#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6j s PRO 2 N 0.00 2.84 -0.07 -1.46 0.04 -1.25 -4.85 135.00 130.25 3g6j s PRO 2 Ca 0.00 1.90 0.01 0.00 0.04 0.00 0.00 61.00 62.96 3g6j s PRO 2 Cb 0.00 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.66 3g6j s PRO 2 CO 0.00 -1.33 -0.09 1.41 0.04 0.00 0.00 177.00 177.03 3g6j s MET 3 N -3.35 1.39 -0.11 4.56 1.75 -0.67 -4.97 119.30 117.91 3g6j s MET 3 Ca 0.79 -0.29 -0.02 0.00 -1.25 0.00 0.00 55.69 54.92 3g6j s MET 3 Cb -0.33 -1.25 -0.03 0.00 2.84 0.00 0.00 34.83 36.06 3g6j s MET 3 CO 0.35 -0.06 -0.01 0.71 -0.65 0.00 0.00 175.02 175.37 3g6j s TYR 4 N 0.92 3.13 0.06 4.11 2.02 -1.26 -1.12 117.35 125.21 3g6j s TYR 4 Ca -0.10 0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.69 3g6j s TYR 4 Cb -0.15 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.54 3g6j s TYR 4 CO 0.01 0.34 -0.07 -1.54 -1.57 0.00 0.00 175.55 172.72 3g6j s SER 5 N -0.53 0.88 -0.00 2.29 1.04 -0.91 -1.04 113.70 115.42 3g6j s SER 5 Ca 0.09 -0.73 0.05 0.00 0.48 0.00 0.00 55.95 55.84 3g6j s SER 5 Cb -0.12 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.06 3g6j s SER 5 CO 0.02 -0.33 -0.17 0.27 0.98 0.00 0.00 173.24 174.01 3g6j s ILE 6 N -2.32 1.38 -0.10 -1.02 -5.25 -0.32 -2.51 121.20 111.05 3g6j s ILE 6 Ca -0.02 -0.81 0.02 0.00 -0.99 0.00 0.00 60.65 58.85 3g6j s ILE 6 Cb -0.04 -1.16 0.01 0.00 2.95 0.00 0.00 42.46 44.23 3g6j s ILE 6 CO -0.02 0.34 -0.16 -0.63 -1.79 0.00 0.00 174.94 172.68 3g6j s ILE 7 N -0.48 1.51 0.17 8.37 1.09 -0.57 -2.38 121.20 128.90 3g6j s ILE 7 Ca 0.06 -0.66 0.02 0.00 -1.10 0.00 0.00 60.65 58.98 3g6j s ILE 7 Cb -0.07 -1.36 -0.05 0.00 -1.06 0.00 0.00 42.46 39.92 3g6j s ILE 7 CO -0.00 0.44 -0.02 0.42 -0.10 0.00 0.00 174.94 175.68 3g6j s THR 8 N 0.86 0.77 0.69 2.92 -4.23 -1.22 -0.83 115.64 114.60 3g6j s THR 8 Ca -0.09 -1.99 -0.17 0.00 -1.18 0.00 0.00 61.69 58.26 3g6j s THR 8 Cb -0.15 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.61 3g6j s THR 8 CO 0.00 -0.52 1.13 -2.65 -0.54 0.00 0.00 174.62 172.04 3g6j n PRO 9 N -0.24 0.76 0.24 3.99 -0.02 -1.26 0.16 135.00 138.63 3g6j n PRO 9 Ca -0.07 0.32 0.07 0.00 -2.02 0.00 0.00 63.50 61.80 3g6j n PRO 9 Cb 0.63 -2.36 0.57 0.00 -0.02 0.00 0.00 33.50 32.31 3g6j n PRO 9 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3g6j h ASN 10 N 0.08 0.00 -3.44 2.55 -0.26 -1.65 -3.40 115.58 109.47 3g6j h ASN 10 Ca -0.49 0.00 -0.48 0.00 -0.56 0.00 0.00 56.30 54.77 3g6j h ASN 10 Cb 1.34 0.00 -0.34 0.00 -1.06 0.00 0.00 38.32 38.26 3g6j h ASN 10 CO 0.50 0.13 -0.80 -0.63 -1.06 0.00 0.00 177.43 175.57 3g6j s ILE 11 N -4.68 0.94 -0.12 2.81 1.01 -1.26 -3.85 121.20 116.05 3g6j s ILE 11 Ca -0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.21 3g6j s ILE 11 Cb 0.16 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 3g6j s ILE 11 CO 0.67 0.31 0.01 -0.76 0.00 0.00 0.00 174.94 175.17 3g6j s LEU 12 N 0.73 3.56 0.07 2.97 1.43 -1.01 -4.94 118.68 121.50 3g6j s LEU 12 Ca -0.14 0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.07 3g6j s LEU 12 Cb -0.15 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 3g6j s LEU 12 CO 0.03 0.29 0.04 -0.13 0.23 0.00 0.00 176.35 176.81 3g6j s ARG 13 N -0.34 2.77 0.33 1.70 0.52 -1.26 -1.80 118.95 120.87 3g6j s ARG 13 Ca 0.07 -0.72 -0.26 0.00 -0.52 0.00 0.00 55.73 54.30 3g6j s ARG 13 Cb -0.12 -2.66 -0.10 0.00 0.52 0.00 0.00 34.95 32.59 3g6j s ARG 13 CO 0.02 0.57 0.98 -0.51 0.02 0.00 0.00 175.30 176.37 3g6j s LEU 14 N -2.25 4.34 0.00 2.53 1.43 -1.24 -4.14 118.68 119.35 3g6j s LEU 14 Ca 0.27 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 3g6j s LEU 14 Cb -0.12 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.11 3g6j s LEU 14 CO 0.19 -0.14 0.00 -0.62 0.23 0.00 0.00 176.35 176.01 3g6j n GLU 15 N 0.54 0.00 -3.68 1.70 1.02 0.22 -4.72 120.64 115.72 3g6j n GLU 15 Ca 0.02 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.91 3g6j n GLU 15 Cb 0.49 -2.20 -0.02 0.00 -0.02 0.00 0.00 31.44 29.69 3g6j n GLU 15 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3g6j s SER 16 N -0.93 6.34 -0.01 1.62 1.04 -1.26 -4.80 113.70 115.70 3g6j s SER 16 Ca 0.00 0.33 -0.30 0.00 0.48 0.00 0.00 55.95 56.46 3g6j s SER 16 Cb 0.00 -1.98 -0.04 0.00 0.10 0.00 0.00 66.02 64.11 3g6j s SER 16 CO 0.00 -0.12 1.11 -1.61 0.98 0.00 0.00 173.24 173.61 3g6j s GLU 17 N -3.75 4.45 -0.10 4.02 2.02 -1.26 -4.33 118.70 119.75 3g6j s GLU 17 Ca 0.38 1.60 0.03 0.00 0.02 0.00 0.00 54.97 56.99 3g6j s GLU 17 Cb -0.10 -3.46 0.01 0.00 0.10 0.00 0.00 34.13 30.68 3g6j s GLU 17 CO 0.31 -0.25 -0.20 -1.21 0.02 0.00 0.00 175.26 173.93 3g6j s GLU 18 N 1.45 2.66 0.18 1.61 0.41 -0.74 -5.00 118.70 119.27 3g6j s GLU 18 Ca 0.55 -0.74 -0.05 0.00 -0.41 0.00 0.00 54.97 54.32 3g6j s GLU 18 Cb -0.24 -2.09 -0.06 0.00 -1.78 0.00 0.00 34.13 29.96 3g6j s GLU 18 CO 0.26 0.07 0.42 0.99 -0.49 0.00 0.00 175.26 176.51 3g6j s THR 19 N 0.60 5.12 -0.12 3.63 2.01 -1.26 -3.22 115.64 122.39 3g6j s THR 19 Ca -0.14 0.06 -0.00 0.00 0.31 0.00 0.00 61.69 61.92 3g6j s THR 19 Cb -0.17 -3.64 0.03 0.00 0.01 0.00 0.00 72.50 68.73 3g6j s THR 19 CO 0.04 -0.04 -0.07 -0.32 -0.69 0.00 0.00 174.62 173.54 3g6j s MET 20 N -2.85 1.47 0.00 4.92 1.75 -0.67 -4.52 119.30 119.40 3g6j s MET 20 Ca 0.42 -0.27 -0.23 0.00 -1.25 0.00 0.00 55.69 54.36 3g6j s MET 20 Cb -0.12 -1.61 -0.05 0.00 2.84 0.00 0.00 34.83 35.89 3g6j s MET 20 CO 0.25 -0.29 0.71 0.08 -0.65 0.00 0.00 175.02 175.12 3g6j s VAL 21 N 1.71 4.87 -0.11 10.11 1.01 -0.01 -1.92 120.40 136.08 3g6j s VAL 21 Ca 0.04 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.54 3g6j s VAL 21 Cb -0.13 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3g6j s VAL 21 CO -0.08 0.34 -0.21 -0.76 0.00 0.00 0.00 175.10 174.39 3g6j s LEU 22 N 0.17 1.99 0.03 3.92 1.43 0.24 -1.52 118.68 124.94 3g6j s LEU 22 Ca 0.36 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 3g6j s LEU 22 Cb -0.19 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 3g6j s LEU 22 CO 0.20 0.11 -0.09 -1.61 0.23 0.00 0.00 176.35 175.19 3g6j s GLU 23 N 0.56 0.62 -0.43 1.70 2.02 -1.04 -1.48 118.70 120.64 3g6j s GLU 23 Ca -0.14 -0.64 0.02 0.00 0.02 0.00 0.00 54.97 54.22 3g6j s GLU 23 Cb -0.17 -0.51 0.14 0.00 0.10 0.00 0.00 34.13 33.70 3g6j s GLU 23 CO 0.05 0.12 0.26 0.00 0.02 0.00 0.00 175.26 175.70 3g6j s ALA 24 N -0.97 1.89 0.34 5.21 0.00 -0.42 -2.14 121.76 125.66 3g6j s ALA 24 Ca -0.04 -2.49 -0.26 0.00 0.00 0.00 0.00 51.96 49.17 3g6j s ALA 24 Cb -0.08 -1.80 -0.10 0.00 0.00 0.00 0.00 23.12 21.14 3g6j s ALA 24 CO 0.01 -2.07 0.98 -1.01 0.00 0.00 0.00 175.76 173.67 3g6j s HIS 25 N 0.36 3.59 -1.23 0.00 0.09 -0.27 -3.62 115.29 114.20 3g6j s HIS 25 Ca 0.20 1.75 -0.10 0.00 -0.00 0.00 0.00 55.06 56.91 3g6j s HIS 25 Cb -0.19 -3.00 -0.01 0.00 -0.00 0.00 0.00 32.58 29.38 3g6j s HIS 25 CO -0.03 -0.04 0.71 -0.25 -0.00 0.00 0.00 174.74 175.12 3g6j n ASP 26 N 0.48 -3.28 -4.85 1.40 10.43 -1.26 -1.67 116.55 117.80 3g6j n ASP 26 Ca 0.02 -0.93 -0.23 0.00 2.57 0.00 0.00 54.79 56.23 3g6j n ASP 26 Cb 0.49 -3.68 -0.04 0.00 1.84 0.00 0.00 41.12 39.73 3g6j n ASP 26 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3g6j s ALA 27 N -3.61 3.66 -0.23 2.24 0.00 -1.24 -3.90 121.76 118.67 3g6j s ALA 27 Ca 0.25 -1.34 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 3g6j s ALA 27 Cb -0.08 -1.40 0.07 0.00 0.00 0.00 0.00 23.12 21.71 3g6j s ALA 27 CO 0.84 0.30 0.06 -0.65 0.00 0.00 0.00 175.76 176.31 3g6j s GLN 28 N -3.73 0.64 0.89 0.00 -1.52 -1.26 -5.08 119.66 109.60 3g6j s GLN 28 Ca 0.33 -0.60 0.00 0.00 -1.95 0.00 0.00 55.36 53.14 3g6j s GLN 28 Cb -0.09 -2.01 0.00 0.00 -0.22 0.00 0.00 33.01 30.70 3g6j s GLN 28 CO 0.26 -0.76 0.00 0.41 -0.25 0.00 0.00 175.29 174.95 3g6j n GLY 29 N 5.01 -1.83 3.75 3.09 0.00 -1.26 -4.85 105.19 109.11 3g6j n GLY 29 Ca -0.07 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 3g6j n GLY 29 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g6j n ASP 30 N -1.33 3.50 -3.56 1.61 9.92 -1.26 -4.59 116.55 120.84 3g6j n ASP 30 Ca 0.00 1.22 -0.22 0.00 -0.53 0.00 0.00 54.79 55.26 3g6j n ASP 30 Cb 0.11 -1.58 -0.15 0.00 -0.64 0.00 0.00 41.12 38.86 3g6j n ASP 30 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3g6j s VAL 31 N -1.09 -0.20 0.45 2.53 0.11 -1.21 -5.06 120.40 115.92 3g6j s VAL 31 Ca 0.54 -0.10 -0.20 0.00 -2.93 0.00 0.00 61.98 59.29 3g6j s VAL 31 Cb -0.50 -0.59 -0.10 0.00 -1.53 0.00 0.00 36.38 33.65 3g6j s VAL 31 CO 0.63 -0.22 0.96 -2.16 -3.33 0.00 0.00 175.10 170.99 3g6j s PRO 32 N 2.23 4.17 -0.05 1.54 0.04 -1.26 -2.96 135.00 138.70 3g6j s PRO 32 Ca 0.04 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.17 3g6j s PRO 32 Cb -0.16 -2.17 0.04 0.00 0.04 0.00 0.00 34.50 32.25 3g6j s PRO 32 CO -0.10 -0.08 0.11 0.08 0.04 0.00 0.00 177.00 177.04 3g6j s VAL 33 N -2.24 -0.10 -0.26 -0.36 1.01 0.99 0.67 120.40 120.11 3g6j s VAL 33 Ca 0.62 0.26 -0.09 0.00 0.00 0.00 0.00 61.98 62.76 3g6j s VAL 33 Cb -0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 3g6j s VAL 33 CO 0.16 0.11 0.13 -0.89 0.00 0.00 0.00 175.10 174.60 3g6j s THR 34 N 1.50 4.79 -0.27 3.92 2.01 -1.02 -1.30 115.64 125.27 3g6j s THR 34 Ca -0.05 -0.01 -0.13 0.00 0.31 0.00 0.00 61.69 61.81 3g6j s THR 34 Cb -0.12 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 3g6j s THR 34 CO -0.05 0.30 0.30 -0.69 -0.69 0.00 0.00 174.62 173.80 3g6j s VAL 35 N 1.65 5.23 0.11 3.82 1.01 -0.94 -0.72 120.40 130.55 3g6j s VAL 35 Ca 0.07 0.43 0.09 0.00 0.00 0.00 0.00 61.98 62.56 3g6j s VAL 35 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3g6j s VAL 35 CO 0.07 0.21 -0.19 -0.89 0.00 0.00 0.00 175.10 174.29 3g6j s THR 36 N 1.86 2.76 -0.14 3.92 2.01 0.87 -4.25 115.64 122.67 3g6j s THR 36 Ca 0.12 -1.50 -0.01 0.00 0.31 0.00 0.00 61.69 60.60 3g6j s THR 36 Cb -0.16 -2.25 0.04 0.00 0.01 0.00 0.00 72.50 70.14 3g6j s THR 36 CO 0.10 0.12 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.45 3g6j s VAL 37 N -1.11 0.69 0.27 3.82 1.01 -0.97 -0.50 120.40 123.62 3g6j s VAL 37 Ca 0.17 -0.32 0.10 0.00 0.00 0.00 0.00 61.98 61.94 3g6j s VAL 37 Cb -0.10 -0.93 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 3g6j s VAL 37 CO 0.09 0.11 -0.07 -1.00 0.00 0.00 0.00 175.10 174.23 3g6j s HIS 38 N 1.82 2.56 0.92 5.22 3.76 -0.42 -1.49 115.29 127.65 3g6j s HIS 38 Ca 0.02 -0.26 -0.12 0.00 -0.15 0.00 0.00 55.06 54.55 3g6j s HIS 38 Cb -0.14 -1.13 0.14 0.00 1.11 0.00 0.00 32.58 32.56 3g6j s HIS 38 CO -0.07 0.65 1.10 0.16 -0.85 0.00 0.00 174.74 175.73 3g6j s ASP 39 N -3.59 3.37 -0.09 1.40 -4.77 -1.23 0.40 116.67 112.16 3g6j s ASP 39 Ca 0.31 1.29 -0.07 0.00 -3.30 0.00 0.00 52.55 50.78 3g6j s ASP 39 Cb -0.06 -1.96 0.03 0.00 -1.09 0.00 0.00 42.92 39.84 3g6j s ASP 39 CO 0.18 -2.68 0.22 0.12 0.70 0.00 0.00 175.17 173.71 3g6j s PHE 40 N -3.03 -0.26 0.68 2.11 5.36 -1.17 -4.35 117.98 117.33 3g6j s PHE 40 Ca 0.64 0.63 -0.11 0.00 -0.96 0.00 0.00 56.93 57.12 3g6j s PHE 40 Cb -0.17 0.06 -0.00 0.00 -0.34 0.00 0.00 43.02 42.57 3g6j s PHE 40 CO 0.56 -0.15 1.07 -1.25 -1.46 0.00 0.00 175.22 174.00 3g6j s PRO 41 N 0.50 3.10 0.29 10.12 0.04 -1.26 -4.50 135.00 143.29 3g6j s PRO 41 Ca -0.03 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.57 3g6j s PRO 41 Cb -0.05 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.45 3g6j s PRO 41 CO -0.03 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.54 3g6j n GLY 42 N -2.90 -3.40 3.00 0.56 0.00 -1.26 -4.95 105.19 96.24 3g6j n GLY 42 Ca 0.07 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 3g6j n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s LYS 43 N -4.66 1.62 -0.23 1.61 1.02 -1.26 -4.39 119.74 113.44 3g6j s LYS 43 Ca 0.00 -1.61 -0.04 0.00 0.02 0.00 0.00 55.97 54.33 3g6j s LYS 43 Cb 0.00 -2.98 -0.01 0.00 -0.52 0.00 0.00 37.83 34.32 3g6j s LYS 43 CO 0.00 -0.83 -0.02 0.21 -0.92 0.00 0.00 175.35 173.80 3g6j s LYS 44 N 1.05 3.34 0.38 1.68 2.36 -1.26 -4.98 119.74 122.30 3g6j s LYS 44 Ca 0.05 -0.66 -0.28 0.00 -2.55 0.00 0.00 55.97 52.53 3g6j s LYS 44 Cb -0.19 -3.09 -0.11 0.00 -1.05 0.00 0.00 37.83 33.39 3g6j s LYS 44 CO -0.08 -0.24 1.48 -0.48 1.55 0.00 0.00 175.35 177.58 3g6j s LEU 45 N 1.49 4.30 -0.03 5.43 -0.00 -1.26 -3.56 118.68 125.04 3g6j s LEU 45 Ca 0.05 3.04 0.01 0.00 -0.00 0.00 0.00 54.13 57.23 3g6j s LEU 45 Cb -0.15 -3.69 -0.03 0.00 -0.00 0.00 0.00 46.19 42.32 3g6j s LEU 45 CO -0.02 -0.90 -0.02 0.55 -0.00 0.00 0.00 176.35 175.96 3g6j n VAL 46 N 0.40 0.18 -3.24 1.48 3.14 -0.56 -4.95 118.33 114.78 3g6j n VAL 46 Ca 0.01 -0.09 -0.03 0.00 -2.96 0.00 0.00 64.34 61.27 3g6j n VAL 46 Cb 0.39 -0.73 -0.03 0.00 -1.06 0.00 0.00 33.84 32.42 3g6j n VAL 46 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 3g6j s LEU 47 N -4.84 -1.18 -0.04 6.55 0.20 -1.01 -4.88 118.68 113.48 3g6j s LEU 47 Ca -0.03 -0.93 0.14 0.00 0.69 0.00 0.00 54.13 54.00 3g6j s LEU 47 Cb 0.01 1.62 0.47 0.00 -0.43 0.00 0.00 46.19 47.87 3g6j s LEU 47 CO 