.66 1qij n TYR 121 Cb 0.29 -0.01 -0.00 0.00 -0.38 0.00 0.00 39.34 39.24 1qij n TYR 121 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1qij s SER 122 N -0.12 -0.14 0.00 9.48 1.04 -0.97 -3.84 113.70 119.15 1qij s SER 122 Ca 0.00 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.79 1qij s SER 122 Cb 0.00 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.75 1qij s SER 122 CO 0.00 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.64 1qij n GLY 123 N -0.51 4.05 3.02 7.32 0.00 -1.26 -4.10 105.19 113.71 1qij n GLY 123 Ca -0.05 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 1qij n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qij s SER 124 N 0.00 0.36 0.02 1.61 0.01 -1.26 -4.65 113.70 109.78 1qij s SER 124 Ca 0.00 -0.65 0.25 0.00 1.31 0.00 0.00 55.95 56.86 1qij s SER 124 Cb 0.00 0.12 0.50 0.00 0.21 0.00 0.00 66.02 66.85 1qij s SER 124 CO 0.00 -0.38 1.41 -1.54 0.41 0.00 0.00 173.24 173.14 1qij n SER 125 N 1.16 0.51 -0.95 2.44 3.41 -1.26 -4.12 113.62 114.82 1qij n SER 125 Ca -0.21 -0.16 0.08 0.00 -0.26 0.00 0.00 58.87 58.32 1qij n SER 125 Cb 0.57 0.22 0.23 0.00 -0.26 0.00 0.00 64.21 64.96 1qij n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1qij n THR 126 N -1.61 0.69 -1.08 6.66 -2.24 -1.26 -4.84 114.28 110.61 1qij n THR 126 Ca 0.05 -0.68 -0.30 0.00 -2.27 0.00 0.00 64.05 60.84 1qij n THR 126 Cb 0.35 0.33 0.13 0.00 -2.10 0.00 0.00 70.33 69.05 1qij n THR 126 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1qij s LEU 127 N -1.01 2.56 0.11 3.22 1.43 -1.26 -4.88 118.68 118.85 1qij s LEU 127 Ca 0.34 1.75 -0.16 0.00 -1.03 0.00 0.00 54.13 55.04 1qij s LEU 127 Cb 0.18 -4.23 -0.05 0.00 0.03 0.00 0.00 46.19 42.12 1qij s LEU 127 CO 0.23 -2.62 1.52 0.44 0.23 0.00 0.00 176.35 176.16 1qij h ASP 128 N -1.53 0.65 0.12 2.29 3.32 -1.93 -2.88 116.42 116.45 1qij h ASP 128 Ca -0.47 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.24 1qij h ASP 128 Cb 1.26 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1qij h ASP 128 CO 0.50 0.84 0.00 1.33 -1.72 0.00 0.00 179.24 180.19 1qij n VAL 129 N -4.45 1.34 -0.96 -1.35 0.24 -1.26 -1.94 118.33 109.95 1qij n VAL 129 Ca -0.02 0.57 0.08 0.00 -2.04 0.00 0.00 64.34 62.92 1qij n VAL 129 Cb 0.31 -1.54 0.33 0.00 -1.47 0.00 0.00 33.84 31.48 1qij n VAL 129 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1qij n TYR 130 N -1.95 1.54 -2.16 6.34 4.01 -1.09 -4.75 117.16 119.11 1qij n TYR 130 Ca -0.00 -0.82 -0.42 0.00 -0.16 0.00 0.00 57.90 56.50 1qij n TYR 130 Cb 0.05 -0.42 -0.03 0.00 -0.31 0.00 0.00 39.34 38.64 1qij n TYR 130 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1qij s ASN 131 N -1.36 5.96 0.32 7.72 3.84 -0.82 -4.88 114.94 125.72 1qij s ASN 131 Ca 0.49 0.88 0.25 0.00 0.21 0.00 0.00 52.86 54.69 1qij s ASN 131 Cb 0.38 -2.53 1.08 0.00 -0.55 0.00 0.00 41.25 39.63 1qij s ASN 131 CO 0.12 -1.73 1.76 1.23 -2.79 0.00 0.00 177.10 175.70 1qij h GLY 132 N 13.57 0.00 0.47 1.21 0.00 -1.92 -3.33 103.07 113.07 1qij h GLY 132 Ca -0.30 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.13 1qij h GLY 132 CO 1.10 0.00 0.42 0.07 0.00 0.00 0.00 176.54 178.13 1qij h LYS 133 N 0.00 0.68 -0.41 4.80 2.10 -1.93 0.48 116.57 122.29 1qij h LYS 133 Ca 0.00 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1qij h LYS 133 Cb 0.36 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 1qij h LYS 133 CO 0.00 0.45 0.24 1.88 -2.00 0.00 0.00 179.45 180.02 1qij h TYR 134 N 0.70 0.55 -0.16 0.07 0.05 -1.80 0.06 116.97 116.44 1qij h TYR 134 Ca 0.39 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 59.07 1qij h TYR 134 Cb 0.40 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 37.96 1qij h TYR 134 CO -0.08 0.40 -0.27 1.25 -1.05 0.00 0.00 178.16 178.42 1qij h LEU 135 N 0.54 0.51 -0.01 3.88 5.85 -1.60 -0.50 115.31 123.98 1qij h LEU 135 Ca 0.15 -0.53 0.02 0.00 0.84 0.00 0.00 57.88 58.36 1qij h LEU 135 Cb 0.02 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1qij h LEU 135 CO -0.03 0.95 -0.12 0.00 -0.34 0.00 0.00 178.44 178.91 1qij h ALA 136 N 0.58 -0.12 0.77 1.25 0.00 -0.83 -0.93 119.26 119.98 1qij h ALA 136 Ca 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1qij h ALA 136 Cb 0.85 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1qij h ALA 136 CO 0.06 -0.61 -0.46 -0.92 0.00 0.00 0.00 179.25 177.33 1qij h TYR 137 N -0.19 -1.22 -0.54 0.00 3.20 -0.99 0.33 116.97 117.56 1qij h TYR 137 Ca 0.05 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1qij h TYR 137 Cb 0.25 0.43 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 1qij h TYR 137 CO -0.18 -0.69 0.36 1.15 -1.64 0.00 0.00 178.16 177.15 1qij h THR 138 N -1.15 1.08 -0.01 1.81 2.02 -1.01 -3.04 112.91 112.62 1qij h THR 138 Ca -0.10 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1qij h THR 138 Cb 0.91 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1qij h THR 138 CO 0.12 0.12 -0.28 -0.62 0.37 0.00 0.00 175.52 175.23 1qij n GLU 139 N -4.47 1.70 -3.31 6.66 -0.58 -0.36 -5.02 120.64 115.27 1qij n GLU 139 Ca 0.06 -0.83 -0.16 0.00 -0.42 0.00 0.00 57.16 55.81 1qij n GLU 139 Cb 0.11 -1.24 0.07 0.00 -0.57 0.00 0.00 31.44 29.82 1qij n GLU 139 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1qij n GLU 140 N -0.05 -3.45 -4.22 3.49 1.02 0.11 -5.04 120.64 112.51 1qij n GLU 140 Ca 0.06 0.86 -0.15 0.00 -0.02 0.00 0.00 57.16 57.91 1qij n GLU 140 Cb 0.32 -5.82 -0.11 0.00 -0.02 0.00 0.00 31.44 25.81 1qij n GLU 140 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1qij s VAL 141 N -3.39 1.10 -0.20 2.62 -7.23 -1.03 -4.70 120.40 107.57 1qij s VAL 141 Ca 0.33 -1.82 -0.24 0.00 -1.81 0.00 0.00 61.98 58.44 1qij s VAL 141 Cb -0.04 -1.59 -0.01 0.00 0.56 0.00 0.00 36.38 35.30 1qij s VAL 141 CO 0.74 -0.61 0.79 -0.69 -0.31 0.00 0.00 175.10 175.02 1qij s VAL 142 N -2.75 4.89 -0.27 1.32 1.01 -0.61 -4.48 120.40 119.50 1qij s VAL 142 Ca 0.11 1.53 -0.08 0.00 0.00 0.00 0.00 61.98 63.54 1qij s VAL 142 Cb -0.01 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1qij s VAL 142 CO 0.01 0.01 0.09 -0.22 0.00 0.00 0.00 175.10 174.99 1qij s LEU 143 N 2.30 3.67 -0.04 3.92 1.98 -0.80 -1.27 118.68 128.45 1qij s LEU 143 Ca 0.35 -0.42 0.02 0.00 -2.89 0.00 0.00 54.13 51.19 1qij s LEU 143 Cb -0.16 -1.92 -0.03 0.00 0.66 0.00 0.00 46.19 44.74 1qij s LEU 143 CO 0.11 -0.11 -0.06 -0.69 -1.89 0.00 0.00 176.35 173.70 1qij s VAL 144 N 1.58 3.72 -0.16 1.68 1.01 0.70 -0.56 120.40 128.38 1qij s VAL 144 Ca 0.05 -0.58 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 1qij s VAL 144 Cb -0.16 -2.56 0.05 0.00 0.00 0.00 0.00 36.38 33.71 1qij s VAL 144 CO 0.04 0.52 -0.00 -0.55 0.00 0.00 0.00 175.10 175.10 1qij s SER 145 N -1.06 2.65 0.57 3.32 0.15 0.31 -0.46 113.70 119.19 1qij s SER 145 Ca 0.14 -0.63 0.09 0.00 0.70 0.00 0.00 55.95 56.25 1qij s SER 145 Cb -0.11 -0.69 0.08 0.00 -1.71 0.00 0.00 66.02 63.59 1qij s SER 145 CO 0.04 -0.24 0.79 -1.48 1.20 0.00 0.00 173.24 173.55 1qij s LEU 146 N 1.79 3.12 0.04 3.45 0.05 -1.15 -0.75 118.68 125.24 1qij s LEU 146 Ca 0.01 -0.82 -0.01 0.00 0.05 0.00 0.00 54.13 53.36 1qij s LEU 146 Cb -0.16 -1.68 -0.04 0.00 -2.05 0.00 0.00 46.19 42.27 1qij s LEU 146 CO -0.07 -1.33 -0.03 -0.94 -0.55 0.00 0.00 176.35 173.43 1qij s SER 147 N -4.66 0.45 0.11 1.48 1.04 -1.20 -4.63 113.70 106.30 1qij s SER 147 Ca 0.62 -0.88 -0.10 0.00 0.48 0.00 0.00 55.95 56.07 1qij s SER 147 Cb -0.06 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1qij s SER 147 CO 0.39 -0.52 0.26 -0.72 0.98 0.00 0.00 173.24 173.62 1qij s TYR 148 N -3.30 0.13 0.28 5.02 1.13 -1.26 -4.66 117.35 114.69 1qij s TYR 148 Ca 0.01 -0.53 -0.29 0.00 -1.41 0.00 0.00 57.07 54.86 1qij s TYR 148 Cb 0.03 0.01 -0.10 0.00 -1.10 0.00 0.00 41.96 40.81 1qij s TYR 148 CO -0.08 -0.62 1.10 1.03 -2.51 0.00 0.00 175.55 174.47 1qij s ARG 149 N -3.87 4.64 0.48 -3.49 0.52 -1.26 -4.89 118.95 111.08 1qij s ARG 149 Ca 0.07 1.80 0.03 0.00 -0.52 0.00 0.00 55.73 57.12 1qij s ARG 149 Cb 0.04 -3.19 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 1qij s ARG 149 CO -0.09 0.21 0.03 0.14 0.02 0.00 0.00 175.30 175.62 1qij s VAL 150 N -1.16 1.45 0.00 3.52 -7.23 -1.26 -4.27 120.40 111.44 1qij s VAL 150 Ca 0.44 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1qij s VAL 150 Cb -0.32 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.21 1qij s VAL 150 CO 0.41 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.81 1qij n GLY 151 N -1.22 0.95 0.36 2.32 0.00 0.58 -2.52 105.19 105.66 1qij n GLY 151 Ca -0.14 -0.75 0.10 0.00 0.00 0.00 0.00 46.02 45.24 1qij n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qij h ALA 152 N -0.90 1.61 -0.42 4.61 0.00 -1.90 -1.08 119.26 121.19 1qij h ALA 152 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1qij h ALA 152 Cb 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1qij h ALA 152 CO 0.00 0.08 0.34 0.74 0.00 0.00 0.00 179.25 180.41 1qij h PHE 153 N 0.87 0.00 -0.00 0.00 0.04 -1.89 -1.94 116.94 114.01 1qij h PHE 153 Ca 0.54 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.31 1qij h PHE 153 Cb 0.71 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.86 1qij h PHE 153 CO -0.00 0.00 -0.03 0.41 -0.60 0.00 0.00 178.31 178.09 1qij n GLY 154 N -1.56 -0.12 0.00 -1.45 0.00 -0.59 -4.24 105.19 97.24 1qij n GLY 154 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1qij n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1qij n PHE 155 N -0.53 0.00 -1.73 1.61 3.72 -0.51 -0.90 117.46 119.12 1qij n PHE 155 Ca 0.00 -0.07 -0.42 0.00 -0.05 0.00 0.00 57.45 56.91 1qij n PHE 155 Cb 0.02 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.54 1qij n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1qij n LEU 156 N -0.07 4.03 -3.60 4.37 7.94 -0.75 -4.48 117.00 124.44 1qij n LEU 156 Ca 0.00 1.15 -0.26 0.00 -1.11 0.00 0.00 56.01 55.79 1qij n LEU 156 Cb 0.39 -1.55 -0.17 0.00 0.53 0.00 0.00 43.42 42.63 1qij n LEU 156 CO 0.00 -0.03 -0.32 0.00 -1.11 0.00 0.00 177.39 175.93 1qij s ALA 157 N -0.06 0.38 -0.85 1.96 0.00 -1.26 -3.73 121.76 118.21 1qij s ALA 157 Ca 0.65 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1qij s ALA 157 Cb -0.54 -1.06 0.21 0.00 0.00 0.00 0.00 23.12 21.73 1qij s ALA 157 CO 0.49 -1.19 0.72 1.28 0.00 0.00 0.00 175.76 177.06 1qij n LEU 158 N 5.28 3.91 -4.38 0.00 4.77 -0.43 -3.22 117.00 122.93 1qij n LEU 158 Ca -0.07 -5.17 -0.38 0.00 -0.03 0.00 0.00 56.01 50.36 1qij n LEU 158 Cb 0.49 -1.00 0.03 0.00 -2.33 0.00 0.00 43.42 40.61 1qij n LEU 158 CO 0.10 1.63 -0.23 1.57 -1.33 0.00 0.00 177.39 179.13 1qij n HIS 159 N 2.14 -1.61 0.00 -1.77 -0.00 -1.26 -2.25 115.22 110.47 1qij n HIS 159 Ca 0.22 0.42 0.00 0.00 -0.00 0.00 0.00 57.72 58.35 1qij n HIS 159 Cb 0.36 -1.84 0.00 0.00 -0.00 0.00 0.00 29.99 28.51 1qij n HIS 159 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1qij n GLY 160 N 2.07 3.16 3.80 1.57 0.00 -1.26 -5.01 105.19 109.52 1qij n GLY 160 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1qij n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qij s SER 161 N -1.05 5.81 0.00 1.61 0.15 -0.95 -5.00 113.70 114.26 1qij s SER 161 Ca 0.00 0.20 0.23 0.00 0.70 0.00 0.00 55.95 57.08 1qij s SER 161 Cb 0.00 -1.71 0.65 0.00 -1.71 0.00 0.00 66.02 63.25 1qij s SER 161 CO 0.00 0.29 1.51 0.00 1.20 0.00 0.00 173.24 176.23 1qij n GLN 162 N 1.27 1.98 0.07 5.44 1.13 -1.26 -3.41 117.38 122.60 1qij n GLN 162 Ca -0.14 -1.46 0.03 0.00 -1.94 0.00 0.00 57.00 53.49 1qij n GLN 162 Cb 0.53 -1.44 -0.04 0.00 0.11 0.00 0.00 30.24 29.40 1qij n GLN 162 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1qij h GLU 163 N 3.05 0.00 -0.37 -1.09 4.39 -1.92 -3.41 114.58 115.23 1qij h GLU 163 Ca 0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.42 1qij h GLU 163 Cb 0.66 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 29.13 1qij h GLU 163 CO 0.00 0.28 -0.60 0.00 -1.16 0.00 0.00 179.01 177.53 1qij n ALA 164 N -2.32 -0.62 -0.02 3.43 0.00 -1.26 -3.35 120.51 116.37 1qij n ALA 164 Ca -0.05 -1.78 0.02 0.00 0.00 0.00 0.00 53.44 51.63 1qij n ALA 164 Cb 0.76 -1.22 0.36 0.00 0.00 0.00 0.00 19.45 19.36 1qij n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1qij h PRO 165 N 3.81 0.57 0.00 0.00 0.13 -1.75 -1.14 132.00 133.61 1qij h PRO 165 Ca -0.10 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1qij h PRO 165 Cb 1.02 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1qij h PRO 165 CO 0.32 0.45 0.00 0.41 -0.23 0.00 0.00 178.00 178.96 1qij n GLY 166 N -1.26 2.13 2.46 1.56 0.00 -1.24 -4.42 105.19 104.40 1qij n GLY 166 Ca 0.03 -2.06 -0.06 0.00 0.00 0.00 0.00 46.02 43.93 1qij n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qij n ASN 167 N 0.00 -4.07 0.32 1.61 3.02 -1.26 -4.76 115.26 110.12 1qij n ASN 167 Ca 0.00 0.16 0.21 0.00 -0.03 0.00 0.00 54.58 54.92 1qij n ASN 167 Cb 0.00 -3.03 1.07 0.00 -0.61 0.00 0.00 39.78 37.21 1qij n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1qij h VAL 168 N 0.00 0.03 -0.01 2.41 -1.51 -1.89 0.45 116.25 115.72 1qij h VAL 168 Ca -0.13 -0.15 -0.13 0.00 -1.23 0.00 0.00 66.70 65.06 1qij h VAL 168 Cb 0.81 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 31.10 1qij h VAL 168 CO 0.19 0.00 -0.62 1.23 -1.23 0.00 0.00 177.57 177.14 1qij h GLY 169 N 0.55 0.05 1.87 5.19 0.00 -1.27 -1.72 103.07 107.74 1qij h GLY 169 Ca -0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 47.33 47.03 1qij h GLY 169 CO 0.00 0.06 -1.06 1.41 0.00 0.00 0.00 176.54 176.95 1qij h LEU 170 N 0.04 0.15 -1.01 3.11 3.38 -1.21 -3.05 115.31 116.72 1qij h LEU 170 Ca -0.01 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1qij h LEU 170 Cb 1.10 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1qij h LEU 170 CO 0.08 1.10 -0.14 -0.07 0.09 0.00 0.00 178.44 179.50 1qij h LEU 171 N 0.03 0.54 -0.16 1.67 3.38 -1.14 -1.24 115.31 118.39 1qij h LEU 171 Ca -0.05 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.80 1qij h LEU 171 Cb 1.80 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.38 1qij h LEU 171 CO 0.15 0.71 -0.04 0.44 0.09 0.00 0.00 178.44 179.79 1qij h ASP 172 N 0.50 -0.15 -0.82 -0.43 3.32 -1.23 0.03 116.42 117.65 1qij h ASP 172 Ca 0.09 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1qij h ASP 172 Cb 0.54 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.15 1qij h ASP 172 CO 0.03 -0.05 0.47 1.56 -1.72 0.00 0.00 179.24 179.53 1qij h GLN 173 N 0.00 1.13 -0.38 3.56 4.20 -1.35 -1.81 115.11 120.47 1qij h GLN 173 Ca 0.08 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1qij h GLN 173 Cb 0.12 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1qij h GLN 173 CO -0.16 0.81 0.05 -0.09 -0.67 0.00 0.00 178.83 178.77 1qij h ARG 174 N 1.13 0.57 -0.05 1.46 2.43 -0.72 -0.99 114.38 118.22 1qij h ARG 174 Ca 0.29 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1qij h ARG 174 Cb 0.00 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1qij h ARG 174 CO -0.05 0.55 0.02 1.98 -1.51 0.00 0.00 179.97 180.96 1qij h MET 175 N 0.55 0.07 -0.86 0.20 4.05 -0.26 0.13 114.93 118.82 1qij h MET 175 Ca 0.12 -0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.59 1qij h MET 175 Cb 0.27 -0.01 -0.06 0.00 -0.80 0.00 0.00 31.60 31.00 1qij h MET 175 CO 0.00 0.23 0.53 0.00 0.23 0.00 0.00 176.91 177.91 1qij h ALA 176 N 0.84 1.17 -0.23 0.39 0.00 -0.85 -1.10 119.26 119.48 1qij h ALA 176 Ca 0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1qij h ALA 176 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1qij h ALA 176 CO -0.00 0.30 -0.18 -0.07 0.00 0.00 0.00 179.25 179.29 1qij h LEU 177 N 0.99 0.40 -0.70 0.00 3.38 -0.68 -1.37 115.31 117.33 1qij h LEU 177 Ca 0.37 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 1qij h LEU 177 Cb 0.