0.09 -0.20 1.36 -1.54 -0.29 0.00 0.00 176.35 175.77 3g6j n SER 48 N 4.43 3.09 -2.91 3.68 3.41 -1.26 -2.28 113.62 121.78 3g6j n SER 48 Ca 0.11 -2.17 -0.04 0.00 -0.26 0.00 0.00 58.87 56.51 3g6j n SER 48 Cb 0.54 -0.41 0.04 0.00 -0.26 0.00 0.00 64.21 64.11 3g6j n SER 48 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3g6j n SER 49 N 0.83 -1.96 -2.68 4.04 2.88 -1.26 -4.75 113.62 110.72 3g6j n SER 49 Ca 0.17 -0.26 -0.02 0.00 -1.33 0.00 0.00 58.87 57.43 3g6j n SER 49 Cb 0.55 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 3g6j n SER 49 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3g6j n GLU 50 N -2.35 -2.95 -4.35 -1.46 -0.58 -1.26 -4.39 120.64 103.30 3g6j n GLU 50 Ca 0.02 2.45 -0.30 0.00 -0.42 0.00 0.00 57.16 58.91 3g6j n GLU 50 Cb 0.08 -5.22 -0.11 0.00 -0.57 0.00 0.00 31.44 25.63 3g6j n GLU 50 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 3g6j s LYS 51 N -1.85 2.14 0.15 3.49 0.00 -1.26 -2.22 119.74 120.18 3g6j s LYS 51 Ca 0.08 -0.99 -0.17 0.00 0.00 0.00 0.00 55.97 54.88 3g6j s LYS 51 Cb -0.02 -2.29 0.04 0.00 0.00 0.00 0.00 37.83 35.56 3g6j s LYS 51 CO 0.73 0.52 0.46 -0.08 0.00 0.00 0.00 175.35 176.98 3g6j s THR 52 N -1.12 0.05 -0.25 3.79 -1.32 -0.42 -5.00 115.64 111.36 3g6j s THR 52 Ca 0.19 -0.54 0.01 0.00 -1.21 0.00 0.00 61.69 60.14 3g6j s THR 52 Cb -0.11 -1.24 0.07 0.00 -1.51 0.00 0.00 72.50 69.71 3g6j s THR 52 CO 0.11 -0.22 -0.04 0.68 -2.21 0.00 0.00 174.62 172.94 3g6j s VAL 53 N -3.81 1.56 -0.17 5.08 -7.23 -1.26 -0.01 120.40 114.56 3g6j s VAL 53 Ca 0.04 -1.32 -0.29 0.00 -1.81 0.00 0.00 61.98 58.60 3g6j s VAL 53 Cb 0.01 -1.86 -0.00 0.00 0.56 0.00 0.00 36.38 35.08 3g6j s VAL 53 CO -0.10 -0.17 1.05 -1.48 -0.31 0.00 0.00 175.10 174.10 3g6j s LEU 54 N 1.36 4.17 0.24 1.32 2.34 -1.16 -4.89 118.68 122.07 3g6j s LEU 54 Ca -0.04 1.49 0.10 0.00 0.06 0.00 0.00 54.13 55.73 3g6j s LEU 54 Cb -0.19 -3.55 -0.04 0.00 -0.56 0.00 0.00 46.19 41.85 3g6j s LEU 54 CO -0.07 -0.59 -0.05 0.42 -1.06 0.00 0.00 176.35 175.00 3g6j s THR 55 N 2.71 3.27 0.38 5.48 -4.23 -1.26 -3.33 115.64 118.67 3g6j s THR 55 Ca 0.47 -1.88 0.22 0.00 -1.18 0.00 0.00 61.69 59.32 3g6j s THR 55 Cb -0.17 -2.71 0.39 0.00 1.34 0.00 0.00 72.50 71.35 3g6j s THR 55 CO 0.12 -0.29 1.63 -0.65 -0.54 0.00 0.00 174.62 174.89 3g6j h PRO 56 N 2.26 0.16 -0.74 3.99 0.11 -1.96 -0.22 132.00 135.61 3g6j h PRO 56 Ca -0.45 -0.01 0.17 0.00 0.11 0.00 0.00 66.00 65.82 3g6j h PRO 56 Cb 1.24 -0.04 -0.13 0.00 0.11 0.00 0.00 31.00 32.18 3g6j h PRO 56 CO 0.58 0.11 0.02 0.00 -0.21 0.00 0.00 178.00 178.50 3g6j h ALA 57 N 1.79 0.78 -0.90 -0.75 0.00 -1.99 -2.51 119.26 115.68 3g6j h ALA 57 Ca 0.79 0.23 -0.62 0.00 0.00 0.00 0.00 54.91 55.30 3g6j h ALA 57 Cb 2.12 0.39 -0.33 0.00 0.00 0.00 0.00 17.79 19.96 3g6j h ALA 57 CO -0.57 -0.41 0.29 0.25 0.00 0.00 0.00 179.25 178.81 3g6j n THR 58 N -5.32 3.24 -3.52 0.00 -2.24 -0.12 -4.93 114.28 101.39 3g6j n THR 58 Ca 0.13 -3.33 -0.25 0.00 -2.27 0.00 0.00 64.05 58.34 3g6j n THR 58 Cb 0.46 -1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 67.55 3g6j n THR 58 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3g6j n ASN 59 N -0.86 -3.02 -3.61 3.42 3.02 -0.95 -1.48 115.26 111.78 3g6j n ASN 59 Ca 0.56 -0.47 -0.27 0.00 -0.03 0.00 0.00 54.58 54.37 3g6j n ASN 59 Cb 0.79 -2.53 0.03 0.00 -0.61 0.00 0.00 39.78 37.46 3g6j n ASN 59 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3g6j n HIS 60 N -3.81 -2.21 -4.14 3.10 8.25 -1.03 -4.87 115.22 110.50 3g6j n HIS 60 Ca 0.02 0.77 -0.22 0.00 -0.26 0.00 0.00 57.72 58.03 3g6j n HIS 60 Cb 0.52 -3.98 -0.17 0.00 1.12 0.00 0.00 29.99 27.48 3g6j n HIS 60 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 3g6j s MET 61 N -6.31 0.97 0.31 -0.41 0.00 -0.55 -1.30 119.30 112.00 3g6j s MET 61 Ca 0.54 -0.13 0.01 0.00 0.00 0.00 0.00 55.69 56.12 3g6j s MET 61 Cb -0.27 -0.99 -0.00 0.00 0.00 0.00 0.00 34.83 33.56 3g6j s MET 61 CO 0.67 -0.11 0.38 0.41 0.00 0.00 0.00 175.02 176.37 3g6j n GLY 62 N 4.25 2.48 3.25 2.11 0.00 -0.55 -4.86 105.19 111.87 3g6j n GLY 62 Ca -0.21 -1.69 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 3g6j n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s ASN 63 N -3.02 0.68 0.00 1.61 2.20 -1.26 -0.60 114.94 114.55 3g6j s ASN 63 Ca 0.30 -1.43 0.03 0.00 -0.94 0.00 0.00 52.86 50.82 3g6j s ASN 63 Cb 0.00 0.33 -0.01 0.00 -2.00 0.00 0.00 41.25 39.57 3g6j s ASN 63 CO 0.21 -0.83 -0.11 -0.69 -2.94 0.00 0.00 177.10 172.75 3g6j s VAL 64 N -3.95 0.84 -0.24 3.54 1.01 -0.81 -4.96 120.40 115.84 3g6j s VAL 64 Ca 0.38 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.81 3g6j s VAL 64 Cb 0.07 -0.72 0.04 0.00 0.00 0.00 0.00 36.38 35.76 3g6j s VAL 64 CO 0.14 0.15 -0.11 -0.89 0.00 0.00 0.00 175.10 174.39 3g6j s THR 65 N -0.41 2.40 0.11 3.92 2.01 -1.26 -1.66 115.64 120.75 3g6j s THR 65 Ca 0.03 -1.23 0.02 0.00 0.31 0.00 0.00 61.69 60.82 3g6j s THR 65 Cb -0.05 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 3g6j s THR 65 CO -0.00 0.20 -0.08 0.72 -0.69 0.00 0.00 174.62 174.77 3g6j s PHE 66 N 1.23 0.98 0.02 4.92 -0.12 -1.20 -4.90 117.98 118.91 3g6j s PHE 66 Ca -0.02 -0.85 0.03 0.00 -0.05 0.00 0.00 56.93 56.04 3g6j s PHE 66 Cb -0.17 -0.55 -0.01 0.00 -0.63 0.00 0.00 43.02 41.66 3g6j s PHE 66 CO -0.07 -0.08 -0.09 0.99 -0.05 0.00 0.00 175.22 175.92 3g6j s THR 67 N -3.41 0.68 -0.23 -4.49 2.01 -1.26 -1.78 115.64 107.15 3g6j s THR 67 Ca 0.12 -0.65 -0.07 0.00 0.31 0.00 0.00 61.69 61.40 3g6j s THR 67 Cb 0.04 -0.63 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 3g6j s THR 67 CO -0.03 -0.01 0.06 -0.63 -0.69 0.00 0.00 174.62 173.32 3g6j s ILE 68 N -0.61 4.33 0.48 1.82 1.01 -1.26 -4.90 121.20 122.06 3g6j s ILE 68 Ca -0.01 -0.17 -0.20 0.00 0.00 0.00 0.00 60.65 60.28 3g6j s ILE 68 Cb -0.06 -3.01 -0.09 0.00 0.01 0.00 0.00 42.46 39.32 3g6j s ILE 68 CO 0.00 0.36 1.00 -2.84 0.00 0.00 0.00 174.94 173.46 3g6j s PRO 69 N 1.39 3.95 -1.49 2.79 0.02 -1.26 0.72 135.00 141.12 3g6j s PRO 69 Ca 0.05 1.19 -0.12 0.00 0.02 0.00 0.00 61.00 62.15 3g6j s PRO 69 Cb -0.15 -2.13 0.01 0.00 0.02 0.00 0.00 34.50 32.26 3g6j s PRO 69 CO 0.03 -0.28 2.46 0.00 -0.33 0.00 0.00 177.00 178.89 3g6j n ALA 70 N -1.02 6.32 -1.00 -1.55 0.00 -1.26 -4.87 120.51 117.14 3g6j n ALA 70 Ca 0.08 -3.81 0.00 0.00 0.00 0.00 0.00 53.44 49.70 3g6j n ALA 70 Cb 0.53 -3.38 0.00 0.00 0.00 0.00 0.00 19.45 16.60 3g6j n ALA 70 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3g6j n ASN 71 N 4.72 -0.36 -0.11 0.00 5.03 -1.26 -4.52 115.26 118.75 3g6j n ASN 71 Ca 0.61 -0.67 -0.10 0.00 0.87 0.00 0.00 54.58 55.29 3g6j n ASN 71 Cb 0.32 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.06 3g6j n ASN 71 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 3g6j h ARG 72 N 0.00 0.53 -0.07 3.52 -0.00 -2.01 -2.42 114.38 113.93 3g6j h ARG 72 Ca 0.00 -0.11 0.00 0.00 -0.50 0.00 0.00 59.98 59.37 3g6j h ARG 72 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 29.97 29.89 3g6j h ARG 72 CO 0.00 0.55 0.00 0.39 0.00 0.00 0.00 179.97 180.91 3g6j n GLU 73 N -4.66 1.25 -0.07 0.04 1.02 -1.26 -3.78 120.64 113.18 3g6j n GLU 73 Ca -0.01 -0.38 -0.12 0.00 -0.02 0.00 0.00 57.16 56.63 3g6j n GLU 73 Cb 0.16 -1.28 -0.06 0.00 -0.02 0.00 0.00 31.44 30.24 3g6j n GLU 73 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3g6j n PHE 74 N -0.37 0.00 0.02 -0.32 0.99 -1.08 -4.51 117.46 112.19 3g6j n PHE 74 Ca 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.56 3g6j n PHE 74 Cb 0.14 -0.52 -0.01 0.00 -1.00 0.00 0.00 39.48 38.09 3g6j n PHE 74 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 3g6j h LYS 75 N -0.19 -0.09 -0.32 -1.08 1.57 -1.53 -3.29 116.57 111.64 3g6j h LYS 75 Ca -0.33 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.32 3g6j h LYS 75 Cb 1.42 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.74 3g6j h LYS 75 CO -0.11 -0.06 -0.34 0.66 -0.57 0.00 0.00 179.45 179.03 3g6j h SER 76 N -0.09 0.86 -2.43 0.86 4.64 -1.86 -3.40 113.55 112.12 3g6j h SER 76 Ca -0.00 -0.48 -0.53 0.00 -0.47 0.00 0.00 61.79 60.31 3g6j h SER 76 Cb 0.09 -0.24 -0.06 0.00 -0.31 0.00 0.00 62.40 61.88 3g6j h SER 76 CO -0.03 1.16 1.15 -1.61 -0.87 0.00 0.00 176.83 176.63 3g6j s GLU 77 N -4.35 3.09 0.25 4.77 2.02 -1.24 -4.95 118.70 118.29 3g6j s GLU 77 Ca -0.12 0.25 -0.01 0.00 0.02 0.00 0.00 54.97 55.11 3g6j s GLU 77 Cb 0.10 -4.21 -0.03 0.00 0.10 0.00 0.00 34.13 30.08 3g6j s GLU 77 CO 0.85 -2.22 0.24 0.15 0.02 0.00 0.00 175.26 174.30 3g6j s LYS 78 N 5.98 1.44 0.00 1.61 1.02 -1.26 -4.71 119.74 123.82 3g6j s LYS 78 Ca 0.50 -1.68 0.00 0.00 0.02 0.00 0.00 55.97 54.81 3g6j s LYS 78 Cb -0.10 0.32 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 3g6j s LYS 78 CO 0.20 -0.52 0.00 0.41 -0.92 0.00 0.00 175.35 174.52 3g6j n GLY 79 N -0.39 2.66 3.86 -3.33 0.00 -1.26 -5.00 105.19 101.72 3g6j n GLY 79 Ca 0.03 -0.75 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 3g6j n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g6j s ARG 80 N 0.00 3.92 0.54 1.61 1.81 -1.26 -5.06 118.95 120.51 3g6j s ARG 80 Ca 0.00 0.46 -0.21 0.00 -1.72 0.00 0.00 55.73 54.26 3g6j s ARG 80 Cb 0.00 -2.68 -0.05 0.00 -0.45 0.00 0.00 34.95 31.77 3g6j s ARG 80 CO 0.00 0.32 1.24 -0.80 -0.68 0.00 0.00 175.30 175.39 3g6j s ASN 81 N -2.14 5.50 0.07 0.23 0.02 -1.26 -5.03 114.94 112.32 3g6j s ASN 81 Ca 0.46 2.49 0.01 0.00 -1.02 0.00 0.00 52.86 54.80 3g6j s ASN 81 Cb -0.12 -2.61 -0.04 0.00 0.02 0.00 0.00 41.25 38.50 3g6j s ASN 81 CO 0.20 -1.39 0.16 -0.54 0.02 0.00 0.00 177.10 175.55 3g6j s LYS 82 N -3.01 3.22 0.08 -0.60 -0.14 -1.26 -5.04 119.74 113.00 3g6j s LYS 82 Ca 0.72 -0.54 0.01 0.00 -1.36 0.00 0.00 55.97 54.80 3g6j s LYS 82 Cb -0.33 -2.91 -0.04 0.00 -1.68 0.00 0.00 37.83 32.87 3g6j s LYS 82 CO 0.38 0.59 -0.06 -0.06 -0.76 0.00 0.00 175.35 175.44 3g6j s PHE 83 N -1.47 0.80 0.42 3.18 0.08 -1.26 -0.65 117.98 119.08 3g6j s PHE 83 Ca 0.33 -0.86 0.04 0.00 0.12 0.00 0.00 56.93 56.56 3g6j s PHE 83 Cb -0.13 -0.48 -0.02 0.00 -0.57 0.00 0.00 43.02 41.83 3g6j s PHE 83 CO 0.26 -0.17 0.14 0.14 -0.10 0.00 0.00 175.22 175.49 3g6j s VAL 84 N -3.27 0.55 -0.28 -0.44 -7.23 -1.03 -3.03 120.40 105.66 3g6j s VAL 84 Ca 0.07 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 3g6j s VAL 84 Cb 0.03 -2.29 0.08 0.00 0.56 0.00 0.00 36.38 34.76 3g6j s VAL 84 CO -0.04 0.00 0.04 -0.89 -0.31 0.00 0.00 175.10 173.89 3g6j s THR 85 N -3.17 1.31 0.26 5.32 2.01 0.16 -2.49 115.64 119.04 3g6j s THR 85 Ca 0.22 -1.44 -0.30 0.00 0.31 0.00 0.00 61.69 60.48 3g6j s THR 85 Cb 0.02 -1.84 -0.09 0.00 0.01 0.00 0.00 72.50 70.59 3g6j s THR 85 CO 0.14 -0.44 1.02 -0.69 -0.69 0.00 0.00 174.62 173.96 3g6j s VAL 86 N 1.43 3.80 -0.24 3.82 1.01 -0.77 -1.30 120.40 128.16 3g6j s VAL 86 Ca 0.04 1.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.80 3g6j s VAL 86 Cb -0.18 -4.15 0.13 0.00 0.00 0.00 0.00 36.38 32.18 3g6j s VAL 86 CO -0.14 0.43 0.38 -1.58 0.00 0.00 0.00 175.10 174.18 3g6j s GLN 87 N -1.28 0.35 -0.03 2.72 0.74 0.35 -1.33 119.66 121.18 3g6j s GLN 87 Ca 0.43 0.53 -0.15 0.00 0.05 0.00 0.00 55.36 56.22 3g6j s GLN 87 Cb -0.29 -0.49 -0.05 0.00 1.10 0.00 0.00 33.01 33.28 3g6j s GLN 87 CO 0.36 -0.64 0.40 0.00 -0.55 0.00 0.00 175.29 174.86 3g6j s ALA 88 N 2.54 3.67 -0.51 1.58 0.00 0.75 -0.09 121.76 129.70 3g6j s ALA 88 Ca 0.13 -0.24 0.03 0.00 0.00 0.00 0.00 51.96 51.88 3g6j s ALA 88 Cb -0.15 -2.40 0.14 0.00 0.00 0.00 0.00 23.12 20.70 3g6j s ALA 88 CO -0.16 0.41 0.28 0.99 0.00 0.00 0.00 175.76 177.28 3g6j s THR 89 N -0.80 2.20 -0.58 0.00 2.01 0.10 -0.25 115.64 118.33 3g6j s THR 89 Ca 0.23 -3.16 -0.28 0.00 0.31 0.00 0.00 61.69 58.80 3g6j s THR 89 Cb -0.16 -2.52 0.02 0.00 0.01 0.00 0.00 72.50 69.84 3g6j s THR 89 CO 0.12 -0.86 1.37 -0.36 -0.69 0.00 0.00 174.62 174.21 3g6j s PHE 90 N -0.19 2.33 0.00 4.92 0.08 0.59 -2.43 117.98 123.29 3g6j s PHE 90 Ca 0.18 0.43 0.00 0.00 0.12 0.00 0.00 56.93 57.66 3g6j s PHE 90 Cb -0.23 -4.43 0.00 0.00 -0.57 0.00 0.00 43.02 37.79 3g6j s PHE 90 CO -0.02 -1.92 0.00 0.41 -0.10 0.00 0.00 175.22 173.59 3g6j n GLY 91 N 5.24 0.32 0.08 4.36 0.00 0.21 -0.67 105.19 114.73 3g6j n GLY 91 Ca 0.11 0.66 -0.08 0.00 0.00 0.00 0.00 46.02 46.71 3g6j n GLY 91 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3g6j n THR 92 N 0.00 1.07 -2.34 2.61 5.66 -1.26 -4.98 114.28 115.03 3g6j n THR 92 Ca 0.00 -0.65 -0.42 0.00 -3.05 0.00 0.00 64.05 59.93 3g6j n THR 92 Cb 0.00 -0.62 -0.03 0.00 -1.55 0.00 0.00 70.33 68.13 3g6j n THR 92 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 3g6j s GLN 93 N -2.38 4.34 -0.12 1.09 2.00 0.16 -5.02 119.66 119.74 3g6j s GLN 93 Ca -0.09 1.83 -0.09 0.00 -2.00 0.00 0.00 55.36 55.01 3g6j s GLN 93 Cb 0.05 -3.49 -0.04 0.00 0.80 0.00 0.00 33.01 30.33 3g6j s GLN 93 CO 0.62 -0.44 0.19 0.54 -0.50 0.00 0.00 175.29 175.70 3g6j s VAL 94 N 1.90 5.40 -0.04 1.34 0.11 -1.26 -0.30 120.40 127.55 3g6j s VAL 94 Ca 0.60 0.33 0.01 0.00 -2.93 0.00 0.00 61.98 59.99 3g6j s VAL 94 Cb -0.29 -3.48 0.02 0.00 -1.53 0.00 0.00 36.38 31.10 3g6j s VAL 94 CO 0.26 0.56 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.84 3g6j s VAL 95 N -0.61 0.63 0.11 2.04 1.01 0.66 -4.91 120.40 119.32 3g6j s VAL 95 Ca 0.15 -0.19 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 3g6j s VAL 95 Cb -0.13 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 3g6j s VAL 95 CO 0.04 0.24 0.01 -1.83 0.00 0.00 0.00 175.10 173.56 3g6j s GLU 96 N 0.81 0.85 -0.27 2.72 -1.05 -1.26 -0.18 118.70 120.32 3g6j s GLU 96 Ca -0.12 -1.38 -0.16 0.00 -0.15 0.00 0.00 54.97 53.16 3g6j s GLU 96 Cb -0.14 0.11 0.08 0.00 -0.44 0.00 0.00 34.13 33.74 3g6j s GLU 96 CO 0.01 -0.17 0.67 0.21 0.95 0.00 0.00 175.26 176.93 3g6j s LYS 97 N -3.97 0.69 0.07 -4.83 2.47 -0.44 -4.97 119.74 108.76 3g6j s LYS 97 Ca 0.18 1.17 -0.27 0.00 -1.56 0.00 0.00 55.97 55.49 3g6j s LYS 97 Cb 0.07 0.15 -0.06 0.00 -1.46 0.00 0.00 37.83 36.54 3g6j s LYS 97 CO -0.02 -0.15 0.84 0.08 0.16 0.00 0.00 175.35 176.27 3g6j s VAL 98 N 1.50 4.65 -0.04 4.02 1.01 -1.26 -1.84 120.40 128.43 3g6j s VAL 98 Ca -0.09 1.81 0.03 0.00 0.00 0.00 0.00 61.98 63.72 3g6j s VAL 98 Cb -0.05 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3g6j s VAL 98 CO -0.18 0.34 -0.12 -0.69 0.00 0.00 0.00 175.10 174.45 3g6j s VAL 99 N -0.01 1.09 0.16 2.92 1.01 -1.04 -4.89 120.40 119.63 3g6j s VAL 99 Ca 0.42 -0.50 -0.31 0.00 0.00 0.00 0.00 61.98 61.58 3g6j s VAL 99 Cb -0.22 -0.96 -0.11 0.00 0.00 0.00 0.00 36.38 35.09 3g6j s VAL 99 CO 0.26 0.33 1.78 -0.22 0.00 0.00 0.00 175.10 177.25 3g6j s LEU 100 N 0.31 4.39 -0.18 3.92 2.96 -1.25 -2.48 118.68 126.35 3g6j s LEU 100 Ca -0.07 2.80 -0.08 0.00 -0.22 0.00 0.00 54.13 56.56 3g6j s LEU 100 Cb -0.12 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 3g6j s LEU 100 CO 0.02 -0.99 0.10 -0.69 -1.32 0.00 0.00 176.35 173.47 3g6j s VAL 101 N 2.09 5.16 -0.04 1.68 1.01 0.17 -2.39 120.40 128.08 3g6j s VAL 101 Ca 0.78 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.75 3g6j s VAL 101 Cb -0.47 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 3g6j s VAL 101 CO 0.34 0.48 0.29 -0.55 0.00 0.00 0.00 175.10 175.67 3g6j s SER 102 N 0.09 6.60 0.00 3.32 0.15 -0.75 -4.15 113.70 118.96 3g6j s SER 102 Ca 0.08 0.71 0.28 0.00 0.70 0.00 0.00 55.95 57.72 3g6j s SER 102 Cb -0.12 -2.16 1.20 0.00 -1.71 0.00 0.00 66.02 63.24 3g6j s SER 102 CO -0.00 0.33 1.83 0.18 1.20 0.00 0.00 173.24 176.78 3g6j n LEU 103 N 1.69 1.16 -4.65 3.45 7.99 -1.26 -3.69 117.00 121.70 3g6j n LEU 103 Ca -0.15 -0.40 -0.42 0.00 -0.01 0.00 0.00 56.01 55.02 3g6j n LEU 103 Cb 0.53 -0.01 -0.03 0.00 -0.11 0.00 0.00 43.42 43.81 3g6j n LEU 103 CO 0.36 0.20 1.48 -1.10 -1.51 0.00 0.00 177.39 176.82 3g6j s GLN 104 N -1.98 4.06 -0.11 3.23 1.11 -1.26 -4.55 119.66 120.15 3g6j s GLN 104 Ca 0.39 2.27 -0.06 0.00 0.01 0.00 0.00 55.36 57.97 3g6j s GLN 104 Cb 0.21 -4.08 -0.05 0.00 -1.01 0.00 0.00 33.01 28.07 3g6j s GLN 104 CO 0.33 -1.02 0.14 0.77 0.01 0.00 0.00 175.29 175.52 3g6j h SER 105 N 10.40 0.00 0.00 5.90 0.02 -1.89 -3.35 113.55 124.63 3g6j h SER 105 Ca -0.42 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 3g6j h SER 105 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 3g6j h SER 105 CO 0.95 0.63 0.00 0.61 -1.14 0.00 0.00 176.83 177.89 3g6j n GLY 106 N 1.73 3.21 2.93 -3.77 0.00 -1.26 -4.41 105.19 103.62 3g6j n GLY 106 Ca -0.03 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 3g6j n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g6j s TYR 107 N 0.94 0.30 -0.11 1.61 2.02 0.10 -4.85 117.35 117.37 3g6j s TYR 107 Ca 0.00 -0.09 0.02 0.00 -0.37 0.00 0.00 57.07 56.63 3g6j s TYR 107 Cb 0.00 -0.19 0.01 0.00 -0.40 0.00 0.00 41.96 41.38 3g6j s TYR 107 CO 0.00 -0.02 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.28 3g6j s LEU 108 N -0.20 1.85 -0.01 -1.29 1.43 -1.26 -2.13 118.68 117.07 3g6j s LEU 108 Ca 0.00 -0.47 0.06 0.00 -1.03 0.00 0.00 54.13 52.70 3g6j s LEU 108 Cb -0.02 -1.18 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 3g6j s LEU 108 CO -0.00 0.05 -0.21 -0.36 0.23 0.00 0.00 176.35 176.07 3g6j s PHE 109 N 0.80 2.49 -0.18 0.29 0.08 -1.02 -4.86 117.98 115.58 3g6j s PHE 109 Ca -0.10 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.65 3g6j s PHE 109 Cb -0.16 -1.53 0.03 0.00 -0.57 0.00 0.00 43.02 40.80 3g6j s PHE 109 CO 0.01 0.10 -0.15 0.42 -0.10 0.00 0.00 175.22 175.50 3g6j s ILE 110 N -0.73 1.81 -0.18 0.64 1.01 -1.26 -0.89 121.20 121.60 3g6j s ILE 110 Ca 0.11 -0.94 -0.09 0.00 0.00 0.00 0.00 60.65 59.74 3g6j s ILE 110 Cb -0.10 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 3g6j s ILE 110 CO 0.01 0.36 0.12 -1.58 0.00 0.00 0.00 174.94 173.85 3g6j s GLN 111 N 1.36 4.04 -0.07 2.79 0.74 -0.62 -4.85 119.66 123.05 3g6j s GLN 111 Ca 0.02 -0.23 0.01 0.00 0.05 0.00 0.00 55.36 55.21 3g6j s GLN 111 Cb -0.14 -3.35 -0.03 0.00 1.10 0.00 0.00 33.01 30.59 3g6j s GLN 111 CO -0.10 0.37 -0.09 0.95 -0.55 0.00 0.00 175.29 175.86 3g6j s THR 112 N 0.15 3.49 0.23 -0.34 -4.23 -1.26 -1.61 115.64 112.08 3g6j s THR 112 Ca 0.08 -0.55 -0.06 0.00 -1.18 0.00 0.00 61.69 59.98 3g6j s THR 112 Cb -0.11 -2.42 0.20 0.00 1.34 0.00 0.00 72.50 71.50 3g6j s THR 112 CO -0.01 0.59 1.82 -2.24 -0.54 0.00 0.00 174.62 174.23 3g6j h ASP 113 N 5.47 0.67 -1.74 3.99 2.03 -1.60 -3.42 116.42 121.81 3g6j h ASP 113 Ca -0.45 0.04 -0.63 0.00 -0.73 0.00 0.00 57.03 55.26 3g6j h ASP 113 Cb 1.17 -0.10 -0.13 0.00 -0.83 0.00 0.00 39.33 39.44 3g6j h ASP 113 CO 0.53 0.41 -0.62 -0.54 -1.03 0.00 0.00 179.24 177.98 3g6j s LYS 114 N -6.05 1.92 0.08 4.15 1.02 -1.26 -4.90 119.74 114.70 3g6j s LYS 114 Ca -0.13 -2.07 0.22 0.00 0.02 0.00 0.00 55.97 54.02 3g6j s LYS 114 Cb 0.18 -1.65 -0.12 0.00 -0.52 0.00 0.00 37.83 35.73 3g6j s LYS 114 CO 0.78 -0.01 0.83 0.25 -0.92 0.00 0.00 175.35 176.28 3g6j n THR 115 N -0.93 0.28 -4.01 2.17 -2.24 -1.26 -4.96 114.28 103.33 3g6j n THR 115 Ca -0.05 -0.45 -0.08 0.00 -2.27 0.00 0.00 64.05 61.19 3g6j n THR 115 Cb 0.66 -0.07 -0.10 0.00 -2.10 0.00 0.00 70.33 68.72 3g6j n THR 115 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 3g6j s ILE 116 N -3.38 0.15 -0.05 2.28 2.07 -1.26 -2.41 121.20 118.59 3g6j s ILE 116 Ca -0.02 -1.23 -0.15 0.00 -1.41 0.00 0.00 60.65 57.83 3g6j s ILE 116 Cb 0.12 -0.77 0.03 0.00 0.13 0.00 0.00 42.46 41.97 3g6j s ILE 116 CO 0.84 -0.68 0.36 -0.31 -1.91 0.00 0.00 174.94 173.23 3g6j s TYR 117 N -2.44 -0.28 0.35 3.50 2.02 0.03 -4.94 117.35 115.59 3g6j s TYR 117 Ca -0.07 0.55 -0.01 0.00 -0.37 0.00 0.00 57.07 57.17 3g6j s TYR 117 Cb -0.03 0.13 -0.04 0.00 -0.40 0.00 0.00 41.96 41.63 3g6j s TYR 117 CO -0.04 -0.35 0.57 0.95 -1.57 0.00 0.00 175.55 175.10 3g6j s THR 118 N -0.86 5.08 0.32 -0.71 -4.23 -1.25 -1.63 115.64 112.36 3g6j s THR 118 Ca -0.09 -0.32 -0.29 0.00 -1.18 0.00 0.00 61.69 59.81 3g6j s THR 118 Cb -0.04 -3.84 -0.12 0.00 1.34 0.00 0.00 72.50 69.84 3g6j s THR 118 CO 0.04 -0.54 1.34 -2.65 -0.54 0.00 0.00 174.62 172.26 3g6j n PRO 119 N -1.67 2.17 0.00 3.99 -0.02 -1.26 -2.87 135.00 135.33 3g6j n PRO 119 Ca -0.04 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3g6j n PRO 119 Cb 0.56 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3g6j n PRO 119 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g6j n GLY 120 N 1.09 3.31 3.93 -1.23 0.00 -0.67 -4.88 105.19 106.74 3g6j n GLY 120 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 3g6j n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6j s SER 121 N -0.84 3.90 -0.17 1.61 1.04 -1.14 -4.69 113.70 113.42 3g6j s SER 121 Ca 0.00 0.39 -0.04 0.00 0.48 0.00 0.00 55.95 56.78 3g6j s SER 121 Cb 0.00 -0.69 -0.02 0.00 0.10 0.00 0.00 66.02 65.41 3g6j s SER 121 CO 0.00 -2.23 -0.03 -0.89 0.98 0.00 0.00 173.24 171.07 3g6j s THR 122 N -3.63 3.82 -0.23 2.02 2.01 -1.26 -0.76 115.64 117.61 3g6j s THR 122 Ca 0.68 -0.37 -0.23 0.00 0.31 0.00 0.00 61.69 62.07 3g6j s THR 122 Cb -0.07 -2.69 -0.01 0.00 0.01 0.00 0.00 72.50 69.73 3g6j s THR 122 CO 0.50 0.47 0.76 -0.69 -0.69 0.00 0.00 174.62 174.96 3g6j s VAL 123 N 0.67 4.90 -0.17 3.82 1.01 -0.51 -4.94 120.40 125.17 3g6j s VAL 123 Ca -0.02 1.42 -0.08 0.00 0.00 0.00 0.00 61.98 63.31 3g6j s VAL 123 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 3g6j s VAL 123 CO 0.02 -0.01 0.08 -0.76 0.00 0.00 0.00 175.10 174.43 3g6j s LEU 124 N 2.57 3.94 -0.02 3.92 1.43 -1.26 -1.75 118.68 127.51 3g6j s LEU 124 Ca 0.32 0.16 -0.10 0.00 -1.03 0.00 0.00 54.13 53.48 3g6j s LEU 124 Cb -0.16 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.09 3g6j s LEU 124 CO 0.09 0.21 0.22 -0.72 0.23 0.00 0.00 176.35 176.38 3g6j s TYR 125 N 0.14 -0.08 0.06 0.29 -0.85 -0.37 -1.30 117.35 115.23 3g6j s TYR 125 Ca 0.06 0.12 0.09 0.00 -0.52 0.00 0.00 57.07 56.82 3g6j s TYR 125 Cb -0.12 0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.21 3g6j s TYR 125 CO 0.00 -0.31 -0.24 1.03 -1.52 0.00 0.00 175.55 174.51 3g6j s ARG 126 N -1.16 1.81 -0.19 -3.49 0.52 -0.63 -0.29 118.95 115.52 3g6j s ARG 126 Ca -0.12 -1.12 -0.02 0.00 -0.52 0.00 0.00 55.73 53.95 3g6j s ARG 126 Cb -0.06 -2.02 -0.00 0.00 0.52 0.00 0.00 34.95 33.39 3g6j s ARG 126 CO 0.02 0.51 -0.10 0.42 0.02 0.00 0.00 175.30 176.17 3g6j s ILE 127 N -0.87 2.96 -0.22 1.52 1.01 -0.25 -1.59 121.20 123.75 3g6j s ILE 127 Ca 0.13 -0.65 -0.15 0.00 0.00 0.00 0.00 60.65 59.98 3g6j s ILE 127 Cb -0.10 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 3g6j s ILE 127 CO 0.03 0.48 0.36 -0.36 0.00 0.00 0.00 174.94 175.45 3g6j s PHE 128 N 1.16 3.33 -0.29 3.97 0.08 -0.07 -1.32 117.98 124.85 3g6j s PHE 128 Ca 0.01 0.52 -0.04 0.00 0.12 0.00 0.00 56.93 57.54 3g6j s PHE 128 Cb -0.14 -2.51 0.03 0.00 -0.57 0.00 0.00 43.02 39.83 3g6j s PHE 128 CO -0.03 -0.06 0.02 0.95 -0.10 0.00 0.00 175.22 176.00 3g6j s THR 129 N 1.47 3.36 0.07 0.64 -4.23 -0.97 -2.44 115.64 113.54 3g6j s THR 129 Ca 0.17 -1.06 0.01 0.00 -1.18 0.00 0.00 61.69 59.63 3g6j s THR 129 Cb -0.15 -2.81 -0.04 0.00 1.34 0.00 0.00 72.50 70.84 3g6j s THR 129 CO 0.08 0.01 -0.06 0.68 -0.54 0.00 0.00 174.62 174.79 3g6j s VAL 130 N 1.37 0.53 0.07 2.29 -7.23 -0.90 -1.74 120.40 114.78 3g6j s VAL 130 Ca -0.01 -1.63 -0.01 0.00 -1.81 0.00 0.00 61.98 58.52 3g6j s VAL 130 Cb -0.18 -1.29 0.02 0.00 0.56 0.00 0.00 36.38 35.49 3g6j s VAL 130 CO -0.00 -0.75 0.10 -0.46 -0.31 0.00 0.00 175.10 173.67 3g6j n ASN 131 N 0.47 0.03 0.01 4.85 0.23 -0.16 0.03 115.26 120.72 3g6j n ASN 131 Ca -0.16 -1.05 0.08 0.00 -0.53 0.00 0.00 54.58 52.92 3g6j n ASN 131 Cb 0.59 -0.07 0.33 0.00 -2.08 0.00 0.00 39.78 38.55 3g6j n ASN 131 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 3g6j n HIS 132 N -2.01 0.08 1.37 -2.53 8.25 -1.26 -1.47 115.22 117.65 3g6j n HIS 132 Ca 0.01 0.03 0.09 0.00 -0.26 0.00 0.00 57.72 57.60 3g6j n HIS 132 Cb 0.04 -0.55 0.37 0.00 1.12 0.00 0.00 29.99 30.97 3g6j n HIS 132 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3g6j n LYS 133 N -1.58 1.56 -3.26 -0.41 5.02 -1.26 -4.92 118.16 113.32 3g6j n LYS 133 Ca 0.03 -0.85 -0.23 0.00 -2.02 0.00 0.00 58.31 55.24 3g6j n LYS 133 Cb 0.18 -1.34 0.02 0.00 -0.02 0.00 0.00 35.03 33.86 3g6j n LYS 133 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3g6j n LEU 134 N 0.09 -2.14 -4.56 -0.35 4.77 -0.54 -5.01 117.00 109.25 3g6j n LEU 134 Ca 0.14 -0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 55.44 3g6j n LEU 134 Cb 0.26 -2.54 -0.11 0.00 -2.33 0.00 0.00 43.42 38.70 3g6j n LEU 134 CO 0.11 0.22 -0.41 -0.76 -1.33 0.00 0.00 177.39 175.22 3g6j s LEU 135 N -6.65 3.03 0.26 2.23 1.43 -1.26 -4.89 118.68 112.83 3g6j s LEU 135 Ca 0.38 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.92 3g6j s LEU 135 Cb -0.19 -1.78 -0.10 0.00 0.03 0.00 0.00 46.19 44.16 3g6j s LEU 135 CO 0.47 0.24 1.32 -2.16 0.23 0.00 0.00 176.35 176.45 3g6j s PRO 136 N -1.67 4.37 0.35 1.29 0.04 -1.26 -0.99 135.00 137.14 3g6j s PRO 136 Ca 0.18 2.14 0.09 0.00 0.04 0.00 0.00 61.00 63.45 3g6j s PRO 136 Cb -0.11 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.23 3g6j s PRO 136 CO 0.09 -0.23 -0.07 0.54 0.04 0.00 0.00 177.00 177.37 3g6j s VAL 137 N -0.45 2.23 -0.81 -0.36 0.11 -0.71 -4.82 120.40 115.59 3g6j s VAL 137 Ca 0.54 -2.16 0.01 0.00 -2.93 0.00 0.00 61.98 57.44 3g6j s VAL 137 Cb -0.38 -2.71 0.20 0.00 -1.53 0.00 0.00 36.38 31.96 3g6j s VAL 137 CO 0.45 -0.17 0.68 0.61 -3.33 0.00 0.00 175.10 173.34 3g6j n GLY 138 N -0.83 4.14 1.74 6.54 0.00 -1.26 -4.10 105.19 111.42 3g6j n GLY 138 Ca -0.05 -2.61 -0.10 0.00 0.00 0.00 0.00 46.02 43.26 3g6j n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j n ARG 139 N 2.05 0.98 -3.94 1.61 1.74 -1.26 -4.50 116.66 113.35 3g6j n ARG 139 Ca 0.22 -1.49 -0.35 0.00 -0.77 0.00 0.00 57.85 55.46 3g6j n ARG 139 Cb 0.36 0.04 -0.14 0.00 -1.02 0.00 0.00 32.46 31.70 3g6j n ARG 139 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3g6j s THR 140 N -0.95 3.11 0.10 0.55 2.01 -1.26 -0.61 115.64 118.59 3g6j s THR 