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1qij h LEU 177 CO -0.16 0.60 -0.02 -0.61 0.09 0.00 0.00 178.44 178.34 1qij h GLN 178 N 0.37 0.98 -0.25 1.13 5.75 0.43 -0.90 115.11 122.63 1qij h GLN 178 Ca 0.06 -0.31 -0.06 0.00 -0.15 0.00 0.00 58.65 58.20 1qij h GLN 178 Cb 0.54 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.99 1qij h GLN 178 CO 0.04 0.98 -0.07 2.35 -2.65 0.00 0.00 178.83 179.48 1qij h TRP 179 N 0.90 0.55 -0.67 3.99 7.01 -0.83 -0.95 115.95 125.94 1qij h TRP 179 Ca 0.16 -0.12 0.04 0.00 2.11 0.00 0.00 58.89 61.08 1qij h TRP 179 Cb 0.55 -0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.44 1qij h TRP 179 CO 0.04 0.71 0.44 0.28 -2.79 0.00 0.00 178.44 177.12 1qij h VAL 180 N 0.23 1.08 -0.29 2.65 2.07 -1.08 0.18 116.25 121.09 1qij h VAL 180 Ca 0.06 -0.27 -0.13 0.00 0.82 0.00 0.00 66.70 67.18 1qij h VAL 180 Cb 0.54 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1qij h VAL 180 CO 0.03 0.14 -0.36 -0.74 0.02 0.00 0.00 177.57 176.66 1qij h HIS 181 N 0.78 0.76 0.00 1.57 -0.00 -0.73 -1.65 115.15 115.87 1qij h HIS 181 Ca 0.27 -0.21 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 1qij h HIS 181 Cb 0.10 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 1qij h HIS 181 CO -0.00 0.91 -0.63 -0.25 -0.00 0.00 0.00 177.93 177.97 1qij n ASP 182 N -4.05 0.58 0.00 3.26 8.00 -0.40 -4.63 116.55 119.30 1qij n ASP 182 Ca -0.01 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.30 1qij n ASP 182 Cb 0.50 0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 1qij n ASP 182 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1qij n ASN 183 N -1.70 1.76 0.28 -2.24 3.02 0.52 -4.81 115.26 112.08 1qij n ASN 183 Ca 0.04 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.71 1qij n ASN 183 Cb 0.37 0.34 0.63 0.00 -0.61 0.00 0.00 39.78 40.52 1qij n ASN 183 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1qij h ILE 184 N 0.00 0.00 -0.01 2.41 6.09 -1.43 0.13 117.51 124.70 1qij h ILE 184 Ca 0.00 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.41 1qij h ILE 184 Cb 0.02 0.52 -0.01 0.00 0.47 0.00 0.00 36.82 37.82 1qij h ILE 184 CO 0.00 0.00 -0.37 0.06 -3.07 0.00 0.00 178.15 174.77 1qij h GLN 185 N 0.00 0.01 0.00 2.19 3.07 -1.81 -0.19 115.11 118.38 1qij h GLN 185 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1qij h GLN 185 Cb 0.67 -0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.23 1qij h GLN 185 CO 0.00 0.38 0.00 1.19 0.09 0.00 0.00 178.83 180.49 1qij n PHE 186 N -4.10 0.00 0.35 0.06 3.72 0.44 -2.37 117.46 115.56 1qij n PHE 186 Ca -0.02 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.46 1qij n PHE 186 Cb 0.40 -0.29 0.12 0.00 -0.94 0.00 0.00 39.48 38.78 1qij n PHE 186 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1qij n PHE 187 N -1.29 0.24 0.00 1.38 3.01 -0.74 -4.82 117.46 115.25 1qij n PHE 187 Ca 0.12 -0.18 0.00 0.00 1.01 0.00 0.00 57.45 58.41 1qij n PHE 187 Cb 0.22 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 1qij n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qij n GLY 188 N 0.95 0.17 3.86 1.37 0.00 -1.00 -4.62 105.19 105.91 1qij n GLY 188 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1qij n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qij s GLY 189 N -1.74 1.90 -0.42 -0.02 0.00 -0.16 -0.52 107.32 106.36 1qij s GLY 189 Ca 0.00 0.02 -0.11 0.00 0.00 0.00 0.00 44.72 44.63 1qij s GLY 189 CO 0.00 0.28 0.27 -0.35 0.00 0.00 0.00 173.10 173.30 1qij s ASP 190 N -3.45 5.76 0.63 1.64 2.15 0.35 -3.53 116.67 120.22 1qij s ASP 190 Ca 0.56 -1.35 0.34 0.00 0.43 0.00 0.00 52.55 52.52 1qij s ASP 190 Cb -0.10 -2.03 1.90 0.00 -0.30 0.00 0.00 42.92 42.38 1qij s ASP 190 CO 0.38 -0.53 2.17 1.55 -0.17 0.00 0.00 175.17 178.58 1qij h PRO 191 N 8.48 0.00 -0.47 4.34 0.13 -1.88 -0.90 132.00 141.71 1qij h PRO 191 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1qij h PRO 191 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1qij h PRO 191 CO 0.76 0.00 0.00 0.36 -0.23 0.00 0.00 178.00 178.89 1qij n LYS 192 N -3.43 2.00 -2.99 0.86 2.85 -1.26 -4.16 118.16 112.03 1qij n LYS 192 Ca -0.01 -1.18 -0.14 0.00 -1.05 0.00 0.00 58.31 55.92 1qij n LYS 192 Cb 0.23 -1.42 0.02 0.00 -0.65 0.00 0.00 35.03 33.22 1qij n LYS 192 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1qij n THR 193 N 0.37 -0.11 -4.33 0.58 -1.04 -0.34 -4.81 114.28 104.60 1qij n THR 193 Ca 0.11 -3.22 -0.34 0.00 -2.04 0.00 0.00 64.05 58.56 1qij n THR 193 Cb 0.38 0.46 -0.12 0.00 -1.82 0.00 0.00 70.33 69.23 1qij n THR 193 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1qij s VAL 194 N -1.20 3.93 -0.18 12.58 0.11 -1.26 -2.02 120.40 132.37 1qij s VAL 194 Ca 0.32 -0.34 -0.05 0.00 -2.93 0.00 0.00 61.98 58.98 1qij s VAL 194 Cb 0.32 -2.73 -0.03 0.00 -1.53 0.00 0.00 36.38 32.40 1qij s VAL 194 CO -0.07 0.48 0.00 -0.89 -3.33 0.00 0.00 175.10 171.29 1qij s THR 195 N 0.47 4.17 -0.09 5.04 2.01 -0.29 -0.62 115.64 126.32 1qij s THR 195 Ca -0.03 -0.25 -0.05 0.00 0.31 0.00 0.00 61.69 61.67 1qij s THR 195 Cb -0.14 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 1qij s THR 195 CO 0.03 0.46 0.10 0.27 -0.69 0.00 0.00 174.62 174.78 1qij s ILE 196 N 0.60 5.11 -0.07 1.82 -4.36 -0.94 -0.21 121.20 123.15 1qij s ILE 196 Ca -0.00 0.01 -0.06 0.00 -0.26 0.00 0.00 60.65 60.34 1qij s ILE 196 Cb -0.14 -3.22 0.02 0.00 1.25 0.00 0.00 42.46 40.37 1qij s ILE 196 CO 0.02 0.58 0.18 0.72 0.24 0.00 0.00 174.94 176.68 1qij s PHE 197 N -1.02 -0.20 0.26 1.37 -0.71 -0.36 -1.21 117.98 116.12 1qij s PHE 197 Ca 0.16 0.49 0.06 0.00 -1.04 0.00 0.00 56.93 56.60 1qij s PHE 197 Cb -0.12 0.06 -0.02 0.00 -1.21 0.00 0.00 43.02 41.73 1qij s PHE 197 CO 0.05 -0.11 0.24 0.41 -1.34 0.00 0.00 175.22 174.47 1qij n GLY 198 N 3.12 3.08 2.92 1.99 0.00 -0.91 -1.98 105.19 113.40 1qij n GLY 198 Ca -0.14 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 1qij n GLY 198 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qij s GLU 199 N -3.03 0.08 6.95 1.61 -6.30 -1.24 -1.50 118.70 115.27 1qij s GLU 199 Ca 0.31 0.19 0.00 0.00 -2.50 0.00 0.00 54.97 52.97 1qij s GLU 199 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 34.13 34.09 1qij s GLU 199 CO 0.22 -0.07 0.00 0.45 0.02 0.00 0.00 175.26 175.88 1qij n SER 200 N 3.48 0.00 0.30 -1.70 2.88 -0.41 -0.59 113.62 117.57 1qij n SER 200 Ca -0.18 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.53 1qij n SER 200 Cb 0.56 0.00 0.94 0.00 -0.75 0.00 0.00 64.21 64.97 1qij n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qij h ALA 201 N -0.91 1.36 0.00 -1.46 0.00 -1.87 0.43 119.26 116.82 1qij h ALA 201 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1qij h ALA 201 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1qij h ALA 201 CO 0.00 0.03 -0.63 0.78 0.00 0.00 0.00 179.25 179.43 1qij h GLY 202 N 0.19 0.00 1.65 0.00 0.00 -0.94 -0.71 103.07 103.27 1qij h GLY 202 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 1qij h GLY 202 CO 0.00 0.00 -0.93 -1.33 0.00 0.00 0.00 176.54 174.28 1qij h GLY 203 N 3.34 0.34 1.71 4.60 0.00 -0.95 -1.70 103.07 110.41 1qij h GLY 203 Ca -0.01 -0.62 -0.15 0.00 0.00 0.00 0.00 47.33 46.56 1qij h GLY 203 CO 0.08 0.55 -0.59 0.00 0.00 0.00 0.00 176.54 176.57 1qij h ALA 204 N 0.83 0.82 -0.35 3.60 0.00 -1.07 -2.54 119.26 120.56 1qij h ALA 204 Ca -0.07 -0.53 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 1qij h ALA 204 Cb 1.57 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1qij h ALA 204 CO 0.15 0.72 -0.16 0.77 0.00 0.00 0.00 179.25 180.73 1qij h SER 205 N 0.23 0.74 -0.39 0.00 0.02 -0.99 -1.80 113.55 111.35 1qij h SER 205 Ca -0.00 -0.40 0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1qij h SER 205 Cb 1.10 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 1qij h SER 205 CO 0.10 0.98 0.24 0.58 -1.14 0.00 0.00 176.83 177.59 1qij h VAL 206 N 0.50 1.07 0.00 2.27 2.07 -1.25 -0.57 116.25 120.33 1qij h VAL 206 Ca 0.08 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1qij h VAL 206 Cb 0.69 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1qij h VAL 206 CO 0.05 0.09 -0.08 1.23 0.02 0.00 0.00 177.57 178.87 1qij h GLY 207 N 0.50 0.00 2.00 2.17 0.00 -1.35 -2.31 103.07 104.07 1qij h GLY 207 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.39 1qij h GLY 207 CO -0.06 0.00 -0.44 -0.33 0.00 0.00 0.00 176.54 175.71 1qij h MET 208 N 0.00 0.00 0.00 4.80 2.86 -0.23 -2.83 114.93 119.53 1qij h MET 208 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1qij h MET 208 Cb 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1qij h MET 208 CO 0.01 0.44 -0.32 0.45 1.06 0.00 0.00 176.91 178.55 1qij h HIS 209 N 0.00 0.00 -0.08 -0.22 3.86 -0.81 -0.89 115.15 117.02 1qij h HIS 209 Ca -0.00 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.03 1qij h HIS 209 Cb 1.30 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.77 1qij h HIS 209 CO 0.00 0.19 -0.71 0.82 0.86 0.00 0.00 177.93 179.09 1qij h ILE 210 N 0.00 1.39 0.16 2.45 2.04 -1.42 -3.22 117.51 118.90 1qij h ILE 210 Ca -0.01 -2.13 -0.33 0.00 1.00 0.00 0.00 64.86 63.39 1qij h ILE 210 Cb 1.15 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 1qij h ILE 210 CO 0.02 0.64 -1.64 -0.07 0.00 0.00 0.00 178.15 177.11 1qij h LEU 211 N 0.26 0.53 -9.26 1.44 3.38 -1.38 -0.13 115.31 110.14 1qij h LEU 211 Ca -0.03 -0.75 -0.55 0.00 0.09 0.00 0.00 57.88 56.64 1qij h LEU 211 Cb 1.28 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1qij h LEU 211 CO 0.12 1.62 0.88 -0.55 0.09 0.00 0.00 178.44 180.60 1qij s SER 212 N -7.16 6.89 0.27 -0.43 0.15 -0.35 -4.73 113.70 108.34 1qij s SER 212 Ca -0.12 1.93 0.00 0.00 0.70 0.00 0.00 55.95 58.46 1qij s SER 212 Cb 0.06 -2.55 0.53 0.00 -1.71 0.00 0.00 66.02 62.36 1qij s SER 212 CO 0.86 -0.75 1.81 -0.65 1.20 0.00 0.00 173.24 175.71 1qij h PRO 213 N 8.20 0.84 0.00 5.44 0.11 -1.87 -2.45 132.00 142.26 1qij h PRO 213 Ca -0.33 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1qij h PRO 213 Cb 1.15 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1qij h PRO 213 CO 0.93 0.55 0.00 0.78 -0.21 0.00 0.00 178.00 180.06 1qij h GLY 214 N 0.86 0.00 0.00 -0.55 0.00 -1.91 -3.21 103.07 98.26 1qij h GLY 214 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1qij h GLY 214 CO -0.29 0.00 -1.35 1.44 0.00 0.00 0.00 176.54 176.34 1qij n SER 215 N -2.75 2.11 -0.32 0.19 7.64 -0.93 -4.73 113.62 114.82 1qij n SER 215 Ca -0.01 -0.12 0.18 0.00 1.01 0.00 0.00 58.87 59.93 1qij n SER 215 Cb 0.13 1.43 0.38 0.00 -1.01 0.00 0.00 64.21 65.14 1qij n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1qij h ARG 216 N 0.00 0.31 0.00 1.43 3.08 -1.53 -0.87 114.38 116.80 1qij h ARG 216 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1qij h ARG 216 Cb 0.47 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1qij h ARG 216 CO 0.00 0.21 0.00 -0.25 -1.07 0.00 0.00 179.97 178.86 1qij n ASP 217 N -5.09 0.00 -0.86 7.04 8.00 -1.26 -3.93 116.55 120.45 1qij n ASP 217 Ca 0.27 -1.07 0.11 0.00 0.71 0.00 0.00 54.79 54.81 1qij n ASP 217 Cb 0.82 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 42.20 1qij n ASP 217 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1qij n LEU 218 N -0.94 2.60 -3.71 0.64 4.77 -0.33 -4.95 117.00 115.07 1qij n LEU 218 Ca 0.20 -1.07 -0.10 0.00 -0.03 0.00 0.00 56.01 55.02 1qij n LEU 218 Cb 0.09 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 1qij n LEU 218 CO 0.15 0.53 0.20 0.72 -1.33 0.00 0.00 177.39 177.66 1qij s PHE 219 N -1.70 -0.12 -0.23 -1.77 -0.71 -1.25 -4.86 117.98 107.34 1qij s PHE 219 Ca 0.35 -0.21 -0.16 0.00 -1.04 0.00 0.00 56.93 55.86 1qij s PHE 219 Cb 0.20 0.30 -0.12 0.00 -1.21 0.00 0.00 43.02 42.18 1qij s PHE 219 CO 0.29 -0.80 -0.18 -2.13 -1.34 0.00 0.00 175.22 171.07 1qij n ARG 220 N -0.28 0.56 -4.44 1.99 3.00 0.20 -4.95 116.66 112.74 1qij n ARG 220 Ca -0.13 0.37 -0.22 0.00 -0.00 0.00 0.00 57.85 57.87 1qij n ARG 220 Cb 0.63 -1.58 -0.09 0.00 0.00 0.00 0.00 32.46 31.43 1qij n ARG 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1qij s ARG 221 N -2.50 1.76 -0.03 -0.14 0.52 -1.18 -4.64 118.95 112.75 1qij s ARG 221 Ca -0.32 -2.03 -0.12 0.00 -0.52 0.00 0.00 55.73 52.73 1qij s ARG 221 Cb 0.10 -0.50 0.02 0.00 0.52 0.00 0.00 34.95 35.08 1qij s ARG 221 CO 0.49 -0.40 0.26 0.00 0.02 0.00 0.00 175.30 175.66 1qij s ALA 222 N -3.36 -0.66 -0.09 2.13 0.00 -1.22 -2.21 121.76 116.35 1qij s ALA 222 Ca 0.30 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.57 1qij s ALA 222 Cb 0.05 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.17 1qij s ALA 222 CO 0.16 -0.23 -0.13 0.42 0.00 0.00 0.00 175.76 175.98 1qij s ILE 223 N -1.08 1.28 -0.16 0.00 1.01 -0.35 -2.24 121.20 119.66 1qij s ILE 223 Ca -0.11 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1qij s ILE 223 Cb -0.05 -1.19 0.01 0.00 0.01 0.00 0.00 42.46 41.23 1qij s ILE 223 CO 0.03 0.40 -0.19 -0.76 0.00 0.00 0.00 174.94 174.42 1qij s LEU 224 N 1.02 2.24 -0.19 2.97 1.02 -0.72 -2.15 118.68 122.87 1qij s LEU 224 Ca -0.07 -0.57 -0.02 0.00 0.02 0.00 0.00 54.13 53.49 1qij s LEU 224 Cb -0.15 -1.50 -0.01 0.00 0.02 0.00 0.00 46.19 44.56 1qij s LEU 224 CO -0.01 0.05 -0.10 -1.10 0.02 0.00 0.00 176.35 175.22 1qij s GLN 225 N 0.99 3.32 -1.61 1.70 -0.21 -0.56 -2.70 119.66 120.59 