140 Ca 0.20 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.46 3g6j s THR 140 Cb -0.02 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.97 3g6j s THR 140 CO 0.13 0.33 0.26 -0.69 -0.69 0.00 0.00 174.62 173.95 3g6j s VAL 141 N 1.41 5.34 -0.11 3.82 1.01 0.42 -1.46 120.40 130.83 3g6j s VAL 141 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.59 3g6j s VAL 141 Cb -0.15 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 3g6j s VAL 141 CO -0.04 0.05 -0.10 -0.32 0.00 0.00 0.00 175.10 174.69 3g6j s MET 142 N -2.76 3.13 -0.04 2.72 1.75 -0.38 -2.33 119.30 121.40 3g6j s MET 142 Ca 0.36 -0.62 0.06 0.00 -1.25 0.00 0.00 55.69 54.23 3g6j s MET 142 Cb -0.12 -2.63 -0.01 0.00 2.84 0.00 0.00 34.83 34.90 3g6j s MET 142 CO 0.28 0.40 -0.20 0.08 -0.65 0.00 0.00 175.02 174.93 3g6j s VAL 143 N -0.12 1.66 -0.15 10.11 1.01 -0.43 -1.85 120.40 130.63 3g6j s VAL 143 Ca -0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 3g6j s VAL 143 Cb -0.13 -1.40 0.05 0.00 0.00 0.00 0.00 36.38 34.90 3g6j s VAL 143 CO 0.03 0.47 0.01 0.20 0.00 0.00 0.00 175.10 175.81 3g6j s ASN 144 N -0.21 2.53 0.11 3.32 -0.87 0.26 -1.35 114.94 118.73 3g6j s ASN 144 Ca 0.01 -0.59 -0.23 0.00 -1.57 0.00 0.00 52.86 50.48 3g6j s ASN 144 Cb -0.11 -0.61 -0.07 0.00 -0.02 0.00 0.00 41.25 40.44 3g6j s ASN 144 CO 0.01 -0.25 0.71 -0.63 -2.57 0.00 0.00 177.10 174.37 3g6j s ILE 145 N 1.85 4.55 -0.08 0.60 1.01 -0.76 -0.31 121.20 128.06 3g6j s ILE 145 Ca 0.01 1.53 -0.03 0.00 0.00 0.00 0.00 60.65 62.16 3g6j s ILE 145 Cb -0.15 -4.06 0.04 0.00 0.01 0.00 0.00 42.46 38.31 3g6j s ILE 145 CO -0.07 0.50 0.15 -0.70 0.00 0.00 0.00 174.94 174.83 3g6j s GLU 146 N -0.93 0.04 1.03 2.79 2.12 -0.34 -2.02 118.70 121.40 3g6j s GLU 146 Ca 0.34 0.52 -0.12 0.00 0.36 0.00 0.00 54.97 56.06 3g6j s GLU 146 Cb -0.21 -0.26 0.21 0.00 0.26 0.00 0.00 34.13 34.12 3g6j s GLU 146 CO 0.23 -0.28 1.08 0.54 -0.54 0.00 0.00 175.26 176.29 3g6j s ASN 147 N 2.08 2.26 0.45 -1.70 4.22 -0.80 -1.54 114.94 119.91 3g6j s ASN 147 Ca 0.01 1.29 0.23 0.00 -2.14 0.00 0.00 52.86 52.25 3g6j s ASN 147 Cb -0.12 -1.98 1.23 0.00 1.28 0.00 0.00 41.25 41.66 3g6j s ASN 147 CO -0.06 -3.37 1.84 -0.65 -2.04 0.00 0.00 177.10 172.82 3g6j h PRO 148 N -2.06 0.26 -0.56 3.55 0.11 -1.92 -0.97 132.00 130.41 3g6j h PRO 148 Ca -0.56 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.54 3g6j h PRO 148 Cb 1.33 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3g6j h PRO 148 CO 0.56 0.17 0.00 -0.85 -0.21 0.00 0.00 178.00 177.67 3g6j n GLU 149 N -4.45 4.83 -1.04 1.05 0.28 -1.26 -4.91 120.64 115.13 3g6j n GLU 149 Ca 0.21 -3.16 0.00 0.00 -0.16 0.00 0.00 57.16 54.05 3g6j n GLU 149 Cb 0.86 -2.25 0.00 0.00 1.43 0.00 0.00 31.44 31.48 3g6j n GLU 149 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g6j n GLY 150 N 0.58 0.70 3.45 -1.84 0.00 -0.37 -5.05 105.19 102.67 3g6j n GLY 150 Ca 0.28 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 3g6j n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g6j s ILE 151 N -2.00 4.75 0.72 -0.61 -1.09 -1.25 -4.90 121.20 116.81 3g6j s ILE 151 Ca 0.00 -0.41 -0.16 0.00 -2.23 0.00 0.00 60.65 57.85 3g6j s ILE 151 Cb 0.00 -3.45 -0.00 0.00 -1.58 0.00 0.00 42.46 37.43 3g6j s ILE 151 CO 0.00 0.03 0.90 -2.65 -1.23 0.00 0.00 174.94 171.98 3g6j n PRO 152 N 5.01 0.48 0.00 2.79 -0.02 -1.26 -1.91 135.00 140.09 3g6j n PRO 152 Ca -0.13 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3g6j n PRO 152 Cb 0.49 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3g6j n PRO 152 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3g6j n VAL 153 N -2.47 0.00 -4.81 -1.45 0.24 -0.86 -4.87 118.33 104.12 3g6j n VAL 153 Ca 0.13 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.16 3g6j n VAL 153 Cb 0.49 -0.16 -0.15 0.00 -1.47 0.00 0.00 33.84 32.56 3g6j n VAL 153 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3g6j s LYS 154 N -1.35 1.51 0.01 7.34 2.20 -1.25 -5.05 119.74 123.15 3g6j s LYS 154 Ca 0.00 -0.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.77 3g6j s LYS 154 Cb 0.00 -1.55 -0.01 0.00 -1.51 0.00 0.00 37.83 34.76 3g6j s LYS 154 CO 0.00 0.41 -0.02 -0.65 -0.36 0.00 0.00 175.35 174.73 3g6j s GLN 155 N -0.86 0.14 0.12 4.03 -0.21 -1.26 -1.82 119.66 119.81 3g6j s GLN 155 Ca 0.08 -0.23 0.01 0.00 0.02 0.00 0.00 55.36 55.24 3g6j s GLN 155 Cb -0.08 -0.00 -0.04 0.00 1.00 0.00 0.00 33.01 33.88 3g6j s GLN 155 CO 0.01 -0.01 -0.03 -0.51 -2.12 0.00 0.00 175.29 172.63 3g6j s ASP 156 N -0.52 1.05 -0.29 5.90 1.01 -0.46 -4.99 116.67 118.37 3g6j s ASP 156 Ca -0.05 -1.08 0.01 0.00 0.71 0.00 0.00 52.55 52.13 3g6j s ASP 156 Cb -0.04 0.13 0.15 0.00 1.01 0.00 0.00 42.92 44.17 3g6j s ASP 156 CO -0.00 -0.53 0.35 -0.55 0.21 0.00 0.00 175.17 174.64 3g6j s SER 157 N -3.08 1.06 0.17 0.27 0.15 -1.26 -1.31 113.70 109.70 3g6j s SER 157 Ca 0.17 -0.61 0.02 0.00 0.70 0.00 0.00 55.95 56.22 3g6j s SER 157 Cb 0.06 0.79 -0.05 0.00 -1.71 0.00 0.00 66.02 65.11 3g6j s SER 157 CO -0.01 -0.37 0.00 -0.76 1.20 0.00 0.00 173.24 173.30 3g6j s LEU 158 N 2.41 2.11 -0.04 3.45 2.01 -0.98 -5.00 118.68 122.65 3g6j s LEU 158 Ca 0.10 -1.17 0.05 0.00 0.01 0.00 0.00 54.13 53.11 3g6j s LEU 158 Cb -0.13 -0.06 -0.02 0.00 0.01 0.00 0.00 46.19 45.99 3g6j s LEU 158 CO -0.31 -0.57 -0.18 -0.55 1.01 0.00 0.00 176.35 175.75 3g6j s SER 159 N -3.18 3.68 -0.35 2.29 0.15 -1.26 -0.43 113.70 114.60 3g6j s SER 159 Ca 0.24 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.60 3g6j s SER 159 Cb 0.06 -0.71 0.33 0.00 -1.71 0.00 0.00 66.02 63.99 3g6j s SER 159 CO 0.04 0.33 1.83 -1.54 1.20 0.00 0.00 173.24 175.10 3g6j n SER 160 N 2.40 5.37 -4.77 5.45 3.41 0.22 -4.93 113.62 120.78 3g6j n SER 160 Ca -0.17 -3.13 -0.38 0.00 -0.26 0.00 0.00 58.87 54.94 3g6j n SER 160 Cb 0.52 -0.90 -0.04 0.00 -0.26 0.00 0.00 64.21 63.53 3g6j n SER 160 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3g6j s GLN 161 N -2.18 4.26 -1.62 4.33 2.00 -1.26 -3.40 119.66 121.80 3g6j s GLN 161 Ca 0.37 1.64 -0.14 0.00 -2.00 0.00 0.00 55.36 55.22 3g6j s GLN 161 Cb 0.30 -2.72 0.12 0.00 0.80 0.00 0.00 33.01 31.50 3g6j s GLN 161 CO 0.02 -0.08 0.75 0.09 -0.50 0.00 0.00 175.29 175.58 3g6j n ASN 162 N 0.27 -3.01 0.00 6.67 5.03 -1.26 -4.84 115.26 118.11 3g6j n ASN 162 Ca 0.03 -0.97 0.00 0.00 0.87 0.00 0.00 54.58 54.51 3g6j n ASN 162 Cb 0.48 -3.01 0.00 0.00 -1.02 0.00 0.00 39.78 36.23 3g6j n ASN 162 CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 3g6j n GLN 163 N -4.44 3.88 -1.75 3.52 -0.06 -1.22 -5.01 117.38 112.30 3g6j n GLN 163 Ca -0.00 0.00 -0.21 0.00 -2.00 0.00 0.00 57.00 54.79 3g6j n GLN 163 Cb 0.53 -0.28 -0.07 0.00 -4.06 0.00 0.00 30.24 26.36 3g6j n GLN 163 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 3g6j n LEU 164 N -0.56 -1.59 -3.09 1.69 7.99 -1.26 -3.17 117.00 117.02 3g6j n LEU 164 Ca 0.00 0.41 -0.20 0.00 -0.01 0.00 0.00 56.01 56.21 3g6j n LEU 164 Cb 0.00 -2.85 0.07 0.00 -0.11 0.00 0.00 43.42 40.53 3g6j n LEU 164 CO 0.00 -0.91 0.21 0.61 -1.51 0.00 0.00 177.39 175.79 3g6j n GLY 165 N -0.55 -0.30 2.77 -0.72 0.00 -1.26 -4.86 105.19 100.26 3g6j n GLY 165 Ca -0.21 0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 3g6j n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6j s VAL 166 N -3.27 0.59 -0.37 1.61 1.01 -1.19 -2.29 120.40 116.50 3g6j s VAL 166 Ca 0.49 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.94 3g6j s VAL 166 Cb -0.22 -0.98 0.04 0.00 0.00 0.00 0.00 36.38 35.22 3g6j s VAL 166 CO 0.61 -0.07 0.17 -0.76 0.00 0.00 0.00 175.10 175.06 3g6j s LEU 167 N 1.84 4.64 -0.16 3.92 1.43 -0.43 -4.96 118.68 124.96 3g6j s LEU 167 Ca 0.00 -1.15 -0.22 0.00 -1.03 0.00 0.00 54.13 51.73 3g6j s LEU 167 Cb -0.16 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.08 3g6j s LEU 167 CO -0.07 -0.39 0.66 -2.16 0.23 0.00 0.00 176.35 174.62 3g6j s PRO 168 N 1.47 4.29 0.21 1.29 0.04 -1.26 -1.09 135.00 139.93 3g6j s PRO 168 Ca 0.01 0.72 -0.03 0.00 0.04 0.00 0.00 61.00 61.74 3g6j s PRO 168 Cb -0.20 -3.54 -0.04 0.00 0.04 0.00 0.00 34.50 30.77 3g6j s PRO 168 CO 0.04 -0.15 0.18 -0.51 0.04 0.00 0.00 177.00 176.60 3g6j s LEU 169 N 1.58 1.04 0.29 -3.56 1.43 0.60 -5.01 118.68 115.05 3g6j s LEU 169 Ca 0.32 -1.33 -0.17 0.00 -1.03 0.00 0.00 54.13 51.92 3g6j s LEU 169 Cb -0.16 0.57 0.02 0.00 0.03 0.00 0.00 46.19 46.65 3g6j s LEU 169 CO 0.12 -0.88 0.65 -0.94 0.23 0.00 0.00 176.35 175.53 3g6j s SER 170 N -3.14 -0.13 -0.30 2.29 1.04 -1.26 -1.24 113.70 110.96 3g6j s SER 170 Ca 0.37 -0.81 -0.12 0.00 0.48 0.00 0.00 55.95 55.87 3g6j s SER 170 Cb 0.06 0.70 0.13 0.00 0.10 0.00 0.00 66.02 67.01 3g6j s SER 170 CO 0.12 -1.33 0.74 0.86 0.98 0.00 0.00 173.24 174.60 3g6j s TRP 171 N -3.70 -1.15 -0.32 5.02 -0.00 -0.72 -5.00 118.94 113.07 3g6j s TRP 171 Ca 0.16 2.03 -0.29 0.00 -0.00 0.00 0.00 56.10 58.00 3g6j s TRP 171 Cb -0.04 0.69 0.01 0.00 -0.00 0.00 0.00 33.47 34.12 3g6j s TRP 171 CO 0.09 -0.57 1.26 -0.51 -0.00 0.00 0.00 176.95 177.21 3g6j s ASP 172 N 2.60 6.71 -0.04 5.86 1.01 -1.26 -1.43 116.67 130.12 3g6j s ASP 172 Ca -0.06 1.13 -0.30 0.00 0.71 0.00 0.00 52.55 54.03 3g6j s ASP 172 Cb -0.10 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 3g6j s ASP 172 CO -0.19 -1.06 1.36 -0.63 0.21 0.00 0.00 175.17 174.86 3g6j s ILE 173 N 4.28 3.89 0.84 0.77 1.01 0.06 -4.99 121.20 127.06 3g6j s ILE 173 Ca 0.54 1.22 -0.11 0.00 0.00 0.00 0.00 60.65 62.30 3g6j s ILE 173 Cb -0.15 -3.79 0.10 0.00 0.01 0.00 0.00 42.46 38.63 3g6j s ILE 173 CO 0.22 -0.03 1.10 -2.16 0.00 0.00 0.00 174.94 174.08 3g6j s PRO 174 N 2.64 1.69 -0.03 2.79 0.04 -1.26 -1.67 135.00 139.21 3g6j s PRO 174 Ca 0.62 1.13 -0.18 0.00 0.04 0.00 0.00 61.00 62.61 3g6j s PRO 174 Cb -0.29 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 3g6j s PRO 174 CO 0.24 -2.03 0.78 0.93 0.04 0.00 0.00 177.00 176.96 3g6j h GLU 175 N -1.41 -0.52 -5.42 4.56 4.39 -1.92 -3.15 114.58 111.10 3g6j h GLU 175 Ca -0.46 0.04 -0.66 0.00 0.34 0.00 0.00 59.36 58.62 3g6j h GLU 175 Cb 1.25 0.12 -0.15 0.00 -0.10 0.00 0.00 28.75 29.88 3g6j h GLU 175 CO 0.50 -0.28 1.12 -0.51 -1.16 0.00 0.00 179.01 178.68 3g6j s LEU 176 N -9.19 4.47 0.09 1.33 1.43 -1.26 -4.64 118.68 110.91 3g6j s LEU 176 Ca -0.10 -1.87 0.01 0.00 -1.03 0.00 0.00 54.13 51.14 3g6j s LEU 176 Cb 0.01 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 3g6j s LEU 176 CO 0.32 -1.21 -0.05 0.54 0.23 0.00 0.00 176.35 176.18 3g6j s VAL 177 N 3.50 0.54 0.68 -1.59 0.11 -1.26 -5.15 120.40 117.23 3g6j s VAL 177 Ca 0.38 -1.90 -0.15 0.00 -2.93 0.00 0.00 61.98 57.38 3g6j s VAL 177 Cb -0.03 -1.66 0.01 0.00 -1.53 0.00 0.00 36.38 33.18 3g6j s VAL 177 CO -0.09 -0.89 1.16 0.20 -3.33 0.00 0.00 175.10 172.15 3g6j s ASN 178 N -3.01 4.74 -0.18 3.54 0.02 -1.26 -5.03 114.94 113.76 3g6j s ASN 178 Ca 0.11 2.19 0.00 0.00 -1.02 0.00 0.00 52.86 54.14 3g6j s ASN 178 Cb 0.06 -2.57 0.01 0.00 0.02 0.00 0.00 41.25 38.77 3g6j s ASN 178 CO -0.06 -1.89 -0.16 -0.32 0.02 0.00 0.00 177.10 174.69 3g6j s MET 179 N -3.92 3.12 0.00 -0.60 1.75 -1.26 -4.94 119.30 113.45 3g6j s MET 179 Ca 0.71 -0.77 0.00 0.00 -1.25 0.00 0.00 55.69 54.38 3g6j s MET 179 Cb -0.25 -2.66 0.00 0.00 2.84 0.00 0.00 34.83 34.76 3g6j s MET 179 CO 0.42 -0.14 0.00 0.41 -0.65 0.00 0.00 175.02 175.06 3g6j n GLY 180 N 4.49 -0.52 3.43 2.11 0.00 -1.08 -4.99 105.19 108.63 3g6j n GLY 180 Ca -0.20 -0.82 -0.44 0.00 0.00 0.00 0.00 46.02 44.57 3g6j n GLY 180 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6j s GLN 181 N -1.74 3.12 0.55 1.61 -1.52 -1.26 -0.90 119.66 119.52 3g6j s GLN 181 Ca 0.00 -0.95 -0.05 0.00 -1.95 0.00 0.00 55.36 52.42 3g6j s GLN 181 Cb 0.00 -4.17 -0.00 0.00 -0.22 0.00 0.00 33.01 28.62 3g6j s GLN 181 CO 0.00 -1.47 0.85 -1.58 -0.25 0.00 0.00 175.29 172.84 3g6j s TRP 182 N 3.07 3.30 0.06 0.91 0.52 -0.22 -4.12 118.94 122.47 3g6j s TRP 182 Ca 0.17 0.61 0.05 0.00 0.02 0.00 0.00 56.10 56.95 3g6j s TRP 182 Cb -0.20 -2.60 -0.03 0.00 -1.15 0.00 0.00 33.47 29.50 3g6j s TRP 182 CO 0.11 -0.66 -0.14 0.15 0.02 0.00 0.00 176.95 176.43 3g6j s LYS 183 N -4.88 0.81 -0.15 4.98 3.01 -0.59 -1.48 119.74 121.44 3g6j s LYS 183 Ca 0.52 -0.91 -0.02 0.00 -1.01 0.00 0.00 55.97 54.55 3g6j s LYS 183 Cb -0.10 -0.80 -0.02 0.00 -1.01 0.00 0.00 37.83 35.90 3g6j s LYS 183 CO 0.44 0.18 -0.09 0.42 0.51 0.00 0.00 175.35 176.81 3g6j s ILE 184 N -1.22 3.41 -0.26 2.17 1.01 -0.40 -1.20 121.20 124.72 3g6j s ILE 184 Ca -0.02 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.11 3g6j s ILE 184 Cb -0.10 -2.47 0.07 0.00 0.01 0.00 0.00 42.46 39.98 3g6j s ILE 184 CO 0.02 0.51 -0.00 -0.13 0.00 0.00 0.00 174.94 175.33 3g6j s ARG 185 N 0.41 1.38 -0.05 2.79 0.52 0.58 -1.82 118.95 122.76 3g6j s ARG 185 Ca -0.07 -1.12 0.03 0.00 -0.52 0.00 0.00 55.73 54.05 3g6j s ARG 185 Cb -0.15 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.74 3g6j s ARG 185 CO 0.04 -0.73 -0.13 0.00 0.02 0.00 0.00 175.30 174.50 3g6j s ALA 186 N 1.38 2.72 0.02 2.13 0.00 -0.40 -0.57 121.76 127.03 3g6j s ALA 186 Ca -0.00 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 50.91 3g6j s ALA 186 Cb -0.18 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 21.92 3g6j s ALA 186 CO -0.10 0.55 0.18 1.52 0.00 0.00 0.00 175.76 177.91 3g6j s TYR 187 N -0.73 0.03 0.43 0.00 -0.85 -0.77 -0.83 117.35 114.63 3g6j s TYR 187 Ca 0.11 -0.17 -0.25 0.00 -0.52 0.00 0.00 57.07 56.25 3g6j s TYR 187 Cb -0.11 -0.03 -0.08 0.00 0.38 0.00 0.00 41.96 42.12 3g6j s TYR 187 CO 0.01 -0.36 1.22 0.71 -1.52 0.00 0.00 175.55 175.61 3g6j s TYR 188 N -1.92 2.88 0.31 -3.49 1.51 -1.26 -1.25 117.35 114.13 3g6j s TYR 188 Ca -0.10 1.50 0.07 0.00 -1.01 0.00 0.00 57.07 57.52 3g6j s TYR 188 Cb -0.04 -3.50 0.83 0.00 -0.11 0.00 0.00 41.96 39.14 3g6j s TYR 188 CO -0.01 -1.71 1.70 1.49 -1.11 0.00 0.00 175.55 175.92 3g6j h GLU 189 N 2.39 0.44 0.00 -0.62 4.81 -1.59 -0.95 114.58 119.06 3g6j h GLU 189 Ca -0.49 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 3g6j h GLU 189 Cb 1.25 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3g6j h GLU 189 CO 0.61 0.29 0.00 0.09 -0.73 0.00 0.00 179.01 179.28 3g6j n ASN 190 N -4.99 0.73 -3.01 1.04 4.13 -1.26 -4.38 115.26 107.52 3g6j n ASN 190 Ca 0.25 0.60 -0.21 0.00 1.68 0.00 0.00 54.58 56.90 3g6j n ASN 190 Cb 0.73 -0.79 -0.03 0.00 -1.54 0.00 0.00 39.78 38.15 3g6j n ASN 190 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3g6j n SER 191 N -2.22 2.46 0.12 6.41 7.64 -0.36 -4.94 113.62 122.72 3g6j n SER 191 Ca 0.05 -3.27 0.07 0.00 1.01 0.00 0.00 58.87 56.72 3g6j n SER 191 Cb 0.36 -0.58 0.36 0.00 -1.01 0.00 0.00 64.21 63.34 3g6j n SER 191 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3g6j n PRO 192 N 0.01 0.09 0.04 1.43 -0.02 -1.25 -0.87 135.00 134.42 3g6j n PRO 192 Ca 0.27 0.55 -0.03 0.00 -2.02 0.00 0.00 63.50 62.27 3g6j n PRO 192 Cb 0.58 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 32.06 3g6j n PRO 192 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3g6j h GLN 193 N 0.00 0.00 -4.84 -0.52 -0.00 -1.93 -3.41 115.11 104.41 3g6j h GLN 193 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 58.65 57.94 3g6j h GLN 193 Cb 0.25 0.00 -0.18 0.00 -0.00 0.00 0.00 27.48 27.55 3g6j h GLN 193 CO 0.00 0.45 0.99 -1.14 -0.00 0.00 0.00 178.83 179.13 3g6j s GLN 194 N -2.82 3.80 -0.18 0.06 0.74 -0.05 -5.01 119.66 116.20 3g6j s GLN 194 Ca -0.02 -2.13 -0.07 0.00 0.05 0.00 0.00 55.36 53.19 3g6j s GLN 194 Cb 0.08 -4.94 -0.04 0.00 1.10 0.00 0.00 33.01 29.21 3g6j s GLN 194 CO 0.81 -1.74 0.06 0.08 -0.55 0.00 0.00 175.29 173.94 3g6j s VAL 195 N 2.07 4.73 -0.11 1.34 1.01 -1.26 -4.46 120.40 123.72 3g6j s VAL 195 Ca 0.36 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 3g6j s VAL 195 Cb -0.04 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 3g6j s VAL 195 CO -0.06 0.46 0.05 -0.36 0.00 0.00 0.00 175.10 175.19 3g6j s PHE 196 N 0.35 3.29 0.36 5.22 0.40 -0.01 -4.96 117.98 122.63 3g6j s PHE 196 Ca 0.03 0.26 0.09 0.00 -0.60 0.00 0.00 56.93 56.70 3g6j s PHE 196 Cb -0.12 -1.87 -0.07 0.00 0.51 0.00 0.00 43.02 41.47 3g6j s PHE 196 CO 0.00 0.49 -0.05 -1.12 0.70 0.00 0.00 175.22 175.24 3g6j s SER 197 N -0.73 3.85 -0.29 1.36 0.01 -1.26 -1.27 113.70 115.37 3g6j s SER 197 Ca 0.12 -1.20 -0.14 0.00 1.31 0.00 0.00 55.95 56.04 3g6j s SER 197 Cb -0.12 -0.39 0.11 0.00 0.21 0.00 0.00 66.02 65.83 3g6j s SER 197 CO 0.02 -0.27 0.71 -0.89 0.41 0.00 0.00 173.24 173.22 3g6j s THR 198 N -2.62 -0.37 0.16 1.44 2.01 -0.76 -4.77 115.64 110.73 3g6j s THR 198 Ca 0.34 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 62.17 3g6j s THR 198 Cb 0.04 -1.00 -0.07 0.00 0.01 0.00 0.00 72.50 71.48 3g6j s THR 198 CO 0.17 0.00 0.60 -1.61 -0.69 0.00 0.00 174.62 173.09 3g6j s GLU 199 N 2.10 4.07 -0.02 4.92 2.02 -1.26 -1.27 118.70 129.26 3g6j s GLU 199 Ca -0.08 0.62 0.01 0.00 0.02 0.00 0.00 54.97 55.54 3g6j s GLU 199 Cb -0.07 -2.94 0.01 0.00 0.10 0.00 0.00 34.13 31.22 3g6j s GLU 199 CO -0.19 0.47 -0.04 -0.59 0.02 0.00 0.00 175.26 174.92 3g6j s PHE 200 N -1.45 0.52 0.20 1.61 -0.12 -0.55 -4.83 117.98 113.36 3g6j s PHE 200 Ca 0.39 -0.10 -0.25 0.00 -0.05 0.00 0.00 56.93 56.92 3g6j s PHE 200 Cb -0.16 -0.42 -0.08 0.00 -0.63 0.00 0.00 43.02 41.73 3g6j s PHE 200 CO 0.20 -0.07 0.80 -2.00 -0.05 0.00 0.00 175.22 174.09 3g6j s GLU 201 N 0.33 4.52 -0.03 1.99 2.12 -1.01 -1.05 118.70 125.56 3g6j s GLU 201 Ca -0.04 1.14 0.06 0.00 0.36 0.00 0.00 54.97 56.49 3g6j s GLU 201 Cb -0.07 -3.13 -0.02 0.00 0.26 0.00 0.00 34.13 31.17 3g6j s GLU 201 CO -0.00 0.50 -0.20 0.08 -0.54 0.00 0.00 175.26 175.10 3g6j s VAL 202 N -1.29 2.60 -0.20 3.70 1.01 -0.08 -0.79 120.40 125.36 3g6j s VAL 202 Ca 0.39 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 61.14 3g6j s VAL 202 Cb -0.21 -1.98 0.15 0.00 0.00 0.00 0.00 36.38 34.34 3g6j s VAL 202 CO 0.25 0.57 1.17 -0.75 0.00 0.00 0.00 175.10 176.34 3g6j s LYS 203 N -0.72 0.35 -0.28 2.72 2.20 -0.65 -2.63 119.74 120.73 3g6j s LYS 203 Ca 0.11 0.01 -0.19 0.00 -0.36 0.00 0.00 55.97 55.54 3g6j s LYS 203 Cb -0.10 0.16 -0.02 0.00 -1.51 0.00 0.00 37.83 36.36 3g6j s LYS 203 CO 0.00 -0.12 0.59 -1.21 -0.36 0.00 0.00 175.35 174.25 3g6j s GLU 204 N -1.52 4.01 0.29 4.03 2.02 -1.26 -3.86 118.70 122.41 3g6j s GLU 204 Ca 0.05 0.37 -0.17 0.00 0.02 0.00 0.00 54.97 55.24 3g6j s GLU 204 Cb -0.01 -3.68 0.02 0.00 0.10 0.00 0.00 34.13 30.56 3g6j s GLU 204 CO -0.04 -0.46 0.65 1.52 0.02 0.00 0.00 175.26 176.95 3g6j s TYR 205 N 2.48 0.10 0.02 1.61 -0.85 -1.26 -5.13 117.35 114.32 3g6j s TYR 205 Ca 0.24 -0.55 0.02 0.00 -0.52 0.00 0.00 57.07 56.26 3g6j s TYR 205 Cb -0.15 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.70 3g6j s TYR 205 CO 0.10 -1.22 -0.08 0.14 -1.52 0.00 0.00 175.55 172.97 3g6j s VAL 206 N -3.63 0.59 0.23 -3.49 -7.23 -1.26 -5.02 120.40 100.59 3g6j s VAL 206 Ca 0.16 -0.74 -0.32 0.00 -1.81 0.00 0.00 61.98 59.27 3g6j s VAL 206 Cb -0.04 -0.58 -0.13 0.00 0.56 0.00 0.00 36.38 36.20 3g6j s VAL 206 CO 0.09 -0.13 1.57 0.18 -0.31 0.00 0.00 175.10 176.51 3g6j n LEU 207 N 2.10 3.65 -4.80 1.32 4.32 -1.26 -4.98 117.00 117.35 3g6j n LEU 207 Ca -0.18 1.11 -0.30 0.00 -0.02 0.00 0.00 56.01 56.62 3g6j n LEU 207 Cb 0.56 -1.51 0.10 0.00 -1.62 0.00 0.00 43.42 40.95 3g6j n LEU 207 CO 0.23 -0.11 0.71 -2.16 -1.22 0.00 0.00 177.39 174.83 3g6j s PRO 208 N 0.24 1.92 0.08 3.23 0.05 -1.26 -4.98 135.00 134.28 3g6j s PRO 208 Ca 0.71 0.62 0.25 0.00 0.05 0.00 0.00 61.00 62.63 3g6j s PRO 208 Cb -0.58 -1.90 0.47 0.00 0.05 0.00 0.00 34.50 32.53 3g6j s PRO 208 CO 0.43 -1.73 1.40 -1.13 0.05 0.00 0.00 177.00 176.02 3g6j n SER 209 N -3.50 0.61 -3.68 6.66 3.41 -1.26 -4.83 113.62 111.02 3g6j n SER 209 Ca 0.07 0.07 -0.10 0.00 -0.26 0.00 0.00 58.87 58.65 3g6j n SER 209 Cb 0.56 0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 64.57 3g6j n SER 209 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3g6j s PHE 210 N -3.11 -0.15 0.24 7.33 -0.12 -1.26 -2.58 117.98 118.33 3g6j s PHE 210 Ca 0.08 -0.18 0.06 0.00 -0.05 0.00 0.00 56.93 56.84 3g6j s PHE 210 Cb 0.15 0.28 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 3g6j s PHE 210 CO 0.70 -0.76 0.25 -1.83 -0.05 0.00 0.00 175.22 173.52 3g6j s GLU 211 N -3.83 3.10 -0.05 1.99 -1.05 -0.37 -4.87 118.70 113.62 3g6j s GLU 211 Ca 0.05 -0.93 0.02 0.00 -0.15 0.00 0.00 54.97 53.96 3g6j s GLU 211 Cb 0.01 -2.69 0.01 0.00 -0.44 0.00 0.00 34.13 31.03 3g6j s GLU 211 CO -0.09 0.42 -0.09 0.08 0.95 0.00 0.00 175.26 176.53 3g6j s VAL 212 N -2.04 0.86 -0.10 1.83 1.01 -1.26 -2.32 120.40 118.37 3g6j s VAL 212 Ca 0.33 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.99 3g6j s VAL 212 Cb -0.08 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 3g6j s VAL 212 CO 0.26 0.29 -0.14 -0.63 0.00 0.00 0.00 175.10 174.88 3g6j s ILE 213 N 0.65 2.97 -0.27 2.22 1.01 0.73 -4.73 121.20 123.79 3g6j s ILE 213 Ca -0.11 -0.71 0.01 0.00 0.00 0.00 0.00 60.65 59.83 3g6j s ILE 213 Cb -0.14 -2.21 0.05 0.00 0.01 0.00 0.00 42.46 40.17 3g6j s ILE 213 CO 0.02 0.55 -0.07 -0.69 0.00 0.00 0.00 174.94 174.75 3g6j s VAL 214 N 0.02 2.53 -0.12 2.92 1.01 -1.26 -1.00 120.40 124.49 3g6j s VAL 214 Ca -0.05 -1.46 0.02 0.00 0.00 0.00 0.00 61.98 60.49 3g6j s VAL 214 Cb -0.14 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.81 3g6j s VAL 214 CO 0.04 -0.01 -0.17 -1.61 0.00 0.00 0.00 175.10 173.35 3g6j s GLU 215 N 1.18 2.49 0.35 2.72 8.01 -0.39 -4.72 118.70 128.34 3g6j s GLU 215 Ca -0.06 -0.66 -0.21 0.00 0.01 0.00 0.00 54.97 54.05 3g6j s GLU 215 Cb -0.19 -2.08 -0.10 0.00 -4.31 0.00 0.00 34.13 27.45 3g6j s GLU 215 CO -0.04 -0.06 0.87 -1.25 0.01 0.00 0.00 175.26 174.79 3g6j s PRO 216 N 0.96 4.27 0.31 0.39 0.05 -1.26 0.07 135.00 139.79 3g6j s PRO 216 Ca -0.06 1.03 -0.01 0.00 0.05 0.00 0.00 61.00 62.01 3g6j s PRO 216 Cb -0.15 -2.49 0.48 0.00 0.05 0.00 0.00 34.50 32.40 3g6j s PRO 216 CO -0.02 0.15 1.97 1.79 0.05 0.00 0.00 177.00 180.93 3g6j h THR 217 N 2.21 1.20 -3.54 1.26 1.35 -0.59 -3.41 112.91 111.40 3g6j h THR 217 Ca -0.48 -0.39 -0.66 0.00 -0.55 0.00 0.00 66.41 64.33 3g6j h THR 217 Cb 1.18 0.08 -0.15 0.00 -1.73 0.00 0.00 68.15 67.53 3g6j h THR 217 CO 0.64 0.20 -0.74 -1.61 -0.25 0.00 0.00 175.52 173.76 3g6j s GLU 218 N -5.84 2.14 -0.04 4.72 0.41 -1.26 -5.02 118.70 113.81 3g6j s GLU 218 Ca -0.11 -1.02 0.02 0.00 -0.41 0.00 0.00 54.97 53.45 3g6j s GLU 218 Cb 0.18 -2.31 0.12 0.00 -1.78 0.00 0.00 34.13 30.34 3g6j s GLU 218 CO 0.79 0.51 0.75 1.63 -0.49 0.00 0.00 175.26 178.44 3g6j n LYS 219 N 0.68 1.55 -3.83 1.61 5.02 -1.26 -4.83 118.16 117.11 3g6j n LYS 219 Ca -0.13 -0.48 -0.06 0.00 -2.02 0.00 0.00 58.31 55.62 3g6j n LYS 219 Cb 0.52 -1.57 0.01 0.00 -0.02 0.00 0.00 35.03 33.97 3g6j n LYS 219 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3g6j s PHE 220 N -1.18 -0.00 -0.15 2.13 -0.12 -1.26 -4.38 117.98 113.01 3g6j s PHE 220 Ca 0.08 -0.48 -0.01 0.00 -0.05 0.00 0.00 56.93 56.48 3g6j s PHE 220 Cb 0.07 0.73 0.04 0.00 -0.63 0.00 0.00 43.02 43.23 3g6j s PHE 220 CO 0.02 -1.16 -0.02 -0.47 -0.05 0.00 0.00 175.22 173.54 3g6j s TYR 221 N -2.76 1.36 -0.38 3.49 5.04 -0.23 -4.94 117.35 118.93 3g6j s TYR 221 Ca 0.16 -0.85 -0.27 0.00 -2.44 0.00 0.00 57.07 53.66 3g6j s TYR 221 Cb -0.04 -1.16 0.02 0.00 0.35 0.00 0.00 41.96 41.14 3g6j s TYR 221 CO 0.07 -0.56 0.99 -0.47 -1.34 0.00 0.00 175.55 174.24 3g6j s TYR 222 N 1.75 3.05 0.65 4.97 5.04 -1.26 -1.02 117.35 130.53 3g6j s TYR 222 Ca 0.01 0.83 0.28 0.00 -2.44 0.00 0.00 57.07 55.76 3g6j s TYR 222 Cb -0.15 -3.78 1.53 0.00 0.35 0.00 0.00 41.96 39.91 3g6j s TYR 222 CO -0.07 -0.89 1.87 -0.84 -1.34 0.00 0.00 175.55 174.28 3g6j h ILE 223 N 5.87 0.06 -0.01 3.14 3.07 -1.81 0.42 117.51 128.26 3g6j h ILE 223 Ca -0.23 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.18 3g6j h ILE 223 Cb 1.07 0.63 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 3g6j h ILE 223 CO 1.01 0.00 -0.71 -1.22 -1.05 0.00 0.00 178.15 176.19 3g6j n TYR 224 N -3.00 0.00 -1.63 0.16 4.01 -1.26 -4.86 117.16 110.58 3g6j n TYR 224 Ca -0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 3g6j n TYR 224 Cb 0.45 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.41 3g6j n TYR 224 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3g6j s ASN 225 N -2.80 5.69 0.00 7.72 3.84 0.15 -4.84 114.94 124.70 3g6j s ASN 225 Ca 0.13 2.05 0.24 0.00 0.21 0.00 0.00 52.86 55.50 3g6j s ASN 225 Cb 0.17 -2.52 0.38 0.00 -0.55 0.00 0.00 41.25 38.73 3g6j s ASN 225 CO 0.73 -1.75 1.32 -0.62 -2.79 0.00 0.00 177.10 173.99 3g6j n GLU 226 N 8.47 0.32 0.27 0.43 1.02 -1.26 -3.62 120.64 126.27 3g6j n GLU 226 Ca 0.27 -0.22 0.13 0.00 -0.02 0.00 0.00 57.16 57.32 3g6j n GLU 226 Cb 0.44 -1.50 0.74 0.00 -0.02 0.00 0.00 31.44 31.10 3g6j n GLU 226 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3g6j h LYS 227 N 0.53 0.00 0.00 3.49 1.57 -1.96 -3.41 116.57 116.78 3g6j h LYS 227 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g6j h LYS 227 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3g6j h LYS 227 CO 0.00 0.11 0.00 0.41 -0.57 0.00 0.00 179.45 179.40 3g6j n GLY 228 N -0.76 -1.80 3.36 3.86 0.00 -1.24 -4.84 105.19 103.77 3g6j n GLY 228 Ca -0.02 -1.84 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 3g6j n GLY 228 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g6j s LEU 229 N 0.00 4.34 -0.41 0.99 2.96 -0.92 -4.94 118.68 120.69 3g6j s LEU 229 Ca 0.00 -0.87 -0.19 0.00 -0.22 0.00 0.00 54.13 52.85 3g6j s LEU 229 Cb 0.00 -1.96 0.02 0.00 0.50 0.00 0.00 46.19 44.75 3g6j s LEU 229 CO 0.00 -0.30 0.52 -1.61 -1.32 0.00 0.00 176.35 173.65 3g6j s GLU 230 N 1.52 3.27 -0.02 1.98 2.02 -1.26 -1.84 118.70 124.36 3g6j s GLU 230 Ca 0.02 -0.51 -0.01 0.00 0.02 0.00 0.00 54.97 54.49 3g6j s GLU 230 Cb -0.18 -3.93 -0.04 0.00 0.10 0.00 0.00 34.13 30.08 3g6j s GLU 230 CO 0.05 -0.87 0.08 0.08 0.02 0.00 0.00 175.26 174.62 3g6j s VAL 231 N 2.43 4.76 -0.07 2.63 1.01 -0.38 0.23 120.40 131.00 3g6j s VAL 231 