1qij s GLN 225 Ca -0.02 -0.68 -0.14 0.00 0.02 0.00 0.00 55.36 54.54 1qij s GLN 225 Cb -0.15 -2.82 0.11 0.00 1.00 0.00 0.00 33.01 31.16 1qij s GLN 225 CO -0.05 -0.07 0.80 0.43 -2.12 0.00 0.00 175.29 174.28 1qij n SER 226 N 4.37 -3.31 -3.65 5.90 7.64 -0.43 -1.29 113.62 122.86 1qij n SER 226 Ca -0.19 -0.94 -0.02 0.00 1.01 0.00 0.00 58.87 58.73 1qij n SER 226 Cb 0.51 -3.15 -0.07 0.00 -1.01 0.00 0.00 64.21 60.49 1qij n SER 226 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1qij s GLY 227 N -3.46 0.40 0.03 0.23 0.00 -1.26 -3.43 107.32 99.83 1qij s GLY 227 Ca 0.61 3.60 -0.03 0.00 0.00 0.00 0.00 44.72 48.90 1qij s GLY 227 CO 0.89 1.98 0.04 -1.35 0.00 0.00 0.00 173.10 174.66 1qij s SER 228 N 0.04 0.25 0.43 1.64 1.04 -1.26 -3.87 113.70 111.96 1qij s SER 228 Ca 0.07 -0.60 0.18 0.00 0.48 0.00 0.00 55.95 56.08 1qij s SER 228 Cb -0.05 0.19 1.11 0.00 0.10 0.00 0.00 66.02 67.37 1qij s SER 228 CO -0.16 -0.46 1.86 1.55 0.98 0.00 0.00 173.24 177.01 1qij h PRO 229 N 3.85 0.37 -0.96 4.02 0.13 -1.80 -2.55 132.00 135.06 1qij h PRO 229 Ca -0.33 -0.02 -0.22 0.00 -0.87 0.00 0.00 66.00 64.57 1qij h PRO 229 Cb 1.18 -0.08 -0.13 0.00 0.13 0.00 0.00 31.00 32.10 1qij h PRO 229 CO 0.51 0.24 0.27 0.27 -0.23 0.00 0.00 178.00 179.06 1qij n ASN 230 N -4.49 3.39 -4.77 1.44 6.94 -1.26 -4.74 115.26 111.77 1qij n ASN 230 Ca 0.19 -2.76 -0.38 0.00 -0.02 0.00 0.00 54.58 51.61 1qij n ASN 230 Cb 0.70 -0.66 -0.05 0.00 -2.36 0.00 0.00 39.78 37.41 1qij n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1qij n PRO 232 N 0.80 0.09 -0.00 0.00 -0.04 -1.26 -2.01 135.00 132.58 1qij n PRO 232 Ca 0.01 0.56 0.06 0.00 -0.04 0.00 0.00 63.50 64.10 1qij n PRO 232 Cb 0.48 -1.90 -0.08 0.00 -0.04 0.00 0.00 33.50 31.96 1qij n PRO 232 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1qij n TRP 233 N -1.98 0.00 1.09 0.54 4.27 -1.26 -4.62 117.44 115.47 1qij n TRP 233 Ca -0.01 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.74 1qij n TRP 233 Cb 0.12 -0.07 0.65 0.00 -1.36 0.00 0.00 31.31 30.65 1qij n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1qij n ALA 234 N -1.46 2.37 -3.44 -1.67 0.00 -0.85 -4.63 120.51 110.82 1qij n ALA 234 Ca 0.01 -0.11 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 1qij n ALA 234 Cb 0.24 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 1qij n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qij s SER 235 N -2.91 -0.52 0.24 0.00 1.04 -1.26 -3.56 113.70 106.73 1qij s SER 235 Ca 0.17 -0.00 0.01 0.00 0.48 0.00 0.00 55.95 56.61 1qij s SER 235 Cb 0.19 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.82 1qij s SER 235 CO 0.52 -0.89 0.10 0.68 0.98 0.00 0.00 173.24 174.62 1qij s VAL 236 N -3.61 0.43 0.59 5.02 -7.23 -0.23 -4.98 120.40 110.39 1qij s VAL 236 Ca 0.02 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.11 1qij s VAL 236 Cb -0.01 -2.60 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 1qij s VAL 236 CO -0.12 -0.01 0.94 -0.94 -0.31 0.00 0.00 175.10 174.66 1qij s SER 237 N -3.28 5.93 0.47 4.85 1.04 -1.26 -1.79 113.70 119.66 1qij s SER 237 Ca 0.38 1.05 0.14 0.00 0.48 0.00 0.00 55.95 58.00 1qij s SER 237 Cb 0.08 -2.11 1.07 0.00 0.10 0.00 0.00 66.02 65.15 1qij s SER 237 CO 0.13 -0.93 2.05 -0.37 0.98 0.00 0.00 173.24 175.11 1qij h VAL 238 N -0.19 1.08 -0.27 5.02 -1.51 -1.93 0.22 116.25 118.66 1qij h VAL 238 Ca -0.45 -0.35 -0.04 0.00 -1.23 0.00 0.00 66.70 64.63 1qij h VAL 238 Cb 1.22 1.11 -0.01 0.00 -2.13 0.00 0.00 31.29 31.48 1qij h VAL 238 CO 0.62 0.11 0.02 0.00 -1.23 0.00 0.00 177.57 177.08 1qij h ALA 239 N 1.86 0.36 0.00 5.19 0.00 -1.95 0.15 119.26 124.88 1qij h ALA 239 Ca 0.02 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 1qij h ALA 239 Cb 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1qij h ALA 239 CO 0.01 0.08 -0.62 1.49 0.00 0.00 0.00 179.25 180.21 1qij h GLU 240 N 0.26 0.00 -0.42 0.00 4.57 -1.82 -0.04 114.58 117.14 1qij h GLU 240 Ca 0.08 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.16 1qij h GLU 240 Cb 0.39 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1qij h GLU 240 CO 0.01 0.62 -0.12 0.78 -1.18 0.00 0.00 179.01 179.12 1qij h GLY 241 N 2.08 0.89 1.06 1.92 0.00 -0.74 -1.40 103.07 106.87 1qij h GLY 241 Ca -0.01 -0.75 -0.12 0.00 0.00 0.00 0.00 47.33 46.46 1qij h GLY 241 CO 0.08 0.68 -0.18 -0.09 0.00 0.00 0.00 176.54 177.03 1qij h ARG 242 N 0.64 0.91 -0.82 4.80 2.43 -0.50 -1.61 114.38 120.23 1qij h ARG 242 Ca 0.10 -0.38 0.03 0.00 -0.81 0.00 0.00 59.98 58.91 1qij h ARG 242 Cb 0.66 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.13 1qij h ARG 242 CO 0.05 1.04 0.53 -0.09 -1.51 0.00 0.00 179.97 179.98 1qij h ARG 243 N 0.74 1.01 -0.02 0.20 2.43 -0.82 -2.10 114.38 115.82 1qij h ARG 243 Ca 0.10 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 59.05 1qij h ARG 243 Cb 0.75 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1qij h ARG 243 CO 0.06 0.67 -0.72 0.00 -1.51 0.00 0.00 179.97 178.47 1qij h ARG 244 N 1.04 0.10 -0.26 0.20 3.08 -1.14 -2.46 114.38 114.94 1qij h ARG 244 Ca 0.32 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 1qij h ARG 244 Cb -0.03 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1qij h ARG 244 CO -0.10 0.77 0.13 0.00 -1.07 0.00 0.00 179.97 179.71 1qij h ALA 245 N 1.20 0.34 0.24 0.04 0.00 -0.80 -1.03 119.26 119.24 1qij h ALA 245 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1qij h ALA 245 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1qij h ALA 245 CO 0.10 -0.12 -0.11 0.28 0.00 0.00 0.00 179.25 179.40 1qij h VAL 246 N 0.30 0.82 -0.92 0.00 2.07 -1.40 -2.41 116.25 114.70 1qij h VAL 246 Ca 0.09 -0.35 0.11 0.00 0.82 0.00 0.00 66.70 67.37 1qij h VAL 246 Cb 0.10 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 1qij h VAL 246 CO -0.01 0.08 0.59 -0.08 0.02 0.00 0.00 177.57 178.17 1qij h GLU 247 N -0.50 0.85 -0.26 1.57 4.57 -1.40 0.36 114.58 119.77 1qij h GLU 247 Ca -0.03 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1qij h GLU 247 Cb 0.37 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1qij h GLU 247 CO 0.05 0.56 0.13 1.25 -1.18 0.00 0.00 179.01 179.83 1qij h LEU 248 N 0.88 0.21 -1.72 1.64 5.85 -1.05 -1.12 115.31 120.00 1qij h LEU 248 Ca 0.44 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 59.13 1qij h LEU 248 Cb 0.49 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1qij h LEU 248 CO -0.20 0.15 -0.17 1.23 -0.34 0.00 0.00 178.44 179.11 1qij h GLY 249 N 0.28 0.00 1.99 3.75 0.00 -0.24 -2.28 103.07 106.57 1qij h GLY 249 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.30 1qij h GLY 249 CO -0.07 0.00 -0.61 -0.09 0.00 0.00 0.00 176.54 175.77 1qij h ARG 250 N 0.00 0.01 0.00 4.80 2.43 0.76 -0.38 114.38 122.00 1qij h ARG 250 Ca -0.00 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 1qij h ARG 250 Cb 0.36 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1qij h ARG 250 CO 0.02 0.62 -0.29 -0.91 -1.51 0.00 0.00 179.97 177.91 1qij h ASN 251 N 0.01 0.00 -0.58 -3.80 -0.26 -0.72 -2.98 115.58 107.25 1qij h ASN 251 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1qij h ASN 251 Cb 1.09 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.35 1qij h ASN 251 CO 0.08 0.29 0.00 0.18 -1.06 0.00 0.00 177.43 176.92 1qij n LEU 252 N -3.32 4.35 -3.40 1.61 4.77 -1.16 -4.98 117.00 114.86 1qij n LEU 252 Ca 0.01 -2.39 -0.15 0.00 -0.03 0.00 0.00 56.01 53.44 1qij n LEU 252 Cb 0.52 -0.52 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1qij n LEU 252 CO 0.35 0.81 0.07 0.59 -1.33 0.00 0.00 177.39 177.89 1qij n ASN 253 N 0.94 -6.40 -4.57 -1.43 3.02 -1.10 -5.00 115.26 100.73 1qij n ASN 253 Ca 0.23 -0.59 -0.30 0.00 -0.03 0.00 0.00 54.58 53.90 1qij n ASN 253 Cb 0.80 -4.01 -0.10 0.00 -0.61 0.00 0.00 39.78 35.85 1qij n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qij s ASN 255 N -2.14 6.49 -0.29 0.00 3.84 -1.26 -4.75 114.94 116.83 1qij s ASN 255 Ca 0.21 2.58 0.11 0.00 0.21 0.00 0.00 52.86 55.97 1qij s ASN 255 Cb -0.11 -2.53 0.63 0.00 -0.55 0.00 0.00 41.25 38.68 1qij s ASN 255 CO 0.13 -1.02 1.63 0.18 -2.79 0.00 0.00 177.10 175.23 1qij n LEU 256 N 7.35 5.09 0.21 3.21 4.77 -1.26 -2.93 117.00 133.44 1qij n LEU 256 Ca 0.19 -3.34 0.09 0.00 -0.03 0.00 0.00 56.01 52.92 1qij n LEU 256 Cb 0.41 -0.68 0.36 0.00 -2.33 0.00 0.00 43.42 41.19 1qij n LEU 256 CO 0.67 0.91 0.75 0.78 -1.33 0.00 0.00 177.39 179.16 1qij h ASN 257 N 1.89 0.00 -5.00 -1.43 2.35 -1.95 -3.47 115.58 107.96 1qij h ASN 257 Ca 0.22 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 1qij h ASN 257 Cb 1.99 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 40.24 1qij h ASN 257 CO 0.55 0.25 0.20 -0.94 -1.65 0.00 0.00 177.43 175.84 1qij s SER 258 N -6.22 -0.54 0.23 5.81 1.04 -1.26 -5.00 113.70 107.76 1qij s SER 258 Ca 0.02 -0.04 -0.06 0.00 0.48 0.00 0.00 55.95 56.34 1qij s SER 258 Cb 0.09 0.60 0.33 0.00 0.10 0.00 0.00 66.02 67.14 1qij s SER 258 CO 0.66 -0.98 1.82 0.44 0.98 0.00 0.00 173.24 176.15 1qij h ASP 259 N 2.01 0.69 -0.65 7.02 5.19 -1.95 0.10 116.42 128.84 1qij h ASP 259 Ca -0.33 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.10 1qij h ASP 259 Cb 1.30 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 40.68 1qij h ASP 259 CO 0.38 0.43 0.36 -0.33 -3.12 0.00 0.00 179.24 176.96 1qij h GLU 260 N 0.82 0.90 0.24 3.56 3.07 -1.97 0.26 114.58 121.47 1qij h GLU 260 Ca 0.36 -0.10 0.01 0.00 -0.50 0.00 0.00 59.36 59.13 1qij h GLU 260 Cb 0.25 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 27.94 1qij h GLU 260 CO -0.20 0.68 -0.43 1.49 -1.40 0.00 0.00 179.01 179.15 1qij h GLU 261 N 0.89 -0.72 0.99 2.33 4.57 -1.43 -1.15 114.58 120.06 1qij h GLU 261 Ca 0.23 0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.41 1qij h GLU 261 Cb 0.03 0.16 0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1qij h GLU 261 CO -0.04 -0.48 -0.47 1.25 -1.18 0.00 0.00 179.01 178.09 1qij h LEU 262 N -0.74 -1.12 -0.60 1.64 5.85 -0.49 -2.81 115.31 117.03 1qij h LEU 262 Ca -0.01 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.88 1qij h LEU 262 Cb 0.72 0.29 -0.10 0.00 0.37 0.00 0.00 40.66 41.94 1qij h LEU 262 CO -0.17 -0.79 -0.01 0.40 -0.34 0.00 0.00 178.44 177.53 1qij h ILE 263 N -1.35 0.50 -0.77 4.05 2.04 -0.50 -0.61 117.51 120.86 1qij h ILE 263 Ca -0.14 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1qij h ILE 263 Cb 1.02 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 1qij h ILE 263 CO 0.22 0.02 0.49 -0.74 0.00 0.00 0.00 178.15 178.14 1qij h HIS 264 N 0.11 0.91 -0.73 1.37 2.76 -1.23 -0.24 115.15 118.10 1qij h HIS 264 Ca 0.31 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.45 1qij h HIS 264 Cb 0.50 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 29.13 1qij h HIS 264 CO -0.37 0.52 0.22 0.00 -1.30 0.00 0.00 177.93 177.00 1qij h LEU 266 N 1.08 0.00 -0.16 0.00 3.38 -0.49 -2.49 115.31 116.63 1qij h LEU 266 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1qij h LEU 266 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1qij h LEU 266 CO -0.01 0.29 0.00 0.54 0.09 0.00 0.00 178.44 179.35 1qij n ARG 267 N -3.76 0.23 0.00 1.13 1.74 -0.16 -3.03 116.66 112.80 1qij n ARG 267 Ca -0.01 0.25 0.12 0.00 -0.77 0.00 0.00 57.85 57.44 1qij n ARG 267 Cb 0.38 -1.80 0.24 0.00 -1.02 0.00 0.00 32.46 30.26 1qij n ARG 267 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1qij n GLU 268 N -2.20 0.86 -3.05 5.56 -0.58 -0.94 -4.92 120.64 115.37 1qij n GLU 268 Ca 0.05 -0.59 -0.36 0.00 -0.42 0.00 0.00 57.16 55.84 1qij n GLU 268 Cb 0.38 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.70 1qij n GLU 268 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1qij s LYS 269 N -2.55 4.32 0.52 3.49 -0.14 -1.17 -5.04 119.74 119.17 1qij s LYS 269 Ca 0.21 0.95 -0.21 0.00 -1.36 0.00 0.00 55.97 55.56 1qij s LYS 269 Cb 0.19 -2.89 -0.06 0.00 -1.68 0.00 0.00 37.83 33.38 1qij s LYS 269 CO 0.56 0.39 1.19 0.15 -0.76 0.00 0.00 175.35 176.89 1qij s LYS 270 N -1.93 3.40 0.27 1.68 1.02 -1.26 -4.91 119.74 118.00 1qij s LYS 270 Ca 0.43 1.81 -0.01 0.00 0.02 0.00 0.00 55.97 58.23 1qij s LYS 270 Cb -0.17 -2.18 0.59 0.00 -0.52 0.00 0.00 37.83 35.55 1qij s LYS 270 CO 0.22 -0.86 1.68 -1.35 -0.92 0.00 0.00 175.35 174.11 1qij h PRO 271 N 1.50 0.29 0.00 -1.68 0.11 -1.96 -1.04 132.00 129.21 1qij h PRO 271 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1qij h PRO 271 Cb 1.27 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1qij h PRO 271 CO 0.58 0.19 0.00 0.94 -0.21 0.00 0.00 178.00 179.50 1qij n GLN 272 N -5.14 0.08 0.02 1.05 -0.06 -1.26 -2.84 117.38 109.22 1qij n GLN 272 Ca 0.18 0.21 -0.10 0.00 -2.00 0.00 0.00 57.00 55.29 1qij n GLN 272 Cb 0.56 -1.50 -0.13 0.00 -4.06 0.00 0.00 30.24 25.11 1qij n GLN 272 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 1qij h GLU 273 N 0.00 0.05 -0.06 3.69 5.08 -1.54 -2.27 114.58 119.52 1qij h GLU 273 Ca 0.00 -0.08 -0.25 0.00 -1.00 0.00 0.00 59.36 58.03 1qij h GLU 273 Cb 0.21 0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.50 1qij h GLU 273 CO 0.00 0.76 -0.93 -0.07 -1.00 0.00 0.00 179.01 177.77 1qij h LEU 274 N 0.01 0.92 -1.06 1.33 4.07 -1.60 -3.18 115.31 115.80 1qij h LEU 274 Ca -0.21 -0.68 -0.09 0.00 0.08 0.00 0.00 57.88 56.98 1qij h LEU 274 Cb 1.95 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 43.40 1qij h LEU 274 CO 0.11 1.48 -0.38 0.40 -1.08 0.00 0.00 178.44 178.97 1qij h ILE 275 N 0.45 1.29 0.00 1.22 2.04 -1.62 -1.47 117.51 119.43 1qij h ILE 275 Ca -0.10 -1.40 -0.03 0.00 1.00 0.00 0.00 64.86 64.33 1qij h ILE 275 Cb 1.57 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1qij h ILE 275 CO 0.19 0.42 -0.16 0.44 0.00 0.00 0.00 178.15 179.03 1qij h ASP 276 N 0.15 0.00 -0.03 1.72 3.32 -1.38 -3.16 116.42 117.04 1qij h ASP 276 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1qij h ASP 276 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1qij h ASP 276 CO 0.06 0.16 0.00 1.33 -1.72 0.00 0.00 179.24 179.06 1qij n VAL 277 N -4.07 0.14 -0.28 -1.35 0.24 -1.13 -4.77 118.33 107.11 1qij n VAL 277 Ca -0.02 -0.57 0.10 0.00 -2.04 0.00 0.00 64.34 61.81 1qij n VAL 277 Cb 0.24 1.03 0.25 0.00 -1.47 0.00 0.00 33.84 33.89 1qij n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1qij h GLU 278 N 1.06 0.32 0.00 7.34 4.81 -1.23 -1.47 114.58 125.41 1qij h GLU 278 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1qij h GLU 278 Cb 0.28 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1qij h GLU 278 CO 0.00 0.21 0.00 0.91 -0.73 0.00 0.00 