Ca 0.17 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.83 3g6j s VAL 231 Cb -0.16 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 3g6j s VAL 231 CO 0.15 0.39 -0.13 -0.89 0.00 0.00 0.00 175.10 174.62 3g6j s THR 232 N -1.16 3.10 -0.16 3.92 2.01 0.11 -1.86 115.64 121.60 3g6j s THR 232 Ca 0.22 -0.69 -0.05 0.00 0.31 0.00 0.00 61.69 61.48 3g6j s THR 232 Cb -0.12 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 3g6j s THR 232 CO 0.12 0.57 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.99 3g6j s ILE 233 N -0.46 4.17 -0.10 1.82 -1.09 -0.28 -1.27 121.20 123.99 3g6j s ILE 233 Ca 0.06 -0.26 0.03 0.00 -2.23 0.00 0.00 60.65 58.25 3g6j s ILE 233 Cb -0.12 -2.84 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 3g6j s ILE 233 CO 0.02 0.49 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.12 3g6j s THR 234 N 0.31 1.85 0.04 2.92 2.01 -0.17 -1.91 115.64 120.67 3g6j s THR 234 Ca -0.01 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.18 3g6j s THR 234 Cb -0.14 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.73 3g6j s THR 234 CO 0.02 0.51 -0.23 0.00 -0.69 0.00 0.00 174.62 174.24 3g6j s ALA 235 N 0.49 2.40 -0.25 7.40 0.00 -0.93 -0.19 121.76 130.69 3g6j s ALA 235 Ca -0.16 -1.22 -0.16 0.00 0.00 0.00 0.00 51.96 50.42 3g6j s ALA 235 Cb -0.17 -0.60 0.07 0.00 0.00 0.00 0.00 23.12 22.42 3g6j s ALA 235 CO 0.06 0.55 0.62 0.50 0.00 0.00 0.00 175.76 177.49 3g6j s ARG 236 N -1.27 0.65 0.58 0.00 3.52 -0.98 -3.26 118.95 118.19 3g6j s ARG 236 Ca 0.13 1.06 -0.20 0.00 -0.13 0.00 0.00 55.73 56.59 3g6j s ARG 236 Cb -0.10 0.15 -0.04 0.00 -1.56 0.00 0.00 34.95 33.40 3g6j s ARG 236 CO 0.03 -0.14 1.29 -0.06 -0.81 0.00 0.00 175.30 175.61 3g6j s PHE 237 N 1.31 2.30 0.45 5.12 0.08 0.30 -1.23 117.98 126.30 3g6j s PHE 237 Ca -0.08 1.45 0.20 0.00 0.12 0.00 0.00 56.93 58.63 3g6j s PHE 237 Cb -0.06 -3.66 1.18 0.00 -0.57 0.00 0.00 43.02 39.91 3g6j s PHE 237 CO -0.14 -2.62 1.90 -0.07 -0.10 0.00 0.00 175.22 174.19 3g6j h LEU 238 N 1.11 0.29 -0.06 -0.37 3.38 -1.82 0.02 115.31 117.87 3g6j h LEU 238 Ca -0.51 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3g6j h LEU 238 Cb 1.31 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3g6j h LEU 238 CO 0.56 0.13 0.00 0.00 0.09 0.00 0.00 178.44 179.22 3g6j n TYR 239 N -4.45 0.66 0.00 1.13 0.18 -1.26 -4.95 117.16 108.47 3g6j n TYR 239 Ca 0.16 0.20 0.00 0.00 1.88 0.00 0.00 57.90 60.14 3g6j n TYR 239 Cb 0.67 -0.82 0.00 0.00 -0.38 0.00 0.00 39.34 38.81 3g6j n TYR 239 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3g6j n GLY 240 N 1.22 3.18 3.75 -7.48 0.00 -0.01 -5.12 105.19 100.73 3g6j n GLY 240 Ca 0.06 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 3g6j n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s LYS 241 N 0.00 2.86 0.59 1.61 -0.14 -1.26 -4.56 119.74 118.84 3g6j s LYS 241 Ca 0.00 1.88 -0.17 0.00 -1.36 0.00 0.00 55.97 56.32 3g6j s LYS 241 Cb 0.00 -1.91 -0.04 0.00 -1.68 0.00 0.00 37.83 34.20 3g6j s LYS 241 CO 0.00 -1.31 1.09 0.15 -0.76 0.00 0.00 175.35 174.52 3g6j s LYS 242 N -3.36 3.24 -0.02 1.68 1.02 -1.26 -0.54 119.74 120.49 3g6j s LYS 242 Ca 0.79 1.38 -0.03 0.00 0.02 0.00 0.00 55.97 58.13 3g6j s LYS 242 Cb -0.32 -2.01 -0.04 0.00 -0.52 0.00 0.00 37.83 34.94 3g6j s LYS 242 CO 0.35 -0.90 0.14 0.08 -0.92 0.00 0.00 175.35 174.10 3g6j s VAL 243 N -2.18 5.21 -0.09 3.17 1.01 -1.20 -4.71 120.40 121.61 3g6j s VAL 243 Ca 0.67 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 3g6j s VAL 243 Cb -0.19 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 3g6j s VAL 243 CO 0.33 0.38 -0.03 -1.61 0.00 0.00 0.00 175.10 174.17 3g6j s GLU 244 N -1.74 3.00 0.00 2.72 0.41 -1.26 -1.58 118.70 120.25 3g6j s GLU 244 Ca 0.24 -0.48 0.00 0.00 -0.41 0.00 0.00 54.97 54.32 3g6j s GLU 244 Cb -0.12 -2.73 0.00 0.00 -1.78 0.00 0.00 34.13 29.50 3g6j s GLU 244 CO 0.15 0.61 0.00 0.41 -0.49 0.00 0.00 175.26 175.94 3g6j n GLY 245 N 2.40 -0.80 3.23 -1.39 0.00 -0.88 -3.49 105.19 104.25 3g6j n GLY 245 Ca -0.18 -0.87 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 3g6j n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g6j s THR 246 N -3.00 1.67 -0.06 2.61 2.01 -0.52 0.45 115.64 118.79 3g6j s THR 246 Ca 0.00 -0.95 0.05 0.00 0.31 0.00 0.00 61.69 61.10 3g6j s THR 246 Cb 0.00 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 3g6j s THR 246 CO 0.00 0.43 -0.22 0.00 -0.69 0.00 0.00 174.62 174.14 3g6j s ALA 247 N -0.54 1.95 -0.34 7.40 0.00 0.19 -0.96 121.76 129.46 3g6j s ALA 247 Ca 0.08 -0.91 -0.05 0.00 0.00 0.00 0.00 51.96 51.08 3g6j s ALA 247 Cb -0.08 -0.64 0.05 0.00 0.00 0.00 0.00 23.12 22.44 3g6j s ALA 247 CO -0.00 0.35 0.10 -0.06 0.00 0.00 0.00 175.76 176.14 3g6j s PHE 248 N 0.01 3.28 -0.06 0.00 0.08 -0.36 -1.32 117.98 119.60 3g6j s PHE 248 Ca -0.07 -1.57 -0.00 0.00 0.12 0.00 0.00 56.93 55.41 3g6j s PHE 248 Cb -0.14 -2.33 -0.03 0.00 -0.57 0.00 0.00 43.02 39.95 3g6j s PHE 248 CO 0.04 -0.76 -0.02 0.14 -0.10 0.00 0.00 175.22 174.52 3g6j s VAL 249 N 1.36 4.08 0.05 -0.44 -7.23 -0.95 -2.01 120.40 115.25 3g6j s VAL 249 Ca -0.02 -0.39 0.03 0.00 -1.81 0.00 0.00 61.98 59.79 3g6j s VAL 249 Cb -0.20 -2.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 3g6j s VAL 249 CO 0.02 0.56 -0.09 -0.51 -0.31 0.00 0.00 175.10 174.77 3g6j s ILE 250 N -0.90 0.64 0.23 -0.62 2.07 -0.10 -1.25 121.20 121.29 3g6j s ILE 250 Ca 0.14 -1.14 0.10 0.00 -1.41 0.00 0.00 60.65 58.34 3g6j s ILE 250 Cb -0.11 -0.71 -0.04 0.00 0.13 0.00 0.00 42.46 41.72 3g6j s ILE 250 CO 0.03 -0.36 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.24 3g6j s PHE 251 N -1.40 2.55 -0.16 3.50 0.08 -1.26 -0.89 117.98 120.40 3g6j s PHE 251 Ca -0.08 -0.26 -0.28 0.00 0.12 0.00 0.00 56.93 56.43 3g6j s PHE 251 Cb -0.10 -1.19 0.09 0.00 -0.57 0.00 0.00 43.02 41.26 3g6j s PHE 251 CO 0.01 0.59 0.81 0.20 -0.10 0.00 0.00 175.22 176.72 3g6j s GLY 252 N -3.22 -0.44 0.22 4.36 0.00 -0.62 -1.42 107.32 106.19 3g6j s GLY 252 Ca 0.28 1.84 -0.20 0.00 0.00 0.00 0.00 44.72 46.64 3g6j s GLY 252 CO 0.16 1.30 0.72 -0.42 0.00 0.00 0.00 173.10 174.87 3g6j s ILE 253 N -0.57 4.56 -0.23 0.90 1.09 -0.76 -0.82 121.20 125.37 3g6j s ILE 253 Ca -0.04 1.30 0.01 0.00 -1.10 0.00 0.00 60.65 60.82 3g6j s ILE 253 Cb -0.02 -3.87 0.05 0.00 -1.06 0.00 0.00 42.46 37.56 3g6j s ILE 253 CO 0.04 0.23 -0.08 -1.58 -0.10 0.00 0.00 174.94 173.44 3g6j s GLN 254 N -1.93 1.89 -0.50 2.79 0.74 0.63 -1.27 119.66 122.02 3g6j s GLN 254 Ca 0.42 -1.02 -0.17 0.00 0.05 0.00 0.00 55.36 54.64 3g6j s GLN 254 Cb -0.17 -2.60 0.07 0.00 1.10 0.00 0.00 33.01 31.41 3g6j s GLN 254 CO 0.21 -0.54 0.51 0.34 -0.55 0.00 0.00 175.29 175.26 3g6j s ASP 255 N 1.33 6.18 1.44 6.67 3.68 -1.07 -2.06 116.67 132.84 3g6j s ASP 255 Ca -0.05 -1.22 0.00 0.00 2.13 0.00 0.00 52.55 53.41 3g6j s ASP 255 Cb -0.18 -2.23 0.00 0.00 -1.45 0.00 0.00 42.92 39.06 3g6j s ASP 255 CO -0.07 -0.78 0.00 0.61 0.13 0.00 0.00 175.17 175.06 3g6j n GLY 256 N 5.20 3.21 0.10 2.66 0.00 -1.26 -1.41 105.19 113.68 3g6j n GLY 256 Ca -0.10 0.27 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 3g6j n GLY 256 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3g6j h GLU 257 N 0.00 0.19 -7.07 1.61 5.08 -2.03 -3.46 114.58 108.91 3g6j h GLU 257 Ca 0.00 -0.31 -0.55 0.00 -1.00 0.00 0.00 59.36 57.50 3g6j h GLU 257 Cb 0.00 0.11 0.13 0.00 0.50 0.00 0.00 28.75 29.50 3g6j h GLU 257 CO 0.00 1.13 0.57 -1.14 -1.00 0.00 0.00 179.01 178.56 3g6j s GLN 258 N -2.75 3.02 -0.32 2.33 0.74 -0.50 -5.03 119.66 117.14 3g6j s GLN 258 Ca -0.03 2.13 -0.00 0.00 0.05 0.00 0.00 55.36 57.51 3g6j s GLN 258 Cb 0.08 -2.13 0.13 0.00 1.10 0.00 0.00 33.01 32.19 3g6j s GLN 258 CO 0.86 -1.25 0.25 1.03 -0.55 0.00 0.00 175.29 175.63 3g6j s ARG 259 N -3.05 0.42 0.27 1.67 0.52 -1.26 -2.59 118.95 114.92 3g6j s ARG 259 Ca 0.74 -0.71 -0.29 0.00 -0.52 0.00 0.00 55.73 54.95 3g6j s ARG 259 Cb -0.38 -0.96 -0.09 0.00 0.52 0.00 0.00 34.95 34.04 3g6j s ARG 259 CO 0.43 -1.11 1.18 0.42 0.02 0.00 0.00 175.30 176.24 3g6j s ILE 260 N 1.75 3.30 0.19 1.52 -1.09 -0.40 -4.97 121.20 121.51 3g6j s ILE 260 Ca 0.13 1.25 0.05 0.00 -2.23 0.00 0.00 60.65 59.85 3g6j s ILE 260 Cb -0.17 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.88 3g6j s ILE 260 CO -0.18 0.27 0.23 -0.55 -1.23 0.00 0.00 174.94 173.48 3g6j s SER 261 N -0.51 5.90 -0.55 3.58 0.15 -1.26 -1.83 113.70 119.18 3g6j s SER 261 Ca 0.48 -0.03 0.04 0.00 0.70 0.00 0.00 55.95 57.14 3g6j s SER 261 Cb -0.34 -1.65 0.14 0.00 -1.71 0.00 0.00 66.02 62.46 3g6j s SER 261 CO 0.43 0.02 0.30 -0.76 1.20 0.00 0.00 173.24 174.43 3g6j s LEU 262 N -3.43 4.25 0.41 3.45 1.43 -0.51 -4.89 118.68 119.40 3g6j s LEU 262 Ca 0.33 -3.14 0.08 0.00 -1.03 0.00 0.00 54.13 50.38 3g6j s LEU 262 Cb -0.10 -1.58 0.86 0.00 0.03 0.00 0.00 46.19 45.40 3g6j s LEU 262 CO 0.26 -0.21 2.01 -0.65 0.23 0.00 0.00 176.35 177.99 3g6j h PRO 263 N 6.31 0.40 -0.05 1.29 0.11 -1.98 -1.34 132.00 136.74 3g6j h PRO 263 Ca -0.03 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.05 3g6j h PRO 263 Cb 0.87 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 3g6j h PRO 263 CO 0.68 0.35 0.07 1.49 -0.21 0.00 0.00 178.00 180.38 3g6j h GLU 264 N 0.40 0.00 -0.00 1.05 4.81 -1.93 -2.63 114.58 116.28 3g6j h GLU 264 Ca 0.10 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3g6j h GLU 264 Cb 0.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3g6j h GLU 264 CO -0.01 0.00 -0.27 -1.13 -0.73 0.00 0.00 179.01 176.87 3g6j n SER 265 N -3.65 0.62 -4.72 1.04 3.41 -0.50 -4.94 113.62 104.88 3g6j n SER 265 Ca -0.02 -0.48 -0.42 0.00 -0.26 0.00 0.00 58.87 57.69 3g6j n SER 265 Cb 0.16 0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 3g6j n SER 265 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g6j s LEU 266 N -2.69 4.37 0.26 1.04 2.96 -1.00 -4.62 118.68 119.00 3g6j s LEU 266 Ca 0.21 2.66 0.07 0.00 -0.22 0.00 0.00 54.13 56.84 3g6j s LEU 266 Cb 0.19 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 3g6j s LEU 266 CO 0.56 -0.84 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.14 3g6j s LYS 267 N 1.04 1.48 -0.50 1.98 -0.14 -0.38 -5.00 119.74 118.22 3g6j s LYS 267 Ca 0.70 -1.73 0.04 0.00 -1.36 0.00 0.00 55.97 53.62 3g6j s LYS 267 Cb -0.45 -1.11 0.16 0.00 -1.68 0.00 0.00 37.83 34.75 3g6j s LYS 267 CO 0.32 0.07 0.37 0.50 -0.76 0.00 0.00 175.35 175.84 3g6j s ARG 268 N -3.72 1.41 0.28 1.68 3.52 -1.26 -2.24 118.95 118.62 3g6j s ARG 268 Ca 0.28 -2.43 -0.12 0.00 -0.13 0.00 0.00 55.73 53.33 3g6j s ARG 268 Cb 0.03 -2.14 -0.08 0.00 -1.56 0.00 0.00 34.95 31.20 3g6j s ARG 268 CO 0.10 -1.32 0.64 0.96 -0.81 0.00 0.00 175.30 174.88 3g6j s ILE 269 N -0.30 4.82 0.47 4.11 -4.36 -0.44 -4.88 121.20 120.62 3g6j s ILE 269 Ca 0.27 0.67 -0.22 0.00 -0.26 0.00 0.00 60.65 61.11 3g6j s ILE 269 Cb -0.04 -3.63 -0.07 0.00 1.25 0.00 0.00 42.46 39.97 3g6j s ILE 269 CO -0.15 -0.16 1.14 -2.84 0.24 0.00 0.00 174.94 173.17 3g6j s PRO 270 N -2.99 3.72 -0.36 0.37 0.02 -1.26 -0.64 135.00 133.86 3g6j s PRO 270 Ca 0.50 1.70 -0.09 0.00 0.02 0.00 0.00 61.00 63.14 3g6j s PRO 270 Cb -0.11 -2.33 0.03 0.00 0.02 0.00 0.00 34.50 32.12 3g6j s PRO 270 CO 0.21 -0.57 0.17 0.42 -0.33 0.00 0.00 177.00 176.90 3g6j s ILE 271 N -1.62 4.26 -0.12 2.83 -1.09 0.17 -4.56 121.20 121.07 3g6j s ILE 271 Ca 0.65 -0.99 0.03 0.00 -2.23 0.00 0.00 60.65 58.11 3g6j s ILE 271 Cb -0.27 -3.40 0.01 0.00 -1.58 0.00 0.00 42.46 37.22 3g6j s ILE 271 CO 0.32 -0.22 -0.23 -1.61 -1.23 0.00 0.00 174.94 171.97 3g6j s GLU 272 N 1.49 3.04 -1.45 2.79 2.02 -0.81 -2.07 118.70 123.71 3g6j s GLU 272 Ca 0.01 -0.86 -0.07 0.00 0.02 0.00 0.00 54.97 54.06 3g6j s GLU 272 Cb -0.19 -2.39 0.03 0.00 0.10 0.00 0.00 34.13 31.68 3g6j s GLU 272 CO 0.05 0.06 0.60 -3.47 0.02 0.00 0.00 175.26 172.53 3g6j n ASP 273 N 3.85 -5.19 -0.73 -0.19 2.03 -1.26 -2.30 116.55 112.75 3g6j n ASP 273 Ca -0.20 -0.35 -0.08 0.00 0.52 0.00 0.00 54.79 54.68 3g6j n ASP 273 Cb 0.52 -4.22 -0.03 0.00 -0.72 0.00 0.00 41.12 36.68 3g6j n ASP 273 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3g6j n GLY 274 N -1.42 0.70 3.09 0.27 0.00 -0.62 -4.81 105.19 102.41 3g6j n GLY 274 Ca -0.07 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 3g6j n GLY 274 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3g6j s SER 275 N -2.82 0.18 -0.13 1.61 0.15 -0.97 -2.18 113.70 109.54 3g6j s SER 275 Ca 0.00 -0.49 -0.30 0.00 0.70 0.00 0.00 55.95 55.86 3g6j s SER 275 Cb 0.00 0.20 0.12 0.00 -1.71 0.00 0.00 66.02 64.63 3g6j s SER 275 CO 0.00 -0.45 1.00 -0.83 1.20 0.00 0.00 173.24 174.16 3g6j s GLY 276 N -1.92 -0.31 0.02 9.45 0.00 -0.80 -1.92 107.32 111.84 3g6j s GLY 276 Ca -0.08 1.75 0.06 0.00 0.00 0.00 0.00 44.72 46.45 3g6j s GLY 276 CO -0.03 0.81 -0.18 -0.54 0.00 0.00 0.00 173.10 173.15 3g6j s GLU 277 N -1.75 1.32 0.00 2.90 8.01 -1.26 -1.13 118.70 126.80 3g6j s GLU 277 Ca 0.01 -0.78 -0.08 0.00 0.01 0.00 0.00 54.97 54.13 3g6j s GLU 277 Cb -0.01 -1.35 0.00 