179.01 179.40 1qij n TRP 279 N -5.11 0.00 1.20 0.92 7.02 -1.26 -3.29 117.44 116.91 1qij n TRP 279 Ca 0.19 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.81 1qij n TRP 279 Cb 0.58 -0.21 0.67 0.00 -2.42 0.00 0.00 31.31 29.92 1qij n TRP 279 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1qij n ASN 280 N -1.21 0.04 -0.29 -0.99 3.02 -0.55 -3.89 115.26 111.39 1qij n ASN 280 Ca 0.12 0.16 0.12 0.00 -0.03 0.00 0.00 54.58 54.95 1qij n ASN 280 Cb 0.15 -0.37 0.25 0.00 -0.61 0.00 0.00 39.78 39.21 1qij n ASN 280 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1qij n VAL 281 N -1.39 0.00 -1.76 2.41 0.24 -1.21 -4.94 118.33 111.70 1qij n VAL 281 Ca 0.10 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.34 61.84 1qij n VAL 281 Cb 0.30 0.64 -0.01 0.00 -1.47 0.00 0.00 33.84 33.29 1qij n VAL 281 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1qij n LEU 282 N -0.57 4.52 0.22 1.34 4.77 -1.25 -4.85 117.00 121.18 1qij n LEU 282 Ca 0.11 1.16 0.08 0.00 -0.03 0.00 0.00 56.01 57.33 1qij n LEU 282 Cb 0.38 -1.61 0.51 0.00 -2.33 0.00 0.00 43.42 40.37 1qij n LEU 282 CO 0.28 0.20 0.83 1.55 -1.33 0.00 0.00 177.39 178.91 1qij h PRO 283 N 4.53 0.00 -4.93 3.23 0.13 -1.96 -3.46 132.00 129.54 1qij h PRO 283 Ca -0.48 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.34 1qij h PRO 283 Cb 1.22 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.21 1qij h PRO 283 CO 0.77 0.25 -0.68 -0.06 -0.23 0.00 0.00 178.00 178.05 1qij s PHE 284 N -3.99 1.28 -0.31 1.56 0.08 -1.26 -5.08 117.98 110.26 1qij s PHE 284 Ca -0.02 -0.91 -0.29 0.00 0.12 0.00 0.00 56.93 55.84 1qij s PHE 284 Cb 0.13 -0.71 0.01 0.00 -0.57 0.00 0.00 43.02 41.87 1qij s PHE 284 CO 0.65 -0.08 1.26 0.34 -0.10 0.00 0.00 175.22 177.30 1qij s ASP 285 N -3.19 6.70 0.35 1.36 -1.08 -1.26 -4.93 116.67 114.62 1qij s ASP 285 Ca 0.22 1.14 0.01 0.00 -0.52 0.00 0.00 52.55 53.40 1qij s ASP 285 Cb 0.05 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.96 1qij s ASP 285 CO 0.03 -1.07 0.42 -0.94 0.52 0.00 0.00 175.17 174.14 1qij s SER 286 N 2.64 1.26 -0.01 -0.34 1.04 -1.26 -4.67 113.70 112.36 1qij s SER 286 Ca 0.54 -1.61 0.01 0.00 0.48 0.00 0.00 55.95 55.37 1qij s SER 286 Cb -0.15 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1qij s SER 286 CO 0.23 -1.25 -0.02 -0.51 0.98 0.00 0.00 173.24 172.67 1qij s ILE 287 N -3.08 0.18 -0.91 -1.02 2.07 -0.76 -4.84 121.20 112.84 1qij s ILE 287 Ca 0.34 -0.06 -0.05 0.00 -1.41 0.00 0.00 60.65 59.47 1qij s ILE 287 Cb 0.00 -0.18 0.01 0.00 0.13 0.00 0.00 42.46 42.41 1qij s ILE 287 CO 0.24 0.07 0.79 0.33 -1.91 0.00 0.00 174.94 174.46 1qij n PHE 288 N 3.26 -1.89 -3.95 3.50 -0.00 -1.26 -4.77 117.46 112.36 1qij n PHE 288 Ca -0.16 0.68 -0.12 0.00 -0.00 0.00 0.00 57.45 57.86 1qij n PHE 288 Cb 0.57 -3.80 -0.13 0.00 -0.00 0.00 0.00 39.48 36.12 1qij n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1qij s ARG 289 N -5.74 0.17 0.05 -4.13 1.81 -1.26 -4.71 118.95 105.13 1qij s ARG 289 Ca 0.34 -0.25 0.05 0.00 -1.72 0.00 0.00 55.73 54.15 1qij s ARG 289 Cb -0.15 -0.03 -0.02 0.00 -0.45 0.00 0.00 34.95 34.30 1qij s ARG 289 CO 0.50 0.00 -0.15 -0.06 -0.68 0.00 0.00 175.30 174.90 1qij s PHE 290 N -0.53 1.34 0.03 -0.53 0.08 -1.26 -5.07 117.98 112.04 1qij s PHE 290 Ca -0.05 -0.38 -0.12 0.00 0.12 0.00 0.00 56.93 56.50 1qij s PHE 290 Cb -0.04 -0.78 -0.06 0.00 -0.57 0.00 0.00 43.02 41.57 1qij s PHE 290 CO -0.00 0.06 1.19 0.77 -0.10 0.00 0.00 175.22 177.13 1qij h SER 291 N 4.73 -0.47 -3.61 1.36 0.02 -1.92 -3.41 113.55 110.25 1qij h SER 291 Ca -0.40 0.04 -0.68 0.00 -0.84 0.00 0.00 61.79 59.91 1qij h SER 291 Cb 1.18 0.15 -0.27 0.00 0.14 0.00 0.00 62.40 63.61 1qij h SER 291 CO 0.43 -0.22 -0.62 -0.36 -1.14 0.00 0.00 176.83 174.92 1qij s PHE 292 N -3.95 3.17 0.24 3.45 0.08 -1.26 -4.99 117.98 114.71 1qij s PHE 292 Ca -0.06 -1.05 0.01 0.00 0.12 0.00 0.00 56.93 55.94 1qij s PHE 292 Cb 0.01 -2.26 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 1qij s PHE 292 CO 0.20 -0.60 0.14 0.14 -0.10 0.00 0.00 175.22 175.00 1qij s VAL 293 N 1.48 0.15 0.70 -0.44 -7.23 -1.26 -4.53 120.40 109.28 1qij s VAL 293 Ca 0.02 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.02 1qij s VAL 293 Cb -0.18 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.19 1qij s VAL 293 CO 0.03 0.00 0.50 -2.65 -0.31 0.00 0.00 175.10 172.67 1qij n PRO 294 N -0.38 0.32 -4.21 4.82 -0.02 -1.23 -4.67 135.00 129.63 1qij n PRO 294 Ca 0.02 0.15 -0.19 0.00 -2.02 0.00 0.00 63.50 61.46 1qij n PRO 294 Cb 0.66 -1.79 -0.15 0.00 -0.02 0.00 0.00 33.50 32.19 1qij n PRO 294 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1qij s VAL 295 N -1.89 0.54 -0.78 -1.45 0.11 -1.26 -1.06 120.40 114.61 1qij s VAL 295 Ca 0.65 -0.21 -0.25 0.00 -2.93 0.00 0.00 61.98 59.25 1qij s VAL 295 Cb -0.36 -0.51 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 1qij s VAL 295 CO 0.58 0.19 1.93 -0.63 -3.33 0.00 0.00 175.10 173.84 1qij s ILE 296 N 0.39 3.40 -0.28 7.04 -1.09 -0.74 -4.77 121.20 125.15 1qij s ILE 296 Ca -0.05 -0.13 0.22 0.00 -2.23 0.00 0.00 60.65 58.46 1qij s ILE 296 Cb -0.09 -3.95 -0.22 0.00 -1.58 0.00 0.00 42.46 36.62 1qij s ILE 296 CO 0.00 -0.90 0.74 -0.90 -1.23 0.00 0.00 174.94 172.64 1qij n ASP 297 N 13.59 0.38 0.00 3.58 5.75 -1.26 -4.23 116.55 134.36 1qij n ASP 297 Ca 0.32 -0.07 0.00 0.00 -0.01 0.00 0.00 54.79 55.03 1qij n ASP 297 Cb 0.49 1.36 0.00 0.00 -1.03 0.00 0.00 41.12 41.94 1qij n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qij n GLY 298 N 1.29 0.71 0.23 6.12 0.00 -0.53 -4.92 105.19 108.08 1qij n GLY 298 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1qij n GLY 298 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qij n GLU 299 N -2.08 0.00 -0.27 1.61 1.02 -1.26 -4.48 120.64 115.18 1qij n GLU 299 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.18 1qij n GLU 299 Cb 0.00 -0.01 0.18 0.00 -0.02 0.00 0.00 31.44 31.59 1qij n GLU 299 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1qij h PHE 300 N 0.00 0.69 -3.72 -0.32 3.04 -1.93 -3.31 116.94 111.39 1qij h PHE 300 Ca 0.00 0.03 -0.68 0.00 3.98 0.00 0.00 57.97 61.30 1qij h PHE 300 Cb 0.00 -0.19 -0.32 0.00 2.56 0.00 0.00 35.95 38.00 1qij h PHE 300 CO 0.00 0.20 -0.69 -0.06 -2.02 0.00 0.00 178.31 175.74 1qij s PHE 301 N -6.02 3.23 0.14 0.41 0.08 -1.26 -4.26 117.98 110.30 1qij s PHE 301 Ca -0.12 -1.72 -0.27 0.00 0.12 0.00 0.00 56.93 54.93 1qij s PHE 301 Cb 0.20 -2.13 -0.02 0.00 -0.57 0.00 0.00 43.02 40.50 1qij s PHE 301 CO 0.77 -0.77 1.59 -1.35 -0.10 0.00 0.00 175.22 175.35 1qij h PRO 302 N 8.05 -0.38 0.00 0.24 0.11 -1.79 -1.41 132.00 136.81 1qij h PRO 302 Ca -0.23 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1qij h PRO 302 Cb 1.07 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qij h PRO 302 CO 0.55 -0.26 0.00 0.25 -0.21 0.00 0.00 178.00 178.34 1qij n THR 303 N -5.42 0.00 -2.10 -1.15 -2.24 -1.26 -4.42 114.28 97.68 1qij n THR 303 Ca -0.02 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.43 1qij n THR 303 Cb 0.35 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1qij n THR 303 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qij s SER 304 N 1.00 5.93 0.16 3.42 1.04 -1.26 -4.84 113.70 119.14 1qij s SER 304 Ca 0.00 1.77 -0.14 0.00 0.48 0.00 0.00 55.95 58.06 1qij s SER 304 Cb 0.00 -2.53 0.04 0.00 0.10 0.00 0.00 66.02 63.63 1qij s SER 304 CO 0.00 -1.06 1.73 -0.07 0.98 0.00 0.00 173.24 174.82 1qij h LEU 305 N 0.51 0.67 -1.13 2.42 3.38 -1.99 -2.63 115.31 116.53 1qij h LEU 305 Ca -0.47 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.38 1qij h LEU 305 Cb 1.21 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 1qij h LEU 305 CO 0.58 0.62 0.59 -0.08 0.09 0.00 0.00 178.44 180.23 1qij h GLU 306 N 0.67 1.14 0.00 1.13 4.57 -1.99 -0.47 114.58 119.63 1qij h GLU 306 Ca 0.17 -0.07 -0.12 0.00 -1.18 0.00 0.00 59.36 58.16 1qij h GLU 306 Cb 0.13 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.45 1qij h GLU 306 CO -0.02 0.75 -0.58 0.66 -1.18 0.00 0.00 179.01 178.65 1qij h SER 307 N 1.17 0.00 -0.25 1.04 4.64 -1.93 -1.95 113.55 116.27 1qij h SER 307 Ca 0.33 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.55 1qij h SER 307 Cb -0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 1qij h SER 307 CO -0.08 0.58 -0.27 0.24 -0.87 0.00 0.00 176.83 176.42 1qij h MET 308 N 0.00 0.62 0.00 4.77 2.86 -0.95 -1.34 114.93 120.89 1qij h MET 308 Ca -0.01 -0.34 -0.06 0.00 -2.06 0.00 0.00 59.70 57.24 1qij h MET 308 Cb 1.16 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 1qij h MET 308 CO 0.07 0.94 -0.30 -0.07 1.06 0.00 0.00 176.91 178.61 1qij h LEU 309 N 0.33 0.00 0.00 1.22 3.38 -1.02 -2.13 115.31 117.09 1qij h LEU 309 Ca 0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.80 1qij h LEU 309 Cb 0.84 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 1qij h LEU 309 CO 0.07 0.30 -1.07 0.78 0.09 0.00 0.00 178.44 178.60 1qij h ASN 310 N 0.00 0.00 -0.07 -0.43 2.35 -1.22 -3.32 115.58 112.90 1qij h ASN 310 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1qij h ASN 310 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1qij h ASN 310 CO 0.04 0.92 0.00 -1.54 -1.65 0.00 0.00 177.43 175.20 1qij n SER 311 N -3.27 1.82 -0.51 5.81 3.41 -0.52 -4.92 113.62 115.45 1qij n SER 311 Ca -0.03 -1.63 -0.07 0.00 -0.26 0.00 0.00 58.87 56.88 1qij n SER 311 Cb 0.93 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.82 1qij n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qij n GLY 312 N 1.20 0.86 3.51 5.00 0.00 -1.03 -4.91 105.19 109.82 1qij n GLY 312 Ca 0.18 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 1qij n GLY 312 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1qij n ASN 313 N 0.16 4.90 -3.59 1.61 5.15 -0.83 -4.84 115.26 117.81 1qij n ASN 313 Ca -0.07 -2.92 -0.04 0.00 -0.60 0.00 0.00 54.58 50.95 1qij n ASN 313 Cb 0.29 -1.72 -0.02 0.00 -0.53 0.00 0.00 39.78 37.80 1qij n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1qij s PHE 314 N 3.85 -0.13 -0.11 1.20 -0.12 -1.26 -4.75 117.98 116.67 1qij s PHE 314 Ca 0.52 0.07 -0.29 0.00 -0.05 0.00 0.00 56.93 57.18 1qij s PHE 314 Cb 0.04 0.52 -0.07 0.00 -0.63 0.00 0.00 43.02 42.88 1qij s PHE 314 CO 0.06 -0.23 2.06 0.21 -0.05 0.00 0.00 175.22 177.27 1qij s LYS 315 N -2.46 3.63 -0.37 1.99 2.20 -0.06 -4.95 119.74 119.73 1qij s LYS 315 Ca 0.10 2.26 -0.23 0.00 -0.36 0.00 0.00 55.97 57.74 1qij s LYS 315 Cb -0.00 -4.26 0.01 0.00 -1.51 0.00 0.00 37.83 32.07 1qij s LYS 315 CO -0.05 -1.54 0.77 0.15 -0.36 0.00 0.00 175.35 174.33 1qij s LYS 316 N 5.39 3.74 0.00 4.03 3.01 -1.26 -4.96 119.74 129.69 1qij s LYS 316 Ca 0.93 0.28 0.00 0.00 -1.01 0.00 0.00 55.97 56.17 1qij s LYS 316 Cb -0.37 -3.81 0.00 0.00 -1.01 0.00 0.00 37.83 32.64 1qij s LYS 316 CO 0.38 -0.85 0.00 -2.37 0.51 0.00 0.00 175.35 173.02 1qij n THR 317 N 5.78 0.00 -4.11 2.17 5.66 -1.26 -4.81 114.28 117.71 1qij n THR 317 Ca 0.03 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.74 1qij n THR 317 Cb 0.48 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.19 1qij n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 1qij s GLN 318 N 1.81 2.68 0.02 1.09 1.11 -1.26 -1.07 119.66 124.04 1qij s GLN 318 Ca 0.00 -0.85 -0.06 0.00 0.01 0.00 0.00 55.36 54.46 1qij s GLN 318 Cb 0.00 -2.58 -0.00 0.00 -1.01 0.00 0.00 33.01 29.42 1qij s GLN 318 CO 0.00 0.52 0.12 0.96 0.01 0.00 0.00 175.29 176.90 1qij s ILE 319 N -1.49 0.10 -0.10 1.08 -4.36 -0.70 -3.39 121.20 112.35 1qij s ILE 319 Ca 0.28 -0.85 -0.00 0.00 -0.26 0.00 0.00 60.65 59.82 1qij s ILE 319 Cb -0.11 -0.60 0.02 0.00 1.25 0.00 0.00 42.46 43.02 1qij s ILE 319 CO 0.20 -0.47 -0.07 -0.22 0.24 0.00 0.00 174.94 174.63 1qij s LEU 320 N -1.68 1.13 0.19 0.37 0.20 -0.95 -1.64 118.68 116.30 1qij s LEU 320 Ca -0.11 -0.26 -0.08 0.00 0.69 0.00 0.00 54.13 54.38 1qij s LEU 320 Cb -0.05 -0.75 -0.02 0.00 -0.43 0.00 0.00 46.19 44.94 1qij s LEU 320 CO -0.01 -0.11 0.29 -1.48 -0.29 0.00 0.00 176.35 174.74 1qij s LEU 321 N 1.62 0.88 0.00 -0.68 2.34 -0.05 -1.76 118.68 121.04 1qij s LEU 321 Ca 0.02 -1.02 -0.13 0.00 0.06 0.00 0.00 54.13 53.06 1qij s LEU 321 Cb -0.13 1.11 0.04 0.00 -0.56 0.00 0.00 46.19 46.65 1qij s LEU 321 CO -0.06 -0.94 0.57 0.61 -1.06 0.00 0.00 176.35 175.47 1qij n GLY 322 N -0.26 0.53 3.21 -3.48 0.00 -1.10 -1.46 105.19 102.62 1qij n GLY 322 Ca -0.04 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1qij n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qij s VAL 323 N -2.13 0.01 0.23 1.61 -7.23 -1.18 -1.31 120.40 110.40 1qij s VAL 323 Ca 0.13 -1.97 -0.01 0.00 -1.81 0.00 0.00 61.98 58.32 1qij s VAL 323 Cb -0.01 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.45 1qij s VAL 323 CO 0.00 -0.04 0.43 0.20 -0.31 0.00 0.00 175.10 175.37 1qij s ASN 324 N -3.14 6.38 0.16 4.85 0.01 -1.26 -1.16 114.94 120.78 1qij s ASN 324 Ca 0.37 0.44 -0.15 0.00 -0.71 0.00 0.00 52.86 52.80 1qij s ASN 324 Cb 0.07 -2.02 0.05 0.00 0.41 0.00 0.00 41.25 39.75 1qij s ASN 324 CO 0.11 -0.09 1.81 0.50 -1.51 0.00 0.00 177.10 177.92 1qij h LYS 325 N 1.83 0.53 -2.27 -0.60 3.64 -1.31 -3.32 116.57 115.07 1qij h LYS 325 Ca -0.48 -0.03 -0.61 0.00 -1.27 0.00 0.00 60.65 58.26 1qij h LYS 325 Cb 1.19 -0.12 -0.41 0.00 -0.41 0.00 0.00 32.23 32.48 1qij h LYS 325 CO 0.67 0.35 -0.52 -0.25 -2.27 0.00 0.00 179.45 177.43 1qij n ASP 326 N -4.82 4.41 0.28 4.20 8.00 -0.86 -4.88 116.55 122.87 1qij n ASP 326 Ca 0.02 -3.60 0.14 0.00 0.71 0.00 0.00 54.79 52.06 1qij n ASP 326 Cb 0.05 -0.64 0.85 0.00 -0.02 0.00 0.00 41.12 41.36 1qij n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1qij h GLU 327 N 3.52 0.00 0.19 -1.24 4.39 -1.73 -3.30 114.58 116.41 1qij h GLU 327 Ca 0.17 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.55 1qij h GLU 327 Cb 0.55 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.22 1qij h GLU 327 CO 0.86 0.00 -1.52 0.78 -1.16 0.00 0.00 179.01 177.96 1qij h GLY 328 N 0.00 0.47 -0.73 -3.84 0.00 -1.86 -3.41 103.07 93.71 1qij h GLY 328 Ca 0.01 -1.20 0.23 0.00 0.00 0.00 0.00 47.33 46.37 1qij h GLY 328 CO -0.00 1.05 0.12 -1.14 0.00 0.00 0.00 176.54 176.57 1qij n SER 329 N -3.74 0.01 -0.24 0.19 3.41 -1.24 -1.17 113.62 110.83 1qij n SER 329 Ca -0.21 1.24 0.10 0.00 -0.26 0.00 0.00 58.87 59.74 1qij n SER 329 Cb 1.03 -0.49 0.38 0.00 -0.26 0.00 0.00 64.21 64.86 1qij n SER 329 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1qij h PHE 330 N 0.00 0.79 0.00 7.33 3.04 -1.83 -2.09 116.94 124.18 1qij h PHE 330 Ca 0.49 0.02 -0.12 0.00 3.98 0.00 0.00 57.97 62.34 1qij h PHE 330 Cb 1.12 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 39.36 1qij h PHE 330 CO -0.27 0.33 -0.78 0.74 -2.02 0.00 0.00 178.31 176.31 1qij h PHE 331 N 0.70 0.00 -0.21 0.41 -1.00 -1.45 -3.21 116.94 112.18 1qij h PHE 331 Ca 0.40 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.98 1qij h PHE 331 Cb 0.59 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.15 1qij h PHE 331 CO -0.00 0.53 -0.67 -0.07 -1.61 0.00 0.00 178.31 176.49 1qij h LEU 332 N 0.00 0.92 -0.33 1.54 3.38 -1.46 -1.69 115.31 117.67 1qij h LEU 332 Ca -0.05 -0.55 0.06 0.00 0.09 0.00 0.00 57.88 57.43 1qij h LEU 332 Cb 1.45 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 1qij h LEU 332 CO 0.06 1.35 0.02 0.25 0.09 0.00 0.00 178.44 180.20 1qij h LEU 333 N 0.58 -0.10 -0.24 1.67 5.85 -1.44 -0.09 115.31 121.55 1qij h LEU 333 Ca -0.02 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.65 1qij h LEU 333 Cb 1.28 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1qij h LEU 333 CO 0.14 -0.01 -0.59 1.88 -0.34 0.00 0.00 178.44 179.52 1qij h TYR 334 N 0.12 0.00 0.00 1.25 -1.99 -1.56 -3.42 116.97 111.37 1qij h TYR 334 Ca 0.16 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.89 1qij h TYR 334 Cb 0.21 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.94 1qij h TYR 334 CO -0.22 0.59 -0.21 0.41 -0.00 0.00 0.00 178.16 178.72 1qij n GLY 335 N 0.99 0.60 3.80 3.88 0.00 -0.64 -5.06 105.19 108.77 1qij n GLY 335 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1qij n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qij s ALA 336 N -0.75 3.71 0.17 4.61 0.00 -0.07 -5.03 121.76 124.40 1qij s ALA 336 Ca 0.00 -0.44 -0.32 0.00 0.00 0.00 0.00 51.96 51.20 1qij s ALA 336 Cb 0.00 -2.27 -0.10 0.00 0.00 0.00 0.00 23.12 20.75 1qij s ALA 336 CO 0.00 0.35 1.59 -1.25 0.00 0.00 0.00 175.76 176.45 1qij s PRO 337 N -0.40 4.20 0.00 0.00 0.04 -1.26 -3.31 135.00 134.27 1qij s PRO 337 Ca 0.18 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.61 1qij s PRO 337 Cb -0.14 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1qij s PRO 337 CO 0.06 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.89 1qij n GLY 338 N 3.72 1.02 3.79 0.56 0.00 -1.26 -4.86 105.19 108.15 1qij n GLY 338 Ca 0.14 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1qij n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1qij s PHE 339 N -0.90 3.83 0.00 1.61 0.40 -1.21 -4.65 117.98 117.07 1qij s PHE 339 Ca 0.00 1.41 -0.01 0.00 -0.60 0.00 0.00 56.93 57.73 1qij s PHE 339 Cb 0.00 -2.62 -0.01 0.00 0.51 0.00 0.00 43.02 40.90 1qij s PHE 339 CO 0.00 0.52 0.00 -1.12 0.70 0.00 0.00 175.22 175.32 1qij s SER 340 N -0.96 0.07 0.53 1.36 0.01 -1.26 -4.90 113.70 108.54 1qij s SER 340 Ca 0.32 -0.16 0.30 0.00 1.31 0.00 0.00 55.95 57.72 1qij s SER 340 Cb -0.21 0.06 1.44 0.00 0.21 0.00 0.00 66.02 67.52 1qij s SER 340 CO 0.22 -0.12 2.04 0.50 0.41 0.00 0.00 173.24 176.29 1qij h LYS 341 N 5.57 0.00 -0.33 12.44 3.64 -1.98 -3.08 116.57 132.83 1qij h LYS 341 Ca -0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1qij h LYS 341 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1qij h LYS 341 CO 0.47 0.11 0.00 -0.25 -2.27 0.00 0.00 179.45 177.50 1qij n ASP 342 N -3.42 2.98 -4.42 4.20 8.00 -1.26 -4.42 116.55 118.22 1qij n ASP 342 Ca -0.01 -1.88 -0.20 0.00 0.71 0.00 0.00 54.79 53.40 1qij n ASP 342 Cb 0.27 -0.22 -0.10 0.00 -0.02 0.00 0.00 41.12 41.05 1qij n ASP 342 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1qij s SER 343 N -1.11 2.26 0.00 -2.24 1.04 -1.17 -4.99 113.70 107.49 1qij s SER 343 Ca 0.28 -1.32 0.13 0.00 0.48 0.00 0.00 55.95 55.52 1qij s SER 343 Cb 0.16 -0.07 0.60 0.00 0.10 0.00 0.00 66.02 66.82 1qij s SER 343 CO 0.22 -0.55 1.38 -0.62 0.98 0.00 0.00 173.24 174.64 1qij n GLU 344 N -0.61 0.08 -3.80 4.02 1.02 -1.26 -4.67 120.64 115.42 1qij n GLU 344 Ca -0.03 0.23 -0.34 0.00 -0.02 0.00 0.00 57.16 57.00 1qij n GLU 344 Cb 0.66 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.60 1qij n GLU 344 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1qij n SER 345 N -1.41 -5.01 -4.73 1.62 7.64 -1.26 -4.91 113.62 105.57 1qij n SER 345 Ca 0.05 -1.05 -0.40 0.00 1.01 0.00 0.00 58.87 58.47 1qij n SER 345 Cb 0.13 -2.59 -0.04 0.00 -1.01 0.00 0.00 64.21 60.69 1qij n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1qij s LYS 346 N -6.10 4.52 -0.13 1.43 1.02 -1.26 -4.79 119.74 114.42 1qij s LYS 346 Ca 0.37 1.15 -0.05 0.00 0.02 0.00 0.00 55.97 57.45 1qij s LYS 346 Cb -0.16 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.70 1qij s LYS 346 CO 0.90 0.16 0.06 0.42 -0.92 0.00 0.00 175.35 175.97 1qij s ILE 347 N 0.35 4.84 0.86 2.17 -1.09 -0.91 -4.98 121.20 122.44 1qij s ILE 347 Ca 0.42 -0.03 -0.12 0.00 -2.23 0.00 0.00 60.65 58.69 1qij s ILE 347 Cb -0.20 -3.11 0.13 0.00 -1.58 0.00 0.00 42.46 37.70 1qij s ILE 347 CO 0.24 0.55 1.21 -0.94 -1.23 0.00 0.00 174.94 174.77 1qij s SER 348 N -0.44 3.91 0.18 3.58 1.04 -1.26 -4.27 113.70 116.43 1qij s SER 348 Ca 0.10 0.42 -0.12 0.00 0.48 0.00 0.00 55.95 56.83 1qij s SER 348 Cb -0.12 -0.72 0.08 0.00 0.10 0.00 0.00 66.02 65.36 1qij s SER 348 CO 0.02 -2.23 1.74 0.03 0.98 0.00 0.00 173.24 173.78 1qij h ARG 349 N -1.22 0.89 0.28 4.02 2.47 -1.94 -0.47 114.38 118.41 1qij h ARG 349 Ca -0.44 -0.15 -0.01 0.00 -1.26 0.00 0.00 59.98 58.12 1qij h ARG 349 Cb 1.28 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.45 1qij h ARG 349 CO 0.51 0.74 -0.13 0.93 0.56 0.00 0.00 179.97 182.57 1qij h GLU 350 N 0.83 -0.36 0.00 0.04 4.39 -2.00 -2.30 114.58 115.19 1qij h GLU 350 Ca 0.20 0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.88 1qij h GLU 350 Cb 0.16 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1qij h GLU 350 CO -0.02 -0.22 -0.21 -0.44 -1.16 0.00 0.00 179.01 176.96 1qij h ASP 351 N -0.40 0.00 0.24 1.42 3.32 -1.87 -1.39 116.42 117.74 1qij h ASP 351 Ca -0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1qij h ASP 351 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1qij h ASP 351 CO 0.06 0.21 -0.11 0.15 -1.72 0.00 0.00 179.24 177.83 1qij h PHE 352 N 0.00 -0.30 0.00 4.55 3.57 -0.75 -0.89 116.94 123.13 1qij h PHE 352 Ca -0.00 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 1qij h PHE 352 Cb 0.47 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1qij h PHE 352 CO 0.00 -0.09 -0.30 0.52 -2.23 0.00 0.00 178.31 176.21 1qij h MET 353 N -0.45 0.00 -0.67 1.11 2.86 -1.17 -0.63 114.93 115.99 1qij h MET 353 Ca -0.03 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1qij h MET 353 Cb 0.34 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1qij h MET 353 CO 0.05 0.30 0.09 0.77 1.06 0.00 0.00 176.91 179.19 1qij h SER 354 N 0.00 1.07 -0.56 1.22 0.02 -1.00 -2.33 113.55 111.96 1qij h SER 354 Ca -0.00 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 1qij h SER 354 Cb 0.56 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1qij h SER 354 CO 0.04 1.07 0.22 1.23 -1.14 0.00 0.00 176.83 178.25 1qij h GLY 355 N 1.04 0.90 1.79 -3.77 0.00 -0.07 -1.69 103.07 101.27 1qij h GLY 355 Ca 0.20 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1qij h GLY 355 CO 0.02 0.46 -0.06 -2.08 0.00 0.00 0.00 176.54 174.88 1qij h VAL 356 N 0.77 1.15 -0.32 4.60 2.07 -0.97 0.11 116.25 123.66 1qij h VAL 356 Ca 0.19 -0.62 -0.16 0.00 0.82 0.00 0.00 66.70 66.93 1qij h VAL 356 Cb 0.20 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1qij h VAL 356 CO -0.02 0.20 -0.43 0.50 0.02 0.00 0.00 177.57 177.85 1qij h LYS 357 N 0.26 0.82 0.00 1.57 1.63 -0.96 -2.62 116.57 117.27 1qij h LYS 357 Ca 0.06 -0.45 -0.11 0.00 -0.85 0.00 0.00 60.65 59.30 1qij h LYS 357 Cb 0.28 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 1qij h LYS 357 CO 0.01 1.08 -0.53 -0.07 -3.45 0.00 0.00 179.45 176.49 1qij h LEU 358 N 0.66 0.00 0.11 5.20 4.07 -0.53 -3.28 115.31 121.55 1qij h LEU 358 Ca 0.05 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.72 1qij h LEU 358 Cb 1.00 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.74 1qij h LEU 358 CO 0.10 0.53 -1.38 0.28 -1.08 0.00 0.00 178.44 176.89 1qij h SER 359 N 0.00 0.37 -2.24 -0.43 0.02 -0.91 -2.03 113.55 108.32 1qij h SER 359 Ca -0.01 -0.45 -0.60 0.00 -0.84 0.00 0.00 61.79 59.90 1qij h SER 359 Cb 1.10 -0.12 -0.42 0.00 0.14 0.00 0.00 62.40 63.10 1qij h SER 359 CO 0.07 1.36 -0.61 0.52 -1.14 0.00 0.00 176.83 177.03 1qij n VAL 360 N -3.47 2.19 0.26 2.27 0.31 -1.00 -4.88 118.33 114.02 1qij n VAL 360 Ca -0.12 -5.15 0.17 0.00 -0.01 0.00 0.00 64.34 59.23 1qij n VAL 360 Cb 1.03 -2.10 0.90 0.00 -0.91 0.00 0.00 33.84 32.76 1qij n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1qij h PRO 361 N 4.25 0.00 -0.62 5.55 0.13 -1.73 -2.69 132.00 136.88 1qij h PRO 361 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1qij h PRO 361 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1qij h PRO 361 CO 0.81 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.19 1qij n HIS 362 N -3.71 1.09 -4.06 1.56 1.44 -1.26 -4.95 115.22 105.33 1qij n HIS 362 Ca -0.01 -0.45 -0.36 0.00 -2.01 0.00 0.00 57.72 54.89 1qij n HIS 362 Cb 0.22 -0.15 -0.07 0.00 0.12 0.00 0.00 29.99 30.11 1qij n HIS 362 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1qij s ALA 363 N -1.63 3.66 1.04 1.59 0.00 -1.02 -5.10 121.76 120.30 1qij s ALA 363 Ca 0.41 -0.70 -0.16 0.00 0.00 0.00 0.00 51.96 51.50 1qij s ALA 363 Cb 0.25 -1.79 0.21 0.00 0.00 0.00 0.00 23.12 21.79 1qij s ALA 363 CO 0.22 0.61 1.18 0.54 0.00 0.00 0.00 175.76 178.31 1qij s ASN 364 N -1.00 2.42 0.53 0.00 2.20 -1.26 -4.68 114.94 113.14 1qij s ASN 364 Ca 0.15 0.64 0.19 0.00 -0.94 0.00 0.00 52.86 52.90 1qij s ASN 364 Cb -0.12 -0.94 1.32 0.00 -2.00 0.00 0.00 41.25 39.52 1qij s ASN 364 CO 0.04 -3.20 2.10 0.44 -2.94 0.00 0.00 177.10 173.54 1qij h ASP 365 N -1.95 0.00 -0.32 3.54 5.19 -1.99 -0.84 116.42 120.05 1qij h ASP 365 Ca -0.47 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 55.85 1qij h ASP 365 Cb 1.29 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.79 1qij h ASP 365 CO 0.45 0.00 -0.15 0.25 -3.12 0.00 0.00 179.24 176.66 1qij h LEU 366 N 0.00 0.69 -0.37 1.55 5.85 -2.00 -2.56 115.31 118.47 1qij h LEU 366 Ca 0.08 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 1qij h LEU 366 Cb 0.34 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1qij h LEU 366 CO -0.00 0.94 0.07 1.23 -0.34 0.00 0.00 178.44 180.34 1qij h GLY 367 N 0.43 0.65 1.15 3.75 0.00 -1.54 -1.44 103.07 106.07 1qij h GLY 367 Ca 0.07 -0.42 0.10 0.00 0.00 0.00 0.00 47.33 47.08 1qij h GLY 367 CO 0.05 0.39 0.33 1.41 0.00 0.00 0.00 176.54 178.72 1qij h LEU 368 N 0.44 0.17 -0.02 3.11 3.38 -1.21 0.05 115.31 121.22 1qij h LEU 368 Ca 0.11 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.82 1qij h LEU 368 Cb 0.35 -0.03 0.02 0.00 0.09 0.00 0.00 40.66 41.08 1qij h LEU 368 CO 0.01 0.10 -1.03 0.44 0.09 0.00 0.00 178.44 178.05 1qij h ASP 369 N 0.18 0.88 -0.28 -0.43 3.32 -0.98 -2.55 116.42 116.57 1qij h ASP 369 Ca 0.22 -0.70 0.01 0.00 0.02 0.00 0.00 57.03 56.58 1qij h ASP 369 Cb 0.64 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1qij h ASP 369 CO -0.04 1.50 0.17 0.00 -1.72 0.00 0.00 179.24 179.16 1qij h ALA 370 N 0.44 0.35 -0.46 3.45 0.00 -0.01 -0.33 119.26 122.70 1qij h ALA 370 Ca -0.12 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1qij h ALA 370 Cb 1.68 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 1qij h ALA 370 CO 0.20 -0.20 0.27 0.28 0.00 0.00 0.00 179.25 179.80 1qij h VAL 371 N 0.35 1.04 -0.54 0.00 2.07 -1.16 -1.21 116.25 116.80 1qij h VAL 371 Ca 0.10 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1qij h VAL 371 Cb -0.02 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 1qij h VAL 371 CO -0.04 0.10 0.24 0.74 0.02 0.00 0.00 177.57 178.63 1qij h THR 372 N 0.54 1.21 -0.76 2.57 2.02 -1.17 -1.82 112.91 115.49 1qij h THR 372 Ca 0.19 -0.64 -0.05 0.00 0.77 0.00 0.00 66.41 66.68 1qij h THR 372 Cb 0.02 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1qij h THR 372 CO -0.09 0.25 0.28 0.25 0.37 0.00 0.00 175.52 176.57 1qij h LEU 373 N 0.73 1.08 -1.42 2.58 5.85 -0.86 -2.27 115.31 121.01 1qij h LEU 373 Ca 0.18 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1qij h LEU 373 Cb 0.17 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1qij h LEU 373 CO -0.02 0.97 -0.23 -0.61 -0.34 0.00 0.00 178.44 178.22 1qij h GLN 374 N 1.12 0.00 -0.13 1.25 5.75 -0.90 -3.25 115.11 118.96 1qij h GLN 374 Ca 0.25 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.73 1qij h GLN 374 Cb 0.25 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 1qij h GLN 374 CO -0.02 0.23 -0.07 0.66 -2.65 0.00 0.00 178.83 176.98 1qij n TYR 375 N -3.59 0.45 -4.47 3.99 4.01 -0.71 -5.00 117.16 111.84 1qij n TYR 375 Ca -0.01 -1.10 -0.29 0.00 -0.16 0.00 0.00 57.90 56.34 1qij n TYR 375 Cb 0.36 -0.26 -0.17 0.00 -0.31 0.00 0.00 39.34 38.97 1qij n TYR 375 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1qij s THR 376 N -2.96 1.53 -0.90 -0.72 2.01 -0.88 -4.86 115.64 108.86 1qij s THR 376 Ca 0.38 -0.66 -0.19 0.00 0.31 0.00 0.00 61.69 61.53 1qij s THR 376 Cb 0.33 -1.39 0.13 0.00 0.01 0.00 0.00 72.50 71.58 1qij s THR 376 CO 0.03 0.45 1.08 -0.62 -0.69 0.00 0.00 174.62 174.87 1qij s ASP 377 N 0.98 6.61 0.00 3.53 2.15 -1.26 -4.89 116.67 123.79 1qij s ASP 377 Ca -0.07 -2.03 0.00 0.00 0.43 0.00 0.00 52.55 50.88 1qij s ASP 377 Cb -0.15 -2.38 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1qij s ASP 377 CO -0.02 -1.04 0.70 0.79 -0.17 0.00 0.00 175.17 175.44 1qij n TRP 378 N 6.38 0.00 0.57 -5.34 7.02 -1.26 -0.29 117.44 124.52 1qij n TRP 378 Ca 0.21 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.81 1qij n TRP 378 Cb 0.49 -0.21 0.22 0.00 -2.42 0.00 0.00 31.31 29.38 1qij n TRP 378 CO 0.00 0.00 0.00 0.52 -2.02 0.00 0.00 177.69 176.19 1qij h MET 379 N 0.00 0.00 -0.49 -0.99 2.86 -2.06 -3.37 114.93 110.88 1qij h MET 379 Ca 0.00 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.37 1qij h MET 379 Cb 0.02 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 31.37 1qij h MET 379 CO 0.00 0.00 -0.86 -3.47 1.06 0.00 0.00 176.91 173.64 1qij n ASP 380 N -2.17 0.32 0.04 1.22 2.03 0.60 -5.00 116.55 113.59 1qij n ASP 380 Ca 0.04 -2.40 0.21 0.00 0.52 0.00 0.00 54.79 53.15 1qij n ASP 380 Cb 0.44 -0.00 0.73 0.00 -0.72 0.00 0.00 41.12 41.57 1qij n ASP 380 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1qij h ASP 381 N 2.39 0.00 -0.55 1.67 2.03 -1.60 -2.32 116.42 118.05 1qij h ASP 381 Ca -0.20 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.10 1qij h ASP 381 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 1qij h ASP 381 CO 0.19 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.99 1qij n ASN 382 N -4.03 5.54 -4.59 4.15 3.02 -1.26 -4.80 115.26 113.29 1qij n ASN 382 Ca 0.09 -2.93 -0.43 0.00 -0.03 0.00 0.00 54.58 51.28 1qij n ASN 382 Cb 0.63 -0.67 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 1qij n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1qij s ASN 383 N -0.91 6.50 0.42 6.41 3.04 -0.87 -4.90 114.94 124.63 1qij s ASN 383 Ca 0.53 0.45 0.12 0.00 0.04 0.00 0.00 52.86 54.01 1qij s ASN 383 Cb 0.41 -2.55 0.96 0.00 -1.54 0.00 0.00 41.25 38.53 1qij s ASN 383 CO 0.16 -1.37 1.97 1.23 -3.04 0.00 0.00 177.10 176.05 1qij h GLY 384 N 11.69 0.68 2.00 1.21 0.00 -1.91 -1.33 103.07 115.42 1qij h GLY 384 Ca -0.25 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 46.75 1qij h GLY 384 CO 1.14 0.12 -0.64 -2.22 0.00 0.00 0.00 176.54 174.94 1qij h ILE 385 N 0.49 1.28 0.08 2.60 2.04 -1.90 -2.31 117.51 119.79 1qij h ILE 385 Ca 0.29 -2.34 -0.27 0.00 1.00 0.00 0.00 64.86 63.55 1qij h ILE 385 Cb 0.49 2.33 0.01 0.00 -0.74 0.00 0.00 36.82 38.91 1qij h ILE 385 CO -0.09 0.63 -1.13 0.11 0.00 0.00 0.00 178.15 177.67 1qij h LYS 386 N 0.00 0.46 -0.09 2.37 1.57 -1.66 -2.38 116.57 116.84 1qij h LYS 386 Ca -0.01 -0.59 -0.10 0.00 -1.87 0.00 0.00 60.65 58.08 1qij h LYS 386 Cb 1.28 0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.77 1qij h LYS 386 CO 0.08 1.24 -0.41 -0.91 -0.57 0.00 0.00 179.45 178.88 1qij h ASN 387 N 0.21 0.21 0.23 0.86 2.35 -1.30 0.32 115.58 118.46 1qij h ASN 387 Ca -0.13 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 1qij h ASN 387 Cb 1.80 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 40.11 1qij h ASN 387 CO 0.20 0.60 -0.11 -0.09 -1.65 0.00 0.00 177.43 176.38 1qij h ARG 388 N 0.17 -0.30 0.00 0.81 2.43 -1.44 -1.94 114.38 114.11 1qij h ARG 388 Ca 0.02 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1qij h ARG 388 Cb 0.80 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1qij h ARG 388 CO 0.06 0.06 -0.09 -0.44 -1.51 0.00 0.00 179.97 178.05 1qij h ASP 389 N -0.76 0.00 -0.11 -3.80 3.32 -1.41 -0.81 116.42 112.85 1qij h ASP 389 Ca -0.03 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.79 1qij h ASP 389 Cb 0.50 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.06 1qij h ASP 389 CO 0.05 0.09 -0.83 1.23 -1.72 0.00 0.00 179.24 178.07 1qij h GLY 390 N 1.32 0.85 1.03 2.75 0.00 -0.87 -1.79 103.07 106.36 1qij h GLY 390 Ca -0.00 -1.25 -0.10 0.00 0.00 0.00 0.00 47.33 45.97 1qij h GLY 390 CO 0.01 1.11 -0.12 -2.00 0.00 0.00 0.00 176.54 175.54 1qij h LEU 391 N 0.51 0.90 -0.86 3.11 5.85 -0.90 -1.72 115.31 122.20 1qij h LEU 391 Ca -0.07 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.32 1qij h LEU 391 Cb 1.46 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 1qij h LEU 391 CO 0.17 1.06 0.55 -0.78 -0.34 0.00 0.00 178.44 179.10 1qij h ASP 392 N 0.72 0.91 -0.50 1.25 1.82 -1.11 -2.29 116.42 117.22 1qij h ASP 392 Ca 0.11 -0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 56.65 1qij h ASP 392 Cb 0.67 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.46 1qij h ASP 392 CO 0.05 0.62 -0.07 0.44 -1.61 0.00 0.00 179.24 178.66 1qij h ASP 393 N 1.06 0.93 0.02 2.28 3.32 -0.98 -2.80 116.42 120.26 1qij h ASP 393 Ca 0.35 -0.34 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1qij h ASP 393 Cb 0.03 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1qij h ASP 393 CO -0.12 1.05 -0.13 0.40 -1.72 0.00 0.00 179.24 178.72 1qij h ILE 394 N 0.79 0.68 -0.66 0.35 2.04 -0.79 0.33 117.51 120.26 1qij h ILE 394 Ca 0.13 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.02 1qij h ILE 394 Cb 0.62 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 1qij h ILE 394 CO 0.04 0.00 0.41 0.58 0.00 0.00 0.00 178.15 179.18 1qij h VAL 395 N -0.23 1.08 -0.15 1.67 2.07 -1.43 -1.62 116.25 117.65 1qij h VAL 395 Ca 0.04 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.22 1qij h VAL 395 Cb 0.28 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1qij h VAL 395 CO -0.11 0.15 -0.14 1.23 0.02 0.00 0.00 177.57 178.72 1qij h GLY 396 N 0.80 0.39 0.98 2.17 0.00 -1.27 -2.44 103.07 103.70 1qij h GLY 396 Ca 0.27 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1qij h GLY 396 CO -0.11 0.35 -0.14 -0.55 0.00 0.00 0.00 176.54 176.10 1qij h ASP 397 N -0.01 -0.32 0.32 0.19 3.32 -0.83 0.23 116.42 119.31 1qij h ASP 397 Ca 0.02 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 1qij h ASP 397 Cb 0.66 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1qij h ASP 397 CO 0.03 -0.21 -0.36 -0.74 -1.72 0.00 0.00 179.24 176.25 1qij h HIS 398 N -0.40 0.08 0.00 4.55 -0.00 -1.40 0.15 115.15 118.12 1qij h HIS 398 Ca -0.04 -0.02 -0.23 0.00 -0.00 0.00 0.00 60.37 60.08 1qij h HIS 398 Cb 0.31 -0.02 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 1qij h HIS 398 CO -0.05 0.42 -2.21 0.09 -0.00 0.00 0.00 177.93 176.18 1qij n ASN 399 N -4.09 0.04 0.09 3.26 3.02 -0.92 -4.66 115.26 112.00 1qij n ASN 399 Ca -0.02 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1qij n ASN 399 Cb 0.41 1.32 0.00 0.00 -0.61 0.00 0.00 39.78 40.90 1qij n ASN 399 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1qij n VAL 400 N -2.58 0.68 0.29 2.41 0.31 0.68 -4.70 118.33 115.42 1qij n VAL 400 Ca -0.22 0.22 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 1qij n VAL 400 Cb 0.94 -1.10 -0.08 0.00 -0.91 0.00 0.00 33.84 32.69 1qij n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1qij h ILE 401 N 0.00 0.34 -0.11 2.52 2.04 -1.28 -1.76 117.51 119.27 1qij h ILE 401 Ca 0.00 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 1qij h ILE 401 Cb 0.00 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1qij h ILE 401 CO 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 178.15 178.12 1qij h PRO 403 N 0.16 0.66 -0.21 0.00 0.11 -1.69 -2.84 132.00 128.19 1qij h PRO 403 Ca 0.04 -0.53 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 1qij h PRO 403 Cb 0.22 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 1qij h PRO 403 CO 0.01 1.15 -0.33 1.25 -0.21 0.00 0.00 178.00 179.87 1qij h LEU 404 N 0.46 0.45 -1.21 2.35 6.46 -0.96 -2.40 115.31 120.45 1qij h LEU 404 Ca -0.04 -0.17 -0.07 0.00 -0.12 0.00 0.00 57.88 57.48 1qij h LEU 404 Cb 1.35 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 1qij h LEU 404 CO 0.15 0.75 -0.32 0.24 -0.62 0.00 0.00 178.44 178.64 1qij h MET 405 N 0.37 0.00 -0.19 1.25 2.86 -1.29 -0.29 114.93 117.66 1qij h MET 405 Ca 0.05 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.49 1qij h MET 405 Cb 0.76 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.42 1qij h MET 405 CO 0.06 0.32 -0.66 1.25 1.06 0.00 0.00 176.91 178.94 1qij h HIS 406 N 0.00 0.92 0.17 -0.22 -0.00 -1.22 -2.23 115.15 112.56 1qij h HIS 406 Ca -0.00 -0.37 -0.01 0.00 -0.00 0.00 0.00 60.37 59.99 1qij h HIS 406 Cb 0.73 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.98 1qij h HIS 406 CO 0.00 1.16 -0.08 0.35 -0.00 0.00 0.00 177.93 179.36 1qij h PHE 407 N 0.51 -0.21 -0.50 5.26 3.57 -1.02 -1.67 116.94 122.88 1qij h PHE 407 Ca -0.02 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1qij h PHE 407 Cb 1.25 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 40.04 1qij h PHE 407 CO 0.07 0.16 0.33 -0.24 -2.23 0.00 0.00 178.31 176.40 1qij h VAL 408 N -0.62 0.97 0.02 1.41 3.04 -1.11 0.19 116.25 120.15 1qij h VAL 408 Ca -0.02 -0.15 -0.19 0.00 -1.01 0.00 0.00 66.70 65.33 1qij h VAL 408 Cb 0.46 0.50 0.02 0.00 -2.01 0.00 0.00 31.29 30.26 1qij h VAL 408 CO 0.04 0.08 -0.76 0.78 -1.01 0.00 0.00 177.57 176.69 1qij h ASN 409 N 0.43 0.64 -0.22 3.17 2.35 -1.35 -2.01 115.58 118.60 1qij h ASN 409 Ca 0.22 -0.77 -0.09 0.00 -0.55 0.00 0.00 56.30 55.10 1qij h ASN 409 Cb 0.31 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1qij h ASN 409 CO -0.06 1.33 -0.16 0.11 -1.65 0.00 0.00 177.43 177.01 1qij h LYS 410 N 0.02 0.64 0.27 0.81 1.79 -0.72 -3.26 116.57 116.12 1qij h LYS 410 Ca -0.10 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 1qij h LYS 410 Cb 1.47 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 32.07 1qij h LYS 410 CO 0.15 0.77 -0.13 -0.92 -1.08 0.00 0.00 179.45 178.23 1qij h TYR 411 N 0.57 -0.34 -1.01 -1.35 3.20 -0.70 -3.21 116.97 114.14 1qij h TYR 411 Ca 0.10 -0.01 0.29 0.00 3.14 0.00 0.00 58.73 62.25 1qij h TYR 411 Cb 0.60 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.94 1qij h TYR 411 CO 0.03 0.02 0.87 1.15 -1.64 0.00 0.00 178.16 178.58 1qij h THR 412 N -0.82 0.28 0.00 1.81 2.02 -1.42 0.32 112.91 115.10 1qij h THR 412 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1qij h THR 412 Cb 0.51 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1qij h THR 412 CO 0.06 0.00 0.00 0.50 0.37 0.00 0.00 175.52 176.45 1qij h LYS 413 N 0.00 0.00 0.00 6.66 3.64 -1.59 -3.23 116.57 122.05 1qij h LYS 413 Ca 0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1qij h LYS 413 Cb 2.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.03 1qij h LYS 413 CO -0.01 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.36 1qij n PHE 414 N -2.83 0.00 -1.76 1.91 3.01 0.91 -5.10 117.46 113.61 1qij n PHE 414 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1qij n PHE 414 Cb 0.21 0.00 0.17 0.00 -0.01 0.00 0.00 39.48 39.86 1qij n PHE 414 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1qij s GLY 415 N -0.32 1.70 -0.29 1.37 0.00 -0.02 -4.82 107.32 104.95 1qij s GLY 415 Ca 0.00 -1.01 0.08 0.00 0.00 0.00 0.00 44.72 43.80 1qij s GLY 415 CO 0.00 -0.28 1.35 -2.01 0.00 0.00 0.00 173.10 172.15 1qij n ASN 416 N -3.85 3.10 0.00 1.64 2.85 -0.23 -4.93 115.26 113.84 1qij n ASN 416 Ca 0.13 -3.83 0.00 0.00 -0.11 0.00 0.00 54.58 50.77 1qij n ASN 416 Cb 0.60 -0.55 0.00 0.00 1.24 0.00 0.00 39.78 41.07 1qij n ASN 416 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1qij n GLY 417 N -1.01 3.93 3.01 8.20 0.00 -1.25 -4.64 105.19 113.44 1qij n GLY 417 Ca 0.33 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 1qij n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qij s THR 418 N 0.00 0.76 -0.14 2.61 2.01 -1.26 -1.72 115.64 117.90 1qij s THR 418 Ca 0.00 -0.37 -0.01 0.00 0.31 0.00 0.00 61.69 61.62 1qij s THR 418 Cb 0.00 -0.66 0.04 0.00 0.01 0.00 0.00 72.50 71.88 1qij s THR 418 CO 0.00 0.23 -0.05 -0.31 -0.69 0.00 0.00 174.62 173.80 1qij s TYR 419 N 0.03 1.48 -0.06 4.92 2.02 -0.65 -0.38 117.35 124.71 1qij s TYR 419 Ca -0.00 -0.87 0.02 0.00 -0.37 0.00 0.00 57.07 55.84 1qij s TYR 419 Cb -0.07 -1.22 -0.03 0.00 -0.40 0.00 0.00 41.96 40.25 1qij s TYR 419 CO 0.00 -0.56 -0.09 -1.17 -1.57 0.00 0.00 175.55 172.16 1qij s LEU 420 N 1.71 3.03 0.28 -1.29 2.96 -1.26 -0.87 118.68 123.25 1qij s LEU 420 Ca 0.02 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 53.88 1qij s LEU 420 Cb -0.14 -1.65 -0.06 0.00 0.50 0.00 0.00 46.19 44.84 1qij s LEU 420 CO -0.08 0.35 0.05 -0.72 -1.32 0.00 0.00 176.35 174.63 1qij s TYR 421 N -0.80 1.76 -0.27 5.38 -0.85 -0.54 -2.54 117.35 119.49 1qij s TYR 421 Ca 0.12 -0.99 -0.03 0.00 -0.52 0.00 0.00 57.07 55.65 1qij s TYR 421 Cb -0.11 -1.09 0.10 0.00 0.38 0.00 0.00 41.96 41.25 1qij s TYR 421 CO 0.01 -0.08 0.16 0.12 -1.52 0.00 0.00 175.55 174.25 1qij s PHE 422 N -3.43 0.11 -0.39 -3.49 5.36 -0.51 -3.10 117.98 112.54 1qij s PHE 422 Ca 0.34 -0.61 -0.29 0.00 -0.96 0.00 0.00 56.93 55.42 1qij s PHE 422 Cb 0.08 -0.76 0.02 0.00 -0.34 0.00 0.00 43.02 42.02 1qij s PHE 422 CO 0.13 -0.80 1.08 0.12 -1.46 0.00 0.00 175.22 174.29 1qij s PHE 423 N 2.17 3.01 -0.33 10.12 5.36 -0.31 -1.21 117.98 136.79 1qij s PHE 423 Ca 0.08 0.95 0.15 0.00 -0.96 0.00 0.00 56.93 57.15 1qij s PHE 423 Cb -0.16 -3.98 0.46 0.00 -0.34 0.00 0.00 43.02 39.01 1qij s PHE 423 CO -0.32 -0.97 1.06 0.27 -1.46 0.00 0.00 175.22 173.80 1qij n ASN 424 N 7.24 2.68 -4.19 6.13 6.94 -1.18 -1.17 115.26 131.70 1qij n ASN 424 Ca 0.11 -2.91 -0.33 0.00 -0.02 0.00 0.00 54.58 51.44 1qij n ASN 424 Cb 0.48 -0.48 -0.16 0.00 -2.36 0.00 0.00 39.78 37.26 1qij n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1qij s HIS 425 N -3.45 2.67 -0.27 -2.53 2.46 -1.26 -4.92 115.29 107.99 1qij s HIS 425 Ca 0.35 -1.27 -0.18 0.00 0.47 0.00 0.00 55.06 54.43 1qij s HIS 425 Cb 0.41 -1.81 -0.02 0.00 -0.13 0.00 0.00 32.58 31.02 1qij s HIS 425 CO -0.03 -0.57 0.52 0.50 -2.47 0.00 0.00 174.74 172.69 1qij s ARG 426 N 0.76 4.01 0.42 2.88 3.52 -1.26 -4.87 118.95 124.41 1qij s ARG 426 Ca -0.08 0.26 -0.25 0.00 -0.13 0.00 0.00 55.73 55.53 1qij s ARG 426 Cb -0.16 -3.67 -0.10 0.00 -1.56 0.00 0.00 34.95 29.46 1qij s ARG 426 CO -0.00 -0.40 1.09 0.00 -0.81 0.00 0.00 175.30 175.18 1qij n ALA 427 N 5.58 0.50 0.27 6.12 0.00 -1.26 -4.88 120.51 126.83 1qij n ALA 427 Ca -0.04 0.24 0.16 0.00 0.00 0.00 0.00 53.44 53.80 1qij n ALA 427 Cb 0.50 -2.14 0.60 0.00 0.00 0.00 0.00 19.45 18.41 1qij n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1qij h SER 428 N 1.68 0.00 -0.68 0.00 4.64 -1.96 -3.10 113.55 114.14 1qij h SER 428 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1qij h SER 428 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1qij h SER 428 CO 0.58 0.03 0.00 -0.46 -0.87 0.00 0.00 176.83 176.10 1qij n ASN 429 N -3.13 4.47 -4.76 4.97 0.23 -1.26 -4.99 115.26 110.79 1qij n ASN 429 Ca 0.01 -2.29 -0.41 0.00 -0.53 0.00 0.00 54.58 51.36 1qij n ASN 429 Cb 0.35 -0.55 -0.01 0.00 -2.08 0.00 0.00 39.78 37.49 1qij n ASN 429 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1qij s LEU 430 N -1.54 4.35 0.06 -4.53 1.43 -1.17 -4.92 118.68 112.36 1qij s LEU 430 Ca 0.50 2.91 0.24 0.00 -1.03 0.00 0.00 54.13 56.75 1qij s LEU 430 Cb 0.30 -3.64 0.29 0.00 0.03 0.00 0.00 46.19 43.18 1qij s LEU 430 CO 0.28 -0.85 1.25 1.33 0.23 0.00 0.00 176.35 178.59 1qij n VAL 431 N 1.76 0.19 -1.87 -1.59 0.24 -1.26 -4.94 118.33 110.86 1qij n VAL 431 Ca 0.06 -0.18 -0.31 0.00 -2.04 0.00 0.00 64.34 61.86 1qij n VAL 431 Cb 0.38 0.10 0.02 0.00 -1.47 0.00 0.00 33.84 32.87 1qij n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1qij s TRP 432 N -3.12 3.30 1.02 6.34 0.52 -1.26 -5.02 118.94 120.71 1qij s TRP 432 Ca 0.07 1.40 -0.11 0.00 0.02 0.00 0.00 56.10 57.48 1qij s TRP 432 Cb 0.15 -2.84 0.20 0.00 -1.15 0.00 0.00 33.47 29.83 1qij s TRP 432 CO 0.74 -0.91 1.09 -0.35 0.02 0.00 0.00 176.95 177.55 1qij n PRO 433 N -2.58 -1.22 -0.16 4.98 -0.04 -1.26 -4.93 135.00 129.78 1qij n PRO 433 Ca 0.07 -0.30 -0.10 0.00 -0.04 0.00 0.00 63.50 63.12 1qij n PRO 433 Cb 0.54 -2.30 -0.00 0.00 -0.04 0.00 0.00 33.50 31.70 1qij n PRO 433 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1qij h GLU 434 N -2.20 0.90 0.00 0.54 4.39 -1.95 -3.04 114.58 113.23 1qij h GLU 434 Ca -0.50 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 58.87 1qij h GLU 434 Cb 1.29 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 1qij h GLU 434 CO 0.44 0.98 0.24 0.11 -1.16 0.00 0.00 179.01 179.62 1qij h TRP 435 N 0.75 0.00 0.00 4.33 5.08 -1.91 0.24 115.95 124.44 1qij h TRP 435 Ca 0.13 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.91 1qij h TRP 435 Cb 0.62 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.75 1qij h TRP 435 CO 0.05 0.00 -0.89 0.52 -1.28 0.00 0.00 178.44 176.84 1qij h MET 436 N 0.00 0.00 0.00 0.12 2.86 -1.90 -3.49 114.93 112.52 1qij h MET 436 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1qij h MET 436 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1qij h MET 436 CO 0.00 0.89 0.00 0.41 1.06 0.00 0.00 176.91 179.27 1qij n GLY 437 N 1.23 1.71 3.53 8.32 0.00 0.83 -4.30 105.19 116.51 1qij n GLY 437 Ca 0.00 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1qij n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qij s VAL 438 N 0.00 4.27 0.55 1.61 1.01 -1.26 -4.87 120.40 121.72 1qij s VAL 438 Ca 0.00 -1.35 -0.21 0.00 0.00 0.00 0.00 61.98 60.42 1qij s VAL 438 Cb 0.00 -5.00 -0.05 0.00 0.00 0.00 0.00 36.38 31.34 1qij s VAL 438 CO 0.00 -1.81 1.26 -0.63 0.00 0.00 0.00 175.10 173.92 1qij s ILE 439 N 3.92 2.47 0.09 2.22 1.01 -1.26 -2.03 121.20 127.62 1qij s ILE 439 Ca 0.44 0.33 -0.36 0.00 0.00 0.00 0.00 60.65 61.05 1qij s ILE 439 Cb -0.01 -3.15 -0.15 0.00 0.01 0.00 0.00 42.46 39.16 1qij s ILE 439 CO -0.06 -0.03 1.49 1.57 0.00 0.00 0.00 174.94 177.91 1qij n HIS 440 N -1.20 1.90 -0.68 3.97 -0.00 -1.25 -2.00 115.22 115.96 1qij n HIS 440 Ca 0.11 0.45 0.00 0.00 -0.00 0.00 0.00 57.72 58.28 1qij n HIS 440 Cb 0.47 -2.44 0.00 0.00 -0.00 0.00 0.00 29.99 28.02 1qij n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1qij n GLY 441 N 3.09 1.47 0.62 1.57 0.00 -1.26 -4.89 105.19 105.79 1qij n GLY 441 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.26 1qij n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1qij n TYR 442 N -2.00 0.44 0.24 1.61 4.02 -0.85 -3.09 117.16 117.54 1qij n TYR 442 Ca 0.00 -0.22 0.12 0.00 -0.01 0.00 0.00 57.90 57.78 1qij n TYR 442 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.34 1qij n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1qij n GLU 443 N 0.48 0.51 -0.16 -0.72 0.00 -1.26 -4.12 120.64 115.37 1qij n GLU 443 Ca 0.11 0.08 -0.03 0.00 0.00 0.00 0.00 57.16 57.33 1qij n GLU 443 Cb 0.29 -1.76 0.07 0.00 0.00 0.00 0.00 31.44 30.04 1qij n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1qij h ILE 444 N 0.00 0.82 -0.44 3.84 2.04 -1.95 -1.87 117.51 119.94 1qij h ILE 444 Ca 0.00 -0.12 0.13 0.00 1.00 0.00 0.00 64.86 65.87 1qij h ILE 444 Cb 0.92 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1qij h ILE 444 CO 0.00 0.06 0.35 1.05 0.00 0.00 0.00 178.15 179.62 1qij h GLU 445 N 0.35 0.00 0.06 2.37 4.11 -1.80 0.11 114.58 119.78 1qij h GLU 445 Ca 0.25 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.44 1qij h GLU 445 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1qij h GLU 445 CO -0.26 0.00 -1.09 0.74 0.07 0.00 0.00 179.01 178.47 1qij h PHE 446 N 0.00 0.30 -0.44 2.06 -1.00 -1.60 -0.70 116.94 115.56 1qij h PHE 446 Ca 0.21 -0.21 -0.11 0.00 2.81 0.00 0.00 57.97 60.68 1qij h PHE 446 Cb 0.91 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.44 1qij h PHE 446 CO 0.00 1.13 -0.16 0.28 -1.61 0.00 0.00 178.31 177.95 1qij h VAL 447 N 0.06 1.27 -0.10 -0.55 2.07 -0.61 -2.72 116.25 115.67 1qij h VAL 447 Ca -0.08 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1qij h VAL 447 Cb 1.81 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1qij h VAL 447 CO 0.17 0.43 0.00 0.49 0.02 0.00 0.00 177.57 178.68 1qij n PHE 448 N -4.14 0.12 -2.26 1.57 3.01 -0.59 -4.74 117.46 110.43 1qij n PHE 448 Ca 0.01 -0.06 -0.12 0.00 1.01 0.00 0.00 57.45 58.29 1qij n PHE 448 Cb 0.40 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.87 1qij n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qij n GLY 449 N 1.19 -0.11 0.29 1.37 0.00 -0.90 -3.98 105.19 103.06 1qij n GLY 449 Ca 0.17 -0.38 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1qij n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1qij h LEU 450 N -0.06 0.00 -2.23 0.99 -0.00 -1.43 -2.33 115.31 110.25 1qij h LEU 450 Ca -0.28 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.59 1qij h LEU 450 Cb 1.21 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.86 1qij h LEU 450 CO 0.33 0.03 -0.05 -0.65 -0.00 0.00 0.00 178.44 178.10 1qij h PRO 451 N 0.00 0.00 0.00 1.13 0.11 -1.91 -2.52 132.00 128.81 1qij h PRO 451 Ca -0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1qij h PRO 451 Cb 0.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 1qij h PRO 451 CO 0.00 0.05 -0.09 -0.07 -0.21 0.00 0.00 178.00 177.68 1qij h LEU 452 N 0.00 0.00 -8.28 2.35 3.38 -1.75 -3.40 115.31 107.62 1qij h LEU 452 Ca -0.00 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.31 1qij h LEU 452 Cb 0.23 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.81 1qij h LEU 452 CO 0.01 0.09 0.34 0.54 0.09 0.00 0.00 178.44 179.51 1qij s VAL 453 N -3.70 4.57 0.10 1.22 0.11 -0.95 -4.95 120.40 116.79 1qij s VAL 453 Ca 0.01 -0.49 -0.19 0.00 -2.93 0.00 0.00 61.98 58.37 1qij s VAL 453 Cb 0.10 -4.55 -0.04 0.00 -1.53 0.00 0.00 36.38 30.36 1qij s VAL 453 CO 0.58 -1.21 1.00 0.29 -3.33 0.00 0.00 175.10 172.43 1qij n LYS 454 N 7.02 -0.27 0.32 1.54 4.76 -1.26 -0.85 118.16 129.42 1qij n LYS 454 Ca -0.05 0.99 0.05 0.00 -2.87 0.00 0.00 58.31 56.43 1qij n LYS 454 Cb 0.45 -1.45 0.29 0.00 -1.84 0.00 0.00 35.03 32.48 1qij n LYS 454 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 1qij h GLU 455 N 0.00 0.00 -0.00 1.97 9.09 -1.96 0.57 114.58 124.26 1qij h GLU 455 Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.51 1qij h GLU 455 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.35 1qij h GLU 455 CO -0.57 0.00 -0.05 1.28 0.05 0.00 0.00 179.01 179.72 1qij n LEU 456 N -2.60 0.10 -2.53 3.06 4.77 -0.03 -4.97 117.00 114.81 1qij n LEU 456 Ca -0.01 0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 56.19 1qij n LEU 456 Cb 0.76 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1qij n LEU 456 CO 0.05 0.02 0.03 0.59 -1.33 0.00 0.00 177.39 176.75 1qij n ASN 457 N -1.33 -3.89 -4.76 -1.43 3.02 0.20 -4.99 115.26 102.08 1qij n ASN 457 Ca 0.11 -0.41 -0.24 0.00 -0.03 0.00 0.00 54.58 54.01 1qij n ASN 457 Cb 0.29 -3.33 -0.06 0.00 -0.61 0.00 0.00 39.78 36.07 1qij n ASN 457 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1qij s TYR 458 N -3.23 2.99 0.70 3.10 2.02 -1.26 -4.59 117.35 117.09 1qij s TYR 458 Ca 0.19 -0.11 -0.11 0.00 -0.37 0.00 0.00 57.07 56.66 1qij s TYR 458 Cb -0.02 -1.38 0.01 0.00 -0.40 0.00 0.00 41.96 40.16 1qij s TYR 458 CO 0.44 0.54 1.07 0.95 -1.57 0.00 0.00 175.55 176.98 1qij s THR 459 N -2.01 3.84 0.34 -0.71 -4.23 -1.26 -4.88 115.64 106.73 1qij s THR 459 Ca 0.31 0.60 0.02 0.00 -1.18 0.00 0.00 61.69 61.44 1qij s THR 459 Cb -0.08 -3.47 0.27 0.00 1.34 0.00 0.00 72.50 70.55 1qij s THR 459 CO 0.22 -0.78 1.99 0.00 -0.54 0.00 0.00 174.62 175.51 1qij h ALA 460 N -0.68 1.53 0.00 3.99 0.00 -1.99 -1.10 119.26 121.01 1qij h ALA 460 Ca -0.45 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.31 1qij h ALA 460 Cb 1.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1qij h ALA 460 CO 0.61 0.42 -0.53 1.05 0.00 0.00 0.00 179.25 180.79 1qij h GLU 461 N 0.92 0.00 -0.19 0.00 9.09 -1.99 -2.39 114.58 120.02 1qij h GLU 461 Ca 0.27 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.54 1qij h GLU 461 Cb -0.05 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.04 1qij h GLU 461 CO -0.06 0.53 -0.47 0.93 0.05 0.00 0.00 179.01 179.99 1qij h GLU 462 N 0.00 0.49 -0.08 1.06 5.08 -1.60 -0.67 114.58 118.86 1qij h GLU 462 Ca -0.01 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 57.96 1qij h GLU 462 Cb 1.11 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1qij h GLU 462 CO 0.07 0.86 -0.48 1.49 -1.00 0.00 0.00 179.01 179.95 1qij h GLU 463 N 0.39 0.19 -0.39 2.33 4.81 -1.15 -1.26 114.58 119.51 1qij h GLU 463 Ca 0.02 -0.11 -0.12 0.00 -0.13 0.00 0.00 59.36 59.02 1qij h GLU 463 Cb 0.98 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 1qij h GLU 463 CO 0.09 0.64 -0.26 0.00 -0.73 0.00 0.00 179.01 178.75 1qij h ALA 464 N 1.35 0.81 -0.31 2.92 0.00 -1.05 -2.21 119.26 120.76 1qij h ALA 464 Ca 0.01 -0.39 -0.14 0.00 0.00 0.00 0.00 54.91 54.39 1qij h ALA 464 Cb 0.91 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1qij h ALA 464 CO 0.07 0.65 -0.37 1.25 0.00 0.00 0.00 179.25 180.85 1qij h LEU 465 N 0.70 0.77 -0.69 0.00 5.85 -0.82 -2.48 115.31 118.63 1qij h LEU 465 Ca 0.09 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 1qij h LEU 465 Cb 0.79 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1qij h LEU 465 CO 0.07 1.06 0.26 -1.28 -0.34 0.00 0.00 178.44 178.20 1qij h SER 466 N 0.60 0.97 -0.21 1.25 0.87 -1.01 -1.77 113.55 114.26 1qij h SER 466 Ca 0.06 -0.18 -0.13 0.00 -1.23 0.00 0.00 61.79 60.30 1qij h SER 466 Cb 0.91 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.60 1qij h SER 466 CO 0.08 0.89 -0.31 0.03 -0.53 0.00 0.00 176.83 176.99 1qij h ARG 467 N 0.99 0.71 0.14 2.24 3.08 -1.30 -1.04 114.38 119.19 1qij h ARG 467 Ca 0.23 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1qij h ARG 467 Cb 0.24 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1qij h ARG 467 CO -0.02 0.93 -0.07 0.00 -1.07 0.00 0.00 179.97 179.75 1qij h ARG 468 N 0.61 -0.19 -0.66 0.04 3.08 -1.14 -1.05 114.38 115.07 1qij h ARG 468 Ca 0.07 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1qij h ARG 468 Cb 0.83 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 1qij h ARG 468 CO 0.07 -0.13 0.33 0.82 -1.07 0.00 0.00 179.97 180.00 1qij h ILE 469 N -0.20 1.22 -0.05 2.04 2.04 -1.27 -0.67 117.51 120.62 1qij h ILE 469 Ca -0.02 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 1qij h ILE 469 Cb 0.16 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1qij h ILE 469 CO 0.02 0.25 -0.10 0.24 0.00 0.00 0.00 178.15 178.56 1qij h MET 470 N 0.91 0.07 0.01 2.37 2.86 -0.98 0.14 114.93 120.31 1qij h MET 470 Ca 0.23 -0.01 -0.22 0.00 -2.06 0.00 0.00 59.70 57.64 1qij h MET 470 Cb 0.09 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1qij h MET 470 CO -0.03 0.18 -1.07 1.25 1.06 0.00 0.00 176.91 178.30 1qij h HIS 471 N 0.07 0.04 0.30 -0.22 -0.00 -0.66 -2.11 115.15 112.58 1qij h HIS 471 Ca 0.02 -0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.34 1qij h HIS 471 Cb 0.22 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 1qij h HIS 471 CO 0.00 1.02 -0.15 1.88 -0.00 0.00 0.00 177.93 180.69 1qij h TYR 472 N 0.01 -0.38 -0.47 5.26 0.05 -0.22 0.16 116.97 121.38 1qij h TYR 472 Ca -0.04 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.79 1qij h TYR 472 Cb 1.80 0.13 -0.05 0.00 1.01 0.00 0.00 36.73 39.62 1qij h TYR 472 CO 0.01 -0.03 0.19 -1.49 -1.05 0.00 0.00 178.16 175.79 1qij h TRP 473 N -0.88 0.35 -0.29 4.88 -0.00 -1.11 0.80 115.95 119.70 1qij h TRP 473 Ca -0.04 0.02 -0.09 0.00 -0.00 0.00 0.00 58.89 58.78 1qij h TRP 473 Cb 0.52 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 29.59 1qij h TRP 473 CO 0.04 0.14 -0.16 0.00 -0.00 0.00 0.00 178.44 178.46 1qij h ALA 474 N 1.29 0.41 -0.20 1.49 0.00 -1.42 0.38 119.26 121.21 1qij h ALA 474 Ca 0.22 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1qij h ALA 474 Cb 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1qij h ALA 474 CO -0.20 0.32 -0.17 1.15 0.00 0.00 0.00 179.25 180.35 1qij h THR 475 N 0.36 1.22 -0.11 0.00 2.02 -0.47 -2.05 112.91 113.88 1qij h THR 475 Ca 0.06 -1.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.08 1qij h THR 475 Cb 0.69 1.27 0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1qij h THR 475 CO 0.05 0.31 -0.56 0.15 0.37 0.00 0.00 175.52 175.84 1qij h PHE 476 N 0.31 0.79 -0.62 3.16 3.57 -0.70 -0.88 116.94 122.57 1qij h PHE 476 Ca 0.06 -0.35 0.05 0.00 3.53 0.00 0.00 57.97 61.26 1qij h PHE 476 Cb 0.49 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 1qij h PHE 476 CO 0.01 1.14 0.41 0.00 -2.23 0.00 0.00 178.31 177.64 1qij h ALA 477 N 0.49 1.74 0.15 2.41 0.00 -0.59 0.18 119.26 123.64 1qij h ALA 477 Ca -0.04 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1qij h ALA 477 Cb 1.21 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 18.84 1qij h ALA 477 CO 0.12 0.17 -1.02 0.87 0.00 0.00 0.00 179.25 179.39 1qij h LYS 478 N 0.66 0.32 0.00 0.00 1.57 -1.34 -3.42 116.57 114.36 1qij h LYS 478 Ca 0.26 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1qij h LYS 478 Cb 0.19 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1qij h LYS 478 CO -0.08 1.26 -0.88 0.25 -0.57 0.00 0.00 179.45 179.43 1qij n THR 479 N -4.03 0.00 -0.61 -0.16 -2.24 -0.34 -5.00 114.28 101.90 1qij n THR 479 Ca -0.16 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1qij n THR 479 Cb 0.88 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 1qij n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qij n GLY 480 N 1.56 0.70 3.10 3.38 0.00 0.63 -5.02 105.19 109.54 1qij n GLY 480 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1qij n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qij s ASN 481 N -2.04 -0.10 0.04 1.61 3.84 -1.26 -4.94 114.94 112.10 1qij s ASN 481 Ca 0.00 0.67 0.16 0.00 0.21 0.00 0.00 52.86 53.90 1qij s ASN 481 Cb 0.00 0.68 0.68 0.00 -0.55 0.00 0.00 41.25 42.07 1qij s ASN 481 CO 0.00 -0.20 1.51 -0.81 -2.79 0.00 0.00 177.10 174.81 1qij n PRO 482 N 4.75 0.03 -3.55 0.43 -0.04 -1.26 -3.27 135.00 132.08 1qij n PRO 482 Ca -0.17 0.28 -0.35 0.00 -0.04 0.00 0.00 63.50 63.22 1qij n PRO 482 Cb 0.52 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 1qij n PRO 482 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1qij s ASN 483 N -3.20 6.66 0.04 3.54 0.01 -1.26 -4.45 114.94 116.27 1qij s ASN 483 Ca 0.07 0.82 -0.30 0.00 -0.71 0.00 0.00 52.86 52.73 1qij s ASN 483 Cb 0.10 -2.19 -0.06 0.00 0.41 0.00 0.00 41.25 39.51 1qij s ASN 483 CO 0.29 