0.00 -4.31 0.00 0.00 34.13 28.47 3g6j s GLU 277 CO -0.02 0.35 0.16 0.54 0.01 0.00 0.00 175.26 176.30 3g6j s VAL 278 N -0.65 0.08 -0.00 2.63 0.11 -0.78 -4.94 120.40 116.85 3g6j s VAL 278 Ca 0.06 -0.66 0.05 0.00 -2.93 0.00 0.00 61.98 58.50 3g6j s VAL 278 Cb -0.08 -0.45 -0.01 0.00 -1.53 0.00 0.00 36.38 34.31 3g6j s VAL 278 CO 0.01 -0.36 -0.15 -0.69 -3.33 0.00 0.00 175.10 170.57 3g6j s VAL 279 N -1.37 1.19 -0.44 2.04 1.01 -1.26 -1.25 120.40 120.31 3g6j s VAL 279 Ca -0.15 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 60.95 3g6j s VAL 279 Cb -0.07 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.34 3g6j s VAL 279 CO 0.02 0.27 0.41 -0.22 0.00 0.00 0.00 175.10 175.58 3g6j s LEU 280 N -0.51 5.12 0.47 3.92 2.96 -0.77 -4.95 118.68 124.92 3g6j s LEU 280 Ca 0.05 -0.92 -0.23 0.00 -0.22 0.00 0.00 54.13 52.82 3g6j s LEU 280 Cb -0.06 -2.28 -0.07 0.00 0.50 0.00 0.00 46.19 44.28 3g6j s LEU 280 CO -0.00 -0.59 1.18 -0.94 -1.32 0.00 0.00 176.35 174.68 3g6j s SER 281 N 2.05 6.05 0.31 3.68 1.04 -1.26 -2.17 113.70 123.40 3g6j s SER 281 Ca 0.08 2.34 0.01 0.00 0.48 0.00 0.00 55.95 58.86 3g6j s SER 281 Cb -0.19 -2.60 0.51 0.00 0.10 0.00 0.00 66.02 63.83 3g6j s SER 281 CO 0.11 -1.00 1.89 -0.09 0.98 0.00 0.00 173.24 175.13 3g6j h ARG 282 N 1.93 0.78 0.03 4.02 2.43 -1.88 -2.29 114.38 119.39 3g6j h ARG 282 Ca -0.50 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 58.55 3g6j h ARG 282 Cb 1.25 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3g6j h ARG 282 CO 0.60 0.65 -0.01 -0.22 -1.51 0.00 0.00 179.97 179.48 3g6j h LYS 283 N 0.77 -0.04 -0.51 0.20 3.64 -1.93 -0.18 116.57 118.51 3g6j h LYS 283 Ca 0.18 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.62 3g6j h LYS 283 Cb 0.18 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.98 3g6j h LYS 283 CO -0.01 0.13 0.34 0.28 -2.27 0.00 0.00 179.45 177.92 3g6j h VAL 284 N -0.20 1.00 0.15 2.00 2.07 -1.90 0.80 116.25 120.17 3g6j h VAL 284 Ca -0.00 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3g6j h VAL 284 Cb 0.19 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3g6j h VAL 284 CO 0.01 0.09 -0.07 0.25 0.02 0.00 0.00 177.57 177.87 3g6j h LEU 285 N 0.49 -0.17 -0.59 2.57 5.85 -1.14 -2.48 115.31 119.85 3g6j h LEU 285 Ca 0.22 -0.35 -0.15 0.00 0.84 0.00 0.00 57.88 58.44 3g6j h LEU 285 Cb 0.24 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3g6j h LEU 285 CO -0.06 0.30 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.78 3g6j h LEU 286 N -0.68 0.59 0.00 2.25 3.38 -0.46 -1.97 115.31 118.42 3g6j h LEU 286 Ca -0.02 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3g6j h LEU 286 Cb 0.50 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3g6j h LEU 286 CO 0.03 0.98 0.00 0.47 0.09 0.00 0.00 178.44 180.01 3g6j n ASP 287 N -3.98 0.00 0.07 -0.43 8.00 0.27 -3.00 116.55 117.48 3g6j n ASP 287 Ca -0.02 0.08 0.12 0.00 0.71 0.00 0.00 54.79 55.68 3g6j n ASP 287 Cb 0.57 -0.34 0.12 0.00 -0.02 0.00 0.00 41.12 41.45 3g6j n ASP 287 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3g6j h GLY 288 N 3.94 0.00 -3.73 0.44 0.00 -0.86 -3.47 103.07 99.39 3g6j h GLY 288 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 3g6j h GLY 288 CO 0.00 0.00 -0.74 0.14 0.00 0.00 0.00 176.54 175.94 3g6j s VAL 289 N -3.21 3.16 -1.05 4.60 1.01 -1.16 -5.04 120.40 118.71 3g6j s VAL 289 Ca 0.05 -1.55 0.26 0.00 0.00 0.00 0.00 61.98 60.73 3g6j s VAL 289 Cb 0.13 -2.53 0.06 0.00 0.00 0.00 0.00 36.38 34.04 3g6j s VAL 289 CO 0.74 -0.03 1.51 0.00 0.00 0.00 0.00 175.10 177.32 3g6j n GLN 290 N 0.31 0.06 -3.33 2.72 3.00 -1.26 -4.75 117.38 114.13 3g6j n GLN 290 Ca -0.12 -0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.42 3g6j n GLN 290 Cb 0.54 -1.50 -0.09 0.00 0.00 0.00 0.00 30.24 29.20 3g6j n GLN 290 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3g6j s ASN 291 N -2.96 6.22 0.46 1.08 4.22 -1.26 -4.97 114.94 117.73 3g6j s ASN 291 Ca 0.13 -0.31 0.31 0.00 -2.14 0.00 0.00 52.86 50.85 3g6j s ASN 291 Cb 0.18 -2.22 1.62 0.00 1.28 0.00 0.00 41.25 42.11 3g6j s ASN 291 CO 0.66 -0.45 1.96 1.55 -2.04 0.00 0.00 177.10 178.78 3g6j h PRO 292 N 8.55 0.00 -5.82 3.55 0.13 -1.92 -3.41 132.00 133.08 3g6j h PRO 292 Ca -0.28 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.48 3g6j h PRO 292 Cb 1.13 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.20 3g6j h PRO 292 CO 0.75 0.00 0.93 0.50 -0.23 0.00 0.00 178.00 179.95 3g6j s ARG 293 N -3.75 2.73 0.19 0.86 3.52 -1.26 -4.79 118.95 116.45 3g6j s ARG 293 Ca -0.02 -0.30 0.03 0.00 -0.13 0.00 0.00 55.73 55.31 3g6j s ARG 293 Cb 0.09 -5.00 0.50 0.00 -1.56 0.00 0.00 34.95 28.98 3g6j s ARG 293 CO 0.34 -3.09 0.91 0.00 -0.81 0.00 0.00 175.30 172.64 3g6j n ALA 294 N 12.95 0.35 0.30 6.12 0.00 -1.26 0.39 120.51 139.36 3g6j n ALA 294 Ca 0.36 0.62 0.19 0.00 0.00 0.00 0.00 53.44 54.60 3g6j n ALA 294 Cb 0.48 -0.48 0.85 0.00 0.00 0.00 0.00 19.45 20.30 3g6j n ALA 294 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3g6j h GLU 295 N 0.00 0.00 0.00 0.00 3.07 -1.95 -1.93 114.58 113.77 3g6j h GLU 295 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 3g6j h GLU 295 Cb 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 3g6j h GLU 295 CO -0.53 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 173.61 3g6j n ASP 296 N -2.99 0.39 0.18 1.42 4.64 0.16 -2.29 116.55 118.06 3g6j n ASP 296 Ca -0.01 0.59 0.13 0.00 -1.38 0.00 0.00 54.79 54.13 3g6j n ASP 296 Cb 0.21 -0.68 0.34 0.00 -1.04 0.00 0.00 41.12 39.95 3g6j n ASP 296 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3g6j h LEU 297 N 0.00 0.00 -9.65 -2.67 3.38 -1.47 -3.45 115.31 101.45 3g6j h LEU 297 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 3g6j h LEU 297 Cb 0.34 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.14 3g6j h LEU 297 CO 0.00 0.00 0.89 -0.69 0.09 0.00 0.00 178.44 178.73 3g6j s VAL 298 N -3.24 2.49 0.00 1.22 1.01 -0.97 -1.98 120.40 118.94 3g6j s VAL 298 Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.42 3g6j s VAL 298 Cb 0.08 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.23 3g6j s VAL 298 CO 0.61 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.35 3g6j n GLY 299 N 3.48 3.05 3.81 4.51 0.00 -1.09 -5.05 105.19 113.90 3g6j n GLY 299 Ca 0.13 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 3g6j n GLY 299 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s LYS 300 N 0.00 2.54 0.31 1.61 1.02 -0.84 -4.85 119.74 119.53 3g6j s LYS 300 Ca 0.00 0.87 0.10 0.00 0.02 0.00 0.00 55.97 56.96 3g6j s LYS 300 Cb 0.00 -1.95 -0.06 0.00 -0.52 0.00 0.00 37.83 35.30 3g6j s LYS 300 CO 0.00 -1.36 -0.14 -1.54 -0.92 0.00 0.00 175.35 171.39 3g6j s SER 301 N -3.78 3.64 -0.02 2.83 1.04 -0.87 -2.08 113.70 114.45 3g6j s SER 301 Ca 0.59 -1.12 0.02 0.00 0.48 0.00 0.00 55.95 55.92 3g6j s SER 301 Cb -0.15 -0.32 -0.03 0.00 0.10 0.00 0.00 66.02 65.62 3g6j s SER 301 CO 0.55 -0.10 -0.07 -0.76 0.98 0.00 0.00 173.24 173.84 3g6j s LEU 302 N -3.56 3.18 -0.00 2.42 1.43 0.94 -0.27 118.68 122.82 3g6j s LEU 302 Ca 0.31 -0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.37 3g6j s LEU 302 Cb -0.01 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 3g6j s LEU 302 CO 0.16 0.31 -0.19 -0.72 0.23 0.00 0.00 176.35 176.13 3g6j s TYR 303 N -0.94 1.67 0.01 0.29 -0.85 -0.00 -1.56 117.35 115.97 3g6j s TYR 303 Ca 0.16 -0.33 0.02 0.00 -0.52 0.00 0.00 57.07 56.40 3g6j s TYR 303 Cb -0.11 -1.06 -0.04 0.00 0.38 0.00 0.00 41.96 41.13 3g6j s TYR 303 CO 0.06 -0.00 0.01 0.08 -1.52 0.00 0.00 175.55 174.18 3g6j s VAL 304 N -0.52 4.22 -0.09 -3.49 1.01 0.30 -1.60 120.40 120.23 3g6j s VAL 304 Ca 0.07 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3g6j s VAL 304 Cb -0.07 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.42 3g6j s VAL 304 CO -0.00 0.34 -0.09 -0.55 0.00 0.00 0.00 175.10 174.80 3g6j s SER 305 N -1.67 1.98 -0.05 3.32 0.15 -0.07 -1.28 113.70 116.08 3g6j s SER 305 Ca 0.21 -0.29 0.06 0.00 0.70 0.00 0.00 55.95 56.62 3g6j s SER 305 Cb -0.12 -0.82 -0.01 0.00 -1.71 0.00 0.00 66.02 63.37 3g6j s SER 305 CO 0.12 -0.06 -0.23 0.00 1.20 0.00 0.00 173.24 174.27 3g6j s ALA 306 N 1.29 1.98 -0.23 5.45 0.00 -0.36 -0.92 121.76 128.97 3g6j s ALA 306 Ca -0.03 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 50.97 3g6j s ALA 306 Cb -0.14 -0.62 0.07 0.00 0.00 0.00 0.00 23.12 22.43 3g6j s ALA 306 CO -0.04 0.38 0.01 0.99 0.00 0.00 0.00 175.76 177.11 3g6j s THR 307 N -0.12 1.02 -0.22 0.00 2.01 -0.85 -1.60 115.64 115.88 3g6j s THR 307 Ca -0.03 -1.01 -0.08 0.00 0.31 0.00 0.00 61.69 60.88 3g6j s THR 307 Cb -0.13 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 3g6j s THR 307 CO 0.03 -0.26 0.08 -0.69 -0.69 0.00 0.00 174.62 173.09 3g6j s VAL 308 N 1.61 4.75 -0.17 3.82 1.01 -0.75 -1.22 120.40 129.44 3g6j s VAL 308 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 3g6j s VAL 308 Cb -0.18 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 3g6j s VAL 308 CO -0.10 0.39 -0.10 -0.63 0.00 0.00 0.00 175.10 174.66 3g6j s ILE 309 N 0.92 3.08 0.97 2.22 1.01 -0.13 -2.07 121.20 127.20 3g6j s ILE 309 Ca 0.05 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 59.96 3g6j s ILE 309 Cb -0.14 -2.34 0.18 0.00 0.01 0.00 0.00 42.46 40.18 3g6j s ILE 309 CO 0.03 0.49 1.12 -0.76 0.00 0.00 0.00 174.94 175.82 3g6j s LEU 310 N 0.86 2.38 0.35 2.97 1.43 -1.02 -1.44 118.68 124.21 3g6j s LEU 310 Ca -0.03 2.04 0.14 0.00 -1.03 0.00 0.00 54.13 55.25 3g6j s LEU 310 Cb -0.15 -4.31 0.63 0.00 0.03 0.00 0.00 46.19 42.39 3g6j s LEU 310 CO 0.00 -3.36 1.75 0.45 0.23 0.00 0.00 176.35 175.42 3g6j h HIS 311 N -2.05 0.00 -0.31 0.29 3.86 -1.91 -2.80 115.15 112.23 3g6j h HIS 311 Ca -0.47 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.65 3g6j h HIS 311 Cb 1.28 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.74 3g6j h HIS 311 CO 0.45 0.44 -0.18 0.66 0.86 0.00 0.00 177.93 180.17 3g6j h SER 312 N 0.00 0.56 0.00 2.45 4.64 -1.91 -3.47 113.55 115.82 3g6j h SER 312 Ca -0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3g6j h SER 312 Cb 0.83 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 3g6j h SER 312 CO 0.06 0.75 0.00 0.61 -0.87 0.00 0.00 176.83 177.37 3g6j n GLY 313 N -0.47 0.75 0.23 -0.77 0.00 -1.06 -4.95 105.19 98.91 3g6j n GLY 313 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3g6j n GLY 313 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3g6j h SER 314 N 0.00 0.00 -5.00 1.61 0.02 -1.91 -3.46 113.55 104.81 3g6j h SER 314 Ca 0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 3g6j h SER 314 Cb 0.00 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.39 3g6j h SER 314 CO 0.00 0.00 0.18 -0.62 -1.14 0.00 0.00 176.83 175.25 3g6j s ASP 315 N -6.06 -0.59 -0.01 3.07 2.15 -1.26 -5.10 116.67 108.88 3g6j s ASP 315 Ca 0.06 0.30 -0.16 0.00 0.43 0.00 0.00 52.55 53.18 3g6j s ASP 315 Cb 0.06 0.56 0.03 0.00 -0.30 0.00 0.00 42.92 43.27 3g6j s ASP 315 CO 0.64 -0.80 0.34 0.00 -0.17 0.00 0.00 175.17 175.18 3g6j s MET 316 N -2.61 0.70 0.13 4.34 0.23 -1.26 -2.43 119.30 118.41 3g6j s MET 316 Ca -0.04 -0.18 0.05 0.00 -1.03 0.00 0.00 55.69 54.49 3g6j s MET 316 Cb -0.01 0.31 -0.04 0.00 -1.53 0.00 0.00 34.83 33.57 3g6j s MET 316 CO -0.03 -0.20 -0.11 0.14 -2.03 0.00 0.00 175.02 172.80 3g6j s VAL 317 N -1.38 1.15 -0.09 5.16 -7.23 -0.88 -5.00 120.40 112.14 3g6j s VAL 317 Ca -0.13 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.13 3g6j s VAL 317 Cb -0.05 -1.72 0.00 0.00 0.56 0.00 0.00 36.38 35.18 3g6j s VAL 317 CO 0.04 -0.67 -0.21 -1.58 -0.31 0.00 0.00 175.10 172.38 3g6j s GLN 318 N -3.43 2.64 0.16 4.82 2.00 -1.26 -1.81 119.66 122.77 3g6j s GLN 318 Ca 0.14 -0.74 0.05 0.00 -2.00 0.00 0.00 55.36 52.81 3g6j s GLN 318 Cb 0.01 -2.03 -0.04 0.00 0.80 0.00 0.00 33.01 31.74 3g6j s GLN 318 CO 0.01 0.14 -0.11 0.00 -0.50 0.00 0.00 175.29 174.83 3g6j s ALA 319 N 0.42 1.57 0.08 1.58 0.00 -0.62 -4.97 121.76 119.82 3g6j s ALA 319 Ca -0.17 -1.52 -0.10 0.00 0.00 0.00 0.00 51.96 50.16 3g6j s ALA 319 Cb -0.17 0.02 0.01 0.00 0.00 0.00 0.00 23.12 22.97 3g6j s ALA 319 CO 0.07 -0.06 0.23 -1.83 0.00 0.00 0.00 175.76 174.18 3g6j s GLU 320 N -3.70 0.85 -0.16 0.00 -1.05 -1.26 -1.22 118.70 112.15 3g6j s GLU 320 Ca 0.18 -0.82 -0.02 0.00 -0.15 0.00 0.00 54.97 54.16 3g6j s GLU 320 Cb 0.02 0.35 0.05 0.00 -0.44 0.00 0.00 34.13 34.11 3g6j s GLU 320 CO 0.02 -0.28 0.00 0.50 0.95 0.00 0.00 175.26 176.45 3g6j s ARG 321 N -3.49 0.88 0.47 -4.83 6.06 -0.41 -4.90 118.95 112.73 3g6j s ARG 321 Ca 0.02 -0.34 0.05 0.00 -2.50 0.00 0.00 55.73 52.95 3g6j s ARG 321 Cb 0.03 -1.84 -0.03 0.00 0.06 0.00 0.00 34.95 33.17 3g6j s ARG 321 CO -0.09 -0.51 0.09 -1.54 -2.50 0.00 0.00 175.30 170.75 3g6j s SER 322 N 1.81 4.18 -1.09 -2.12 1.04 -1.26 -0.54 113.70 115.72 3g6j s SER 322 Ca 0.01 -1.40 -0.04 0.00 0.48 0.00 0.00 55.95 55.00 3g6j s SER 322 Cb -0.16 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.00 