0.16 1.29 -1.61 -1.51 0.00 0.00 177.10 175.73 1qij s GLU 484 N -1.92 4.36 0.00 -0.60 0.41 -1.26 -4.96 118.70 114.73 1qij s GLU 484 Ca 0.34 1.87 0.00 0.00 -0.41 0.00 0.00 54.97 56.76 1qij s GLU 484 Cb -0.14 -3.42 0.00 0.00 -1.78 0.00 0.00 34.13 28.79 1qij s GLU 484 CO 0.18 -0.41 0.54 -2.30 -0.49 0.00 0.00 175.26 172.78 1qij n PRO 485 N 4.52 0.00 -2.11 0.39 -0.02 -1.26 -2.28 135.00 134.24 1qij n PRO 485 Ca 0.11 0.54 -0.31 0.00 -2.02 0.00 0.00 63.50 61.82 1qij n PRO 485 Cb 0.45 -0.84 0.02 0.00 -0.02 0.00 0.00 33.50 33.11 1qij n PRO 485 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1qij n HIS 486 N -2.23 3.16 -1.63 6.00 8.25 -1.26 -5.05 115.22 122.46 1qij n HIS 486 Ca 0.00 -2.73 -0.30 0.00 -0.26 0.00 0.00 57.72 54.43 1qij n HIS 486 Cb 0.00 -0.59 0.07 0.00 1.12 0.00 0.00 29.99 30.59 1qij n HIS 486 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1qij s SER 487 N -2.68 4.87 0.00 0.41 0.15 -0.97 -4.98 113.70 110.50 1qij s SER 487 Ca 0.52 1.33 0.16 0.00 0.70 0.00 0.00 55.95 58.65 1qij s SER 487 Cb 0.43 -2.11 -0.07 0.00 -1.71 0.00 0.00 66.02 62.56 1qij s SER 487 CO -0.19 -1.73 0.77 0.00 1.20 0.00 0.00 173.24 173.29 1qij n GLN 488 N -3.28 1.80 -1.19 5.44 1.13 -1.26 -4.99 117.38 115.03 1qij n GLN 488 Ca 0.07 -0.49 -0.30 0.00 -1.94 0.00 0.00 57.00 54.34 1qij n GLN 488 Cb 0.56 -1.25 0.23 0.00 0.11 0.00 0.00 30.24 29.89 1qij n GLN 488 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1qij s GLU 489 N -2.11 -0.93 0.30 -1.09 0.41 -1.26 -4.99 118.70 109.04 1qij s GLU 489 Ca 0.10 -0.08 -0.29 0.00 -0.41 0.00 0.00 54.97 54.29 1qij s GLU 489 Cb 0.12 -1.63 -0.10 0.00 -1.78 0.00 0.00 34.13 30.75 1qij s GLU 489 CO 0.49 -3.51 1.15 -1.12 -0.49 0.00 0.00 175.26 171.77 1qij s SER 490 N -3.99 7.10 -0.17 -0.19 0.01 -1.26 -5.01 113.70 110.18 1qij s SER 490 Ca 0.71 2.36 -0.18 0.00 1.31 0.00 0.00 55.95 60.14 1qij s SER 490 Cb -0.09 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.47 1qij s SER 490 CO 0.56 -0.27 0.50 -0.54 0.41 0.00 0.00 173.24 173.89 1qij s LYS 491 N -1.61 4.24 -0.66 12.44 -0.14 -1.26 -5.00 119.74 127.74 1qij s LYS 491 Ca 0.47 0.42 -0.27 0.00 -1.36 0.00 0.00 55.97 55.22 1qij s LYS 491 Cb -0.33 -3.52 0.00 0.00 -1.68 0.00 0.00 37.83 32.30 1qij s LYS 491 CO 0.43 -0.04 1.60 -0.46 -0.76 0.00 0.00 175.35 176.13 1qij s TRP 492 N 1.27 1.94 0.85 3.18 -0.11 -1.26 -4.97 118.94 119.84 1qij s TRP 492 Ca 0.24 0.43 -0.13 0.00 1.22 0.00 0.00 56.10 57.87 1qij s TRP 492 Cb -0.15 -4.32 0.08 0.00 -1.50 0.00 0.00 33.47 27.58 1qij s TRP 492 CO 0.10 -2.21 1.02 -0.35 -4.62 0.00 0.00 176.95 170.89 1qij n PRO 493 N 9.23 -0.02 -2.90 5.86 -0.04 -1.26 -4.93 135.00 140.94 1qij n PRO 493 Ca 0.13 0.07 -0.35 0.00 -0.04 0.00 0.00 63.50 63.31 1qij n PRO 493 Cb 0.51 -2.29 -0.06 0.00 -0.04 0.00 0.00 33.50 31.61 1qij n PRO 493 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1qij s LEU 494 N -4.76 4.18 -0.10 1.53 2.96 -1.26 -4.75 118.68 116.48 1qij s LEU 494 Ca 0.69 1.63 -0.19 0.00 -0.22 0.00 0.00 54.13 56.04 1qij s LEU 494 Cb -0.27 -4.11 -0.04 0.00 0.50 0.00 0.00 46.19 42.27 1qij s LEU 494 CO 0.55 -0.16 0.53 0.12 -1.32 0.00 0.00 176.35 176.07 1qij s PHE 495 N -1.83 3.54 0.09 5.38 2.19 0.48 -4.48 117.98 123.36 1qij s PHE 495 Ca 0.53 0.99 0.06 0.00 0.33 0.00 0.00 56.93 58.83 1qij s PHE 495 Cb -0.14 -2.60 -0.03 0.00 -1.31 0.00 0.00 43.02 38.94 1qij s PHE 495 CO 0.19 0.18 -0.15 0.95 1.83 0.00 0.00 175.22 178.22 1qij s THR 496 N 0.54 1.23 0.33 0.12 -4.23 -1.26 -4.30 115.64 108.08 1qij s THR 496 Ca 0.29 -1.44 0.07 0.00 -1.18 0.00 0.00 61.69 59.42 1qij s THR 496 Cb -0.16 -1.25 0.31 0.00 1.34 0.00 0.00 72.50 72.75 1qij s THR 496 CO 0.12 -0.26 1.84 0.74 -0.54 0.00 0.00 174.62 176.52 1qij h THR 497 N 4.06 0.81 0.11 3.99 2.02 -1.95 0.30 112.91 122.25 1qij h THR 497 Ca -0.41 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 1qij h THR 497 Cb 1.19 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1qij h THR 497 CO 0.43 0.14 -0.05 0.50 0.37 0.00 0.00 175.52 176.90 1qij h LYS 498 N 0.76 -0.14 -0.13 6.66 3.64 -2.01 -3.39 116.57 121.95 1qij h LYS 498 Ca 0.50 0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 59.66 1qij h LYS 498 Cb 0.76 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1qij h LYS 498 CO -0.26 -0.10 -0.80 0.93 -2.27 0.00 0.00 179.45 176.96 1qij h GLU 499 N -0.26 0.75 -5.80 1.90 4.39 -1.96 -3.48 114.58 110.12 1qij h GLU 499 Ca -0.02 -0.63 -0.37 0.00 0.34 0.00 0.00 59.36 58.68 1qij h GLU 499 Cb 0.11 0.14 0.14 0.00 -0.10 0.00 0.00 28.75 29.04 1qij h GLU 499 CO 0.02 1.23 -0.73 1.04 -1.16 0.00 0.00 179.01 179.42 1qij n GLN 500 N -3.92 -7.11 -2.27 2.33 6.02 0.09 -4.53 117.38 108.00 1qij n GLN 500 Ca -0.07 0.82 -0.32 0.00 -0.01 0.00 0.00 57.00 57.41 1qij n GLN 500 Cb 0.76 -5.82 -0.02 0.00 1.02 0.00 0.00 30.24 26.17 1qij n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1qij s LYS 501 N -5.90 3.75 0.20 -1.09 1.02 -1.26 -2.45 119.74 114.01 1qij s LYS 501 Ca 0.30 1.01 -0.21 0.00 0.02 0.00 0.00 55.97 57.10 1qij s LYS 501 Cb -0.14 -2.10 0.04 0.00 -0.52 0.00 0.00 37.83 35.11 1qij s LYS 501 CO 0.74 -0.44 0.60 -0.59 -0.92 0.00 0.00 175.35 174.74 1qij s PHE 502 N -2.61 -0.31 0.27 3.18 -0.71 -0.81 -4.40 117.98 112.60 1qij s PHE 502 Ca 0.60 -0.00 0.12 0.00 -1.04 0.00 0.00 56.93 56.60 1qij s PHE 502 Cb -0.12 0.53 -0.05 0.00 -1.21 0.00 0.00 43.02 42.18 1qij s PHE 502 CO 0.34 -0.96 -0.20 0.96 -1.34 0.00 0.00 175.22 174.02 1qij s ILE 503 N -3.83 2.45 0.30 -4.49 -4.36 -1.05 0.37 121.20 110.59 1qij s ILE 503 Ca 0.06 -2.39 -0.05 0.00 -0.26 0.00 0.00 60.65 58.01 1qij s ILE 503 Cb -0.02 -2.28 -0.05 0.00 1.25 0.00 0.00 42.46 41.35 1qij s ILE 503 CO -0.05 -0.39 0.57 -1.81 0.24 0.00 0.00 174.94 173.50 1qij s ASP 504 N -3.47 6.44 -0.35 4.36 1.01 -1.10 -1.42 116.67 122.14 1qij s ASP 504 Ca 0.29 0.73 0.01 0.00 0.71 0.00 0.00 52.55 54.30 1qij s ASP 504 Cb -0.05 -2.15 0.11 0.00 1.01 0.00 0.00 42.92 41.84 1qij s ASP 504 CO 0.15 -0.22 0.11 -0.22 0.21 0.00 0.00 175.17 175.19 1qij s LEU 505 N -3.64 3.26 0.00 1.23 2.96 -0.35 -4.69 118.68 117.45 1qij s LEU 505 Ca 0.44 -2.03 -0.06 0.00 -0.22 0.00 0.00 54.13 52.27 1qij s LEU 505 Cb -0.11 -1.19 0.02 0.00 0.50 0.00 0.00 46.19 45.42 1qij s LEU 505 CO 0.31 -0.37 0.40 -0.46 -1.32 0.00 0.00 176.35 174.90 1qij n ASN 506 N 4.37 -1.15 -0.26 3.68 0.23 -1.26 -3.10 115.26 117.77 1qij n ASN 506 Ca 0.02 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.07 1qij n ASN 506 Cb 0.40 1.97 0.00 0.00 -2.08 0.00 0.00 39.78 40.08 1qij n ASN 506 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1qij n THR 507 N -0.32 0.00 -4.07 5.53 -2.24 -1.26 -4.84 114.28 107.07 1qij n THR 507 Ca -0.03 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.53 1qij n THR 507 Cb 0.35 -0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 68.27 1qij n THR 507 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1qij s GLU 508 N -1.48 2.69 -0.05 -0.78 2.02 -1.26 -5.05 118.70 114.79 1qij s GLU 508 Ca 0.00 -1.24 -0.35 0.00 0.02 0.00 0.00 54.97 53.39 1qij s GLU 508 Cb 0.00 -2.42 -0.13 0.00 0.10 0.00 0.00 34.13 31.68 1qij s GLU 508 CO 0.00 0.28 1.74 -2.30 0.02 0.00 0.00 175.26 175.00 1qij n PRO 509 N -1.17 1.90 -1.36 0.39 -0.02 -1.26 -4.80 135.00 128.68 1qij n PRO 509 Ca -0.05 0.69 -0.48 0.00 -2.02 0.00 0.00 63.50 61.63 1qij n PRO 509 Cb 0.59 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 1qij n PRO 509 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 1qij n MET 510 N 5.28 0.00 -4.09 -0.52 0.00 -1.26 -4.98 117.12 111.55 1qij n MET 510 Ca 0.22 0.00 -0.20 0.00 -0.00 0.00 0.00 57.70 57.72 1qij n MET 510 Cb 0.25 -1.08 -0.16 0.00 0.00 0.00 0.00 33.22 32.23 1qij n MET 510 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1qij s LYS 511 N -0.70 0.72 0.16 2.12 1.02 -1.26 -5.06 119.74 116.74 1qij s LYS 511 Ca 0.68 -0.06 -0.09 0.00 0.02 0.00 0.00 55.97 56.52 1qij s LYS 511 Cb -0.97 -0.79 -0.06 0.00 -0.52 0.00 0.00 37.83 35.49 1qij s LYS 511 CO 0.53 -0.11 0.46 0.08 -0.92 0.00 0.00 175.35 175.40 1qij s VAL 512 N 1.02 5.03 0.00 3.17 1.01 -1.26 -2.70 120.40 126.67 1qij s VAL 512 Ca -0.10 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1qij s VAL 512 Cb -0.14 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1qij s VAL 512 CO -0.01 0.08 0.00 1.41 0.00 0.00 0.00 175.10 176.58 1qij n HIS 513 N 0.28 0.00 -3.79 5.22 8.25 0.16 -4.95 115.22 120.39 1qij n HIS 513 Ca -0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.31 1qij n HIS 513 Cb 0.52 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.55 1qij n HIS 513 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1qij s GLN 514 N -1.77 0.68 -0.88 -0.41 -0.21 -1.26 -1.92 119.66 113.88 1qij s GLN 514 Ca 0.00 -0.38 -0.06 0.00 0.02 0.00 0.00 55.36 54.94 1qij s GLN 514 Cb 0.00 0.29 -0.00 0.00 1.00 0.00 0.00 33.01 34.30 1qij s GLN 514 CO 0.00 -0.19 0.69 0.54 -2.12 0.00 0.00 175.29 174.20 1qij n ARG 515 N 1.03 -1.36 -1.52 2.91 1.74 -1.03 -4.79 116.66 113.64 1qij n ARG 515 Ca -0.21 0.91 -0.52 0.00 -0.77 0.00 0.00 57.85 57.27 1qij n ARG 515 Cb 0.57 -3.92 -0.07 0.00 -1.02 0.00 0.00 32.46 28.03 1qij n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1qij n LEU 516 N -2.78 2.33 -4.14 0.55 7.94 -1.26 -2.48 117.00 117.14 1qij n LEU 516 Ca -0.15 0.61 -0.37 0.00 -1.11 0.00 0.00 56.01 54.99 1qij n LEU 516 Cb 0.60 -1.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.27 1qij n LEU 516 CO 0.61 -0.59 -0.30 0.54 -1.11 0.00 0.00 177.39 176.54 1qij n ARG 517 N 7.47 -0.92 -0.08 1.96 1.74 -1.26 -4.88 116.66 120.68 1qij n ARG 517 Ca 0.36 0.14 -0.10 0.00 -0.77 0.00 0.00 57.85 57.48 1qij n ARG 517 Cb 0.21 -3.28 -0.03 0.00 -1.02 0.00 0.00 32.46 28.35 1qij n ARG 517 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1qij h VAL 518 N -2.16 1.16 -0.61 1.55 -1.51 -1.85 -1.49 116.25 111.34 1qij h VAL 518 Ca -0.68 -0.47 0.12 0.00 -1.23 0.00 0.00 66.70 64.44 1qij h VAL 518 Cb 1.40 0.96 -0.12 0.00 -2.13 0.00 0.00 31.29 31.40 1qij h VAL 518 CO 0.61 0.16 -0.20 -0.61 -1.23 0.00 0.00 177.57 176.30 1qij h GLN 519 N 0.30 -0.05 0.14 5.19 5.75 -1.90 -0.32 115.11 124.22 1qij h GLN 519 Ca 0.09 0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.31 1qij h GLN 519 Cb 0.14 0.01 0.02 0.00 1.07 0.00 0.00 27.48 28.72 1qij h GLN 519 CO -0.01 -0.03 -1.26 0.52 -2.65 0.00 0.00 178.83 175.40 1qij h MET 520 N -0.05 0.39 -0.17 1.69 2.86 -1.96 -3.21 114.93 114.49 1qij h MET 520 Ca 0.29 -0.61 -0.01 0.00 -2.06 0.00 0.00 59.70 57.30 1qij h MET 520 Cb 0.49 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1qij h MET 520 CO -0.65 1.28 0.05 0.00 1.06 0.00 0.00 176.91 178.64 1qij h VAL 522 N 0.23 1.33 0.01 0.00 2.07 -1.13 -0.32 116.25 118.44 1qij h VAL 522 Ca 0.06 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 65.74 1qij h VAL 522 Cb 0.08 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1qij h VAL 522 CO -0.00 0.57 -0.00 0.15 0.02 0.00 0.00 177.57 178.30 1qij h PHE 523 N 0.41 -0.01 0.00 1.57 3.57 -1.24 0.85 116.94 122.09 1qij h PHE 523 Ca 0.00 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.36 1qij h PHE 523 Cb 1.12 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1qij h PHE 523 CO 0.05 0.23 -0.67 -1.49 -2.23 0.00 0.00 178.31 174.20 1qij h TRP 524 N -0.25 0.00 0.00 0.41 4.06 -1.03 -0.04 115.95 119.11 1qij h TRP 524 Ca -0.00 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.61 1qij h TRP 524 Cb 0.24 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.34 1qij h TRP 524 CO 0.01 0.67 -2.14 0.09 -3.56 0.00 0.00 178.44 173.50 1qij n ASN 525 N -3.56 0.31 -0.04 -3.49 3.02 -0.13 -4.41 115.26 106.95 1qij n ASN 525 Ca -0.00 0.15 -0.08 0.00 -0.03 0.00 0.00 54.58 54.61 1qij n ASN 525 Cb 0.70 0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 40.47 1qij n ASN 525 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qij n GLN 526 N -2.85 0.28 0.27 3.52 6.02 0.25 -4.70 117.38 120.17 1qij n GLN 526 Ca -0.27 0.12 -0.11 0.00 -0.01 0.00 0.00 57.00 56.73 1qij n GLN 526 Cb 1.12 -0.99 -0.05 0.00 1.02 0.00 0.00 30.24 31.33 1qij n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1qij h PHE 527 N -0.51 -0.67 -0.24 1.08 3.57 -1.39 -3.12 116.94 115.66 1qij h PHE 527 Ca -0.13 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.42 1qij h PHE 527 Cb 0.79 0.22 -0.07 0.00 2.79 0.00 0.00 35.95 39.69 1qij h PHE 527 CO -0.16 -0.41 -0.21 1.25 -2.23 0.00 0.00 178.31 176.55 1qij h LEU 528 N -1.05 -0.66 -0.41 0.59 5.85 -1.27 0.96 115.31 119.31 1qij h LEU 528 Ca -0.07 0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1qij h LEU 528 Cb 0.55 0.32 -0.09 0.00 0.37 0.00 0.00 40.66 41.81 1qij h LEU 528 CO 0.12 -0.24 -0.32 -0.65 -0.34 0.00 0.00 178.44 177.00 1qij h PRO 529 N -0.21 -0.23 -0.49 5.25 0.11 -1.77 -0.35 132.00 134.31 1qij h PRO 529 Ca 0.14 0.02 0.08 0.00 0.11 0.00 0.00 66.00 66.34 1qij h PRO 529 Cb 0.41 0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.51 1qij h PRO 529 CO -0.36 -0.16 0.13 -0.22 -0.21 0.00 0.00 178.00 177.18 1qij h LYS 530 N -0.24 0.27 0.18 1.05 3.64 -1.31 -1.78 116.57 118.37 1qij h LYS 530 Ca 0.18 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1qij h LYS 530 Cb 0.54 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1qij h LYS 530 CO -0.55 0.18 -0.14 1.25 -2.27 0.00 0.00 179.45 177.92 1qij h LEU 531 N 0.27 -0.35 -1.99 5.20 6.46 0.21 -1.60 115.31 123.51 1qij h LEU 531 Ca 0.24 0.03 0.04 0.00 -0.12 0.00 0.00 57.88 58.07 1qij h LEU 531 Cb 0.30 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 1qij h LEU 531 CO -0.29 -0.22 0.12 -0.07 -0.62 0.00 0.00 178.44 177.36 1qij h LEU 532 N -0.33 0.02 -0.11 2.25 3.38 -0.85 -1.07 115.31 118.60 1qij h LEU 532 Ca -0.01 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.74 1qij h LEU 532 Cb 0.29 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1qij h LEU 532 CO -0.01 0.01 -1.00 -1.13 0.09 0.00 0.00 178.44 176.40 1qij h ASN 533 N 0.02 0.24 1.41 -0.43 -0.73 -0.82 -3.24 115.58 112.03 1qij h ASN 533 Ca 0.08 -0.23 -0.11 0.00 1.87 0.00 0.00 56.30 57.91 1qij h ASN 533 Cb 0.28 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 1qij h ASN 533 CO -0.00 1.10 -0.60 0.00 -0.37 0.00 0.00 177.43 177.56 1qij h ALA 534 N 0.88 0.66 -0.01 1.57 0.00 -0.73 -3.51 119.26 118.11 1qij h ALA 534 Ca -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1qij h ALA 534 Cb 1.69 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1qij h ALA 534 CO 0.15 0.67 0.00 0.25 0.00 0.00 0.00 179.25 180.32