3g6j s SER 322 CO -0.07 -0.70 0.93 0.61 0.98 0.00 0.00 173.24 174.99 3g6j n GLY 323 N -1.23 -0.29 3.54 7.32 0.00 -1.23 -4.96 105.19 108.35 3g6j n GLY 323 Ca -0.09 0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 3g6j n GLY 323 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g6j s ILE 324 N -3.29 4.78 0.26 -0.61 1.01 -0.60 -4.93 121.20 117.82 3g6j s ILE 324 Ca 0.24 0.41 -0.30 0.00 0.00 0.00 0.00 60.65 61.00 3g6j s ILE 324 Cb -0.11 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 38.06 3g6j s ILE 324 CO 0.62 -0.55 1.09 -2.84 0.00 0.00 0.00 174.94 173.27 3g6j s PRO 325 N 2.97 4.65 -0.18 2.79 0.02 -1.26 -0.04 135.00 143.95 3g6j s PRO 325 Ca 0.26 1.78 -0.22 0.00 0.02 0.00 0.00 61.00 62.84 3g6j s PRO 325 Cb -0.13 -3.21 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 3g6j s PRO 325 CO 0.19 0.21 0.69 0.42 -0.33 0.00 0.00 177.00 178.18 3g6j s ILE 326 N -1.05 4.98 0.04 2.83 1.01 -0.89 -1.07 121.20 127.06 3g6j s ILE 326 Ca 0.45 1.33 0.00 0.00 0.00 0.00 0.00 60.65 62.43 3g6j s ILE 326 Cb -0.31 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.12 3g6j s ILE 326 CO 0.40 0.10 -0.04 0.68 0.00 0.00 0.00 174.94 176.08 3g6j s VAL 327 N 1.88 0.25 -0.13 2.92 -7.23 -0.19 -2.68 120.40 115.23 3g6j s VAL 327 Ca 0.32 -1.29 0.19 0.00 -1.81 0.00 0.00 61.98 59.38 3g6j s VAL 327 Cb -0.16 -0.81 -0.24 0.00 0.56 0.00 0.00 36.38 35.73 3g6j s VAL 327 CO 0.11 -0.67 0.43 0.35 -0.31 0.00 0.00 175.10 175.01 3g6j n THR 328 N 0.99 0.93 -4.49 5.32 -2.24 -1.26 -2.14 114.28 111.38 3g6j n THR 328 Ca -0.20 -0.70 -0.23 0.00 -2.27 0.00 0.00 64.05 60.65 3g6j n THR 328 Cb 0.57 -0.42 -0.14 0.00 -2.10 0.00 0.00 70.33 68.25 3g6j n THR 328 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3g6j s SER 329 N -5.31 2.07 0.00 3.42 0.15 -1.26 -4.18 113.70 108.60 3g6j s SER 329 Ca -0.07 -0.49 0.22 0.00 0.70 0.00 0.00 55.95 56.31 3g6j s SER 329 Cb 0.09 -0.16 1.11 0.00 -1.71 0.00 0.00 66.02 65.36 3g6j s SER 329 CO 0.85 0.10 1.73 -2.65 1.20 0.00 0.00 173.24 174.46 3g6j n PRO 330 N 1.87 0.29 -4.65 5.44 -0.02 -1.26 -4.87 135.00 131.80 3g6j n PRO 330 Ca -0.18 0.08 -0.29 0.00 -2.02 0.00 0.00 63.50 61.09 3g6j n PRO 330 Cb 0.54 -1.50 -0.08 0.00 -0.02 0.00 0.00 33.50 32.44 3g6j n PRO 330 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3g6j s TYR 331 N -2.61 1.88 -0.29 6.00 2.02 -1.26 -4.07 117.35 119.01 3g6j s TYR 331 Ca 0.20 -1.06 -0.06 0.00 -0.37 0.00 0.00 57.07 55.77 3g6j s TYR 331 Cb 0.15 -1.44 0.15 0.00 -0.40 0.00 0.00 41.96 40.42 3g6j s TYR 331 CO 0.35 0.03 0.60 -1.14 -1.57 0.00 0.00 175.55 173.82 3g6j s GLN 332 N -3.80 0.54 -0.20 -0.62 0.74 -0.17 -4.79 119.66 111.36 3g6j s GLN 332 Ca 0.16 1.23 -0.12 0.00 0.05 0.00 0.00 55.36 56.67 3g6j s GLN 332 Cb 0.03 0.66 -0.05 0.00 1.10 0.00 0.00 33.01 34.75 3g6j s GLN 332 CO 0.09 -0.36 0.24 0.42 -0.55 0.00 0.00 175.29 175.13 3g6j s ILE 333 N 2.84 5.32 -0.02 -2.34 1.01 -1.26 -0.70 121.20 126.06 3g6j s ILE 333 Ca 0.04 0.40 0.06 0.00 0.00 0.00 0.00 60.65 61.15 3g6j s ILE 333 Cb -0.13 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 3g6j s ILE 333 CO -0.19 0.36 -0.19 -1.00 0.00 0.00 0.00 174.94 173.92 3g6j s HIS 334 N 0.77 1.71 -0.33 3.97 3.76 0.16 -4.86 115.29 120.47 3g6j s HIS 334 Ca 0.13 -0.35 0.08 0.00 -0.15 0.00 0.00 55.06 54.76 3g6j s HIS 334 Cb -0.13 -1.11 0.56 0.00 1.11 0.00 0.00 32.58 33.00 3g6j s HIS 334 CO 0.03 -0.05 1.59 1.19 -0.85 0.00 0.00 174.74 176.66 3g6j n PHE 335 N 2.70 1.65 0.96 1.40 3.72 -1.26 -0.96 117.46 125.66 3g6j n PHE 335 Ca -0.15 -1.66 0.13 0.00 -0.05 0.00 0.00 57.45 55.72 3g6j n PHE 335 Cb 0.53 -0.62 0.46 0.00 -0.94 0.00 0.00 39.48 38.91 3g6j n PHE 335 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3g6j n THR 336 N -1.11 0.05 0.28 4.37 -2.24 -1.26 -3.24 114.28 111.13 3g6j n THR 336 Ca 0.41 -0.03 0.08 0.00 -2.27 0.00 0.00 64.05 62.23 3g6j n THR 336 Cb 1.22 -0.23 0.13 0.00 -2.10 0.00 0.00 70.33 69.35 3g6j n THR 336 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3g6j n LYS 337 N -1.57 1.88 -4.61 -0.78 5.02 -1.26 -4.79 118.16 112.04 3g6j n LYS 337 Ca 0.06 -1.80 -0.34 0.00 -2.02 0.00 0.00 58.31 54.22 3g6j n LYS 337 Cb 0.35 -1.34 -0.12 0.00 -0.02 0.00 0.00 35.03 33.90 3g6j n LYS 337 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3g6j s THR 338 N -1.19 3.63 0.42 -0.18 -1.32 -1.20 -4.81 115.64 110.99 3g6j s THR 338 Ca 0.25 -0.49 -0.26 0.00 -1.21 0.00 0.00 61.69 59.98 3g6j s THR 338 Cb 0.15 -2.51 -0.10 0.00 -1.51 0.00 0.00 72.50 68.53 3g6j s THR 338 CO 0.21 0.56 1.41 -2.65 -2.21 0.00 0.00 174.62 171.95 3g6j n PRO 339 N 2.70 2.32 -0.24 7.08 -0.02 -1.26 -4.67 135.00 140.90 3g6j n PRO 339 Ca -0.18 0.82 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 3g6j n PRO 339 Cb 0.53 -2.58 0.21 0.00 -0.02 0.00 0.00 33.50 31.63 3g6j n PRO 339 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3g6j n LYS 340 N 0.09 2.11 -4.23 -0.52 4.76 -1.26 -4.89 118.16 114.21 3g6j n LYS 340 Ca 0.04 -1.69 -0.18 0.00 -2.87 0.00 0.00 58.31 53.61 3g6j n LYS 340 Cb 0.40 -1.37 -0.13 0.00 -1.84 0.00 0.00 35.03 32.09 3g6j n LYS 340 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3g6j s TYR 341 N -1.39 1.08 0.28 2.13 2.02 -1.26 -1.17 117.35 119.04 3g6j s TYR 341 Ca 0.31 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.65 3g6j s TYR 341 Cb 0.16 -0.63 -0.06 0.00 -0.40 0.00 0.00 41.96 41.04 3g6j s TYR 341 CO 0.21 0.02 0.03 -0.59 -1.57 0.00 0.00 175.55 173.65 3g6j s PHE 342 N -1.03 1.79 -0.39 2.71 -0.12 -0.71 -4.85 117.98 115.36 3g6j s PHE 342 Ca -0.02 -0.94 -0.08 0.00 -0.05 0.00 0.00 56.93 55.85 3g6j s PHE 342 Cb -0.09 -1.10 0.07 0.00 -0.63 0.00 0.00 43.02 41.28 3g6j s PHE 342 CO 0.01 -0.01 0.21 0.15 -0.05 0.00 0.00 175.22 175.53 3g6j s LYS 343 N -3.88 2.55 -0.05 1.99 3.01 -1.26 -0.04 119.74 122.07 3g6j s LYS 343 Ca 0.33 -1.40 -0.40 0.00 -1.01 0.00 0.00 55.97 53.49 3g6j s LYS 343 Cb 0.07 -3.66 -0.19 0.00 -1.01 0.00 0.00 37.83 33.04 3g6j s LYS 343 CO 0.13 -0.87 1.26 -2.30 0.51 0.00 0.00 175.35 174.07 3g6j n PRO 344 N 4.86 0.43 -0.03 -1.68 -0.02 -1.26 -1.44 135.00 135.85 3g6j n PRO 344 Ca -0.10 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 3g6j n PRO 344 Cb 0.43 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 3g6j n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g6j n GLY 345 N 2.30 0.47 3.41 -1.23 0.00 -1.14 -4.58 105.19 104.41 3g6j n GLY 345 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3g6j n GLY 345 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3g6j s MET 346 N -0.85 1.51 0.13 1.61 0.00 -0.52 -4.79 119.30 116.39 3g6j s MET 346 Ca 0.00 -1.30 -0.31 0.00 0.00 0.00 0.00 55.69 54.08 3g6j s MET 346 Cb 0.00 -1.95 -0.08 0.00 0.00 0.00 0.00 34.83 32.80 3g6j s MET 346 CO 0.00 0.46 1.39 -2.14 0.00 0.00 0.00 175.02 174.73 3g6j s PRO 347 N -2.02 4.32 -0.31 4.11 0.02 -1.26 -3.77 135.00 136.08 3g6j s PRO 347 Ca 0.15 2.09 -0.27 0.00 0.02 0.00 0.00 61.00 62.99 3g6j s PRO 347 Cb -0.10 -3.24 0.01 0.00 0.02 0.00 0.00 34.50 31.20 3g6j s PRO 347 CO 0.07 -0.43 0.98 0.12 -0.33 0.00 0.00 177.00 177.41 3g6j s PHE 348 N 0.99 3.17 -0.75 6.54 5.36 0.17 -4.83 117.98 128.63 3g6j s PHE 348 Ca 0.64 1.07 -0.20 0.00 -0.96 0.00 0.00 56.93 57.48 3g6j s PHE 348 Cb -0.37 -3.53 0.11 0.00 -0.34 0.00 0.00 43.02 38.88 3g6j s PHE 348 CO 0.31 -0.70 0.95 -0.51 -1.46 0.00 0.00 175.22 173.82 3g6j s ASP 349 N 1.64 6.37 -0.40 6.13 1.01 -1.26 -0.53 116.67 129.62 3g6j s ASP 349 Ca 0.41 -1.55 -0.28 0.00 0.71 0.00 0.00 52.55 51.84 3g6j s ASP 349 Cb -0.13 -2.38 0.02 0.00 1.01 0.00 0.00 42.92 41.45 3g6j s ASP 349 CO 0.14 -1.19 1.04 -0.22 0.21 0.00 0.00 175.17 175.15 3g6j s LEU 350 N 3.08 3.85 -0.76 1.23 0.20 0.23 -4.84 118.68 121.67 3g6j s LEU 350 Ca 0.23 0.63 -0.21 0.00 0.69 0.00 0.00 54.13 55.48 3g6j s LEU 350 Cb -0.14 -3.44 0.09 0.00 -0.43 0.00 0.00 46.19 42.28 3g6j s LEU 350 CO 0.01 -1.02 1.03 -0.04 -0.29 0.00 0.00 176.35 176.04 3g6j s MET 351 N 3.89 3.29 -0.12 1.98 -1.94 -1.26 -1.78 119.30 123.36 3g6j s MET 351 Ca 0.44 -1.18 -0.28 0.00 -1.71 0.00 0.00 55.69 52.95 3g6j s MET 351 Cb -0.10 -4.51 -0.01 0.00 2.01 0.00 0.00 34.83 32.22 3g6j s MET 351 CO 0.23 -1.81 0.96 0.08 -0.01 0.00 0.00 175.02 174.47 3g6j s VAL 352 N 3.58 4.81 -0.46 -6.03 1.01 -0.43 -3.98 120.40 118.90 3g6j s VAL 352 Ca 0.26 1.94 -0.06 0.00 0.00 0.00 0.00 61.98 64.12 3g6j s VAL 352 Cb -0.12 -4.27 0.12 0.00 0.00 0.00 0.00 36.38 32.11 3g6j s VAL 352 CO 0.03 0.01 0.29 0.12 0.00 0.00 0.00 175.10 175.55 3g6j s PHE 353 N 2.03 3.51 0.01 5.22 5.36 -0.13 -1.17 117.98 132.82 3g6j s PHE 353 Ca 0.46 -2.18 -0.17 0.00 -0.96 0.00 0.00 56.93 54.08 3g6j s PHE 353 Cb -0.18 -3.36 -0.06 0.00 -0.34 0.00 0.00 43.02 39.08 3g6j s PHE 353 CO 0.16 -0.98 0.48 0.08 -1.46 0.00 0.00 175.22 173.50 3g6j s VAL 354 N 1.16 4.94 0.04 3.12 1.01 -0.50 -0.66 120.40 129.51 3g6j s VAL 354 Ca 0.08 1.00 -0.02 0.00 0.00 0.00 0.00 61.98 63.03 3g6j s VAL 354 Cb -0.24 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 3g6j s VAL 354 CO -0.03 0.54 0.01 0.42 0.00 0.00 0.00 175.10 176.05 3g6j s THR 355 N -0.90 0.17 0.59 3.92 -4.23 0.13 -2.26 115.64 113.06 3g6j s THR 355 Ca 0.26 -1.41 -0.15 0.00 -1.18 0.00 0.00 61.69 59.21 3g6j s THR 355 Cb -0.18 -1.08 -0.04 0.00 1.34 0.00 0.00 72.50 72.54 3g6j s THR 355 CO 0.15 -0.78 1.04 0.20 -0.54 0.00 0.00 174.62 174.69 3g6j s ASN 356 N -2.41 6.00 0.53 3.99 0.01 -0.04 -1.00 114.94 122.02 3g6j s ASN 356 Ca -0.01 1.68 0.29 0.00 -0.71 0.00 0.00 52.86 54.11 3g6j s ASN 356 Cb 0.02 -2.51 1.58 0.00 0.41 0.00 0.00 41.25 40.74 3g6j s ASN 356 CO -0.07 -1.02 1.87 -0.65 -1.51 0.00 0.00 177.10 175.72 3g6j h PRO 357 N 0.32 0.00 0.00 -0.60 0.11 -1.89 0.63 132.00 130.57 3g6j h PRO 357 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3g6j h PRO 357 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g6j h PRO 357 CO 0.59 0.00 -0.24 -0.40 -0.21 0.00 0.00 178.00 177.74 3g6j n ASP 358 N -2.65 0.57 0.00 -2.05 5.68 -1.26 -4.93 116.55 111.91 3g6j n ASP 358 Ca -0.02 0.33 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 3g6j n ASP 358 Cb 0.22 -0.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 3g6j n ASP 358 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g6j n GLY 359 N 1.38 2.02 3.77 6.12 0.00 0.22 -5.10 105.19 113.60 3g6j n GLY 359 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3g6j n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6j s SER 360 N -1.79 6.11 0.20 1.61 1.04 -1.24 -4.68 113.70 114.95 3g6j s SER 360 Ca 0.00 2.80 -0.32 0.00 0.48 0.00 0.00 55.95 58.92 3g6j s SER 360 Cb 0.00 -2.65 -0.15 0.00 0.10 0.00 0.00 66.02 63.32 3g6j s SER 360 CO 0.00 -1.00 1.17 -0.81 0.98 0.00 0.00 173.24 173.58 3g6j n PRO 361 N 0.01 1.29 -1.30 4.02 -0.04 -1.26 -0.87 135.00 136.85 3g6j n PRO 361 Ca 0.04 0.46 -0.17 0.00 -0.04 0.00 0.00 63.50 63.79 3g6j n PRO 361 Cb 0.42 -1.95 0.11 0.00 -0.04 0.00 0.00 33.50 32.04 3g6j n PRO 361 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3g6j n ALA 362 N 1.37 -0.68 -3.64 0.55 0.00 -0.96 -4.66 120.51 112.50 3g6j n ALA 362 Ca 0.14 -1.08 -0.10 0.00 0.00 0.00 0.00 53.44 52.41 3g6j n ALA 362 Cb 0.26 0.01 -0.07 0.00 0.00 0.00 0.00 19.45 19.65 3g6j n ALA 362 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3g6j s TYR 363 N -2.52 -0.63 -1.30 0.00 6.14 -1.26 -4.12 117.35 113.65 3g6j s TYR 363 Ca 0.44 1.47 -0.02 0.00 0.64 0.00 0.00 57.07 59.60 3g6j s TYR 363 Cb -0.01 0.36 0.01 0.00 0.42 0.00 0.00 41.96 42.74 3g6j s TYR 363 CO 0.31 -0.31 0.16 0.54 0.64 0.00 0.00 175.55 176.89 3g6j n ARG 364 N 2.72 -2.67 -3.44 4.97 5.12 -0.39 -4.91 116.66 118.06 3g6j n ARG 364 Ca -0.14 0.70 -0.40 0.00 -1.93 0.00 0.00 57.85 56.08 3g6j n ARG 364 Cb 0.56 -5.37 -0.10 0.00 -1.16 0.00 0.00 32.46 26.40 3g6j n ARG 364 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3g6j s VAL 365 N -2.83 5.20 0.30 1.55 1.01 -1.26 -4.75 120.40 119.62 3g6j s VAL 365 Ca 0.11 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.93 3g6j s VAL 365 Cb -0.05 -3.75 -0.10 0.00 0.00 0.00 0.00 36.38 32.48 3g6j s VAL 365 CO 0.13 0.01 1.26 -2.84 0.00 0.00 0.00 175.10 173.66 3g6j s PRO 366 N 1.96 4.43 -0.03 2.72 0.02 -1.26 -1.66 135.00 141.18 3g6j s PRO 366 Ca 0.11 2.09 0.01 0.00 0.02 0.00 0.00 61.00 63.23 3g6j s PRO 366 Cb -0.16 -3.12 0.01 0.00 0.02 0.00 0.00 34.50 31.25 3g6j s PRO 366 CO 0.11 -0.10 -0.04 0.14 -0.33 0.00 0.00 177.00 176.78 3g6j s VAL 367 N -0.95 0.44 0.13 3.83 -7.23 -1.26 -0.59 120.40 114.76 3g6j s VAL 367 Ca 0.49 -0.12 0.07 0.00 -1.81 0.00 0.00 61.98 60.61 3g6j s VAL 367 Cb -0.37 -0.45 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 3g6j s VAL 367 CO 0.48 0.18 -0.18 0.00 -0.31 0.00 0.00 175.10 175.27 3g6j s ALA 368 N 0.59 1.74 -0.06 1.32 0.00 0.66 -3.96 121.76 122.05 3g6j s ALA 368 Ca -0.07 -1.32 -0.25 0.00 0.00 0.00 0.00 51.96 50.32 3g6j s ALA 368 Cb -0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 3g6j s ALA 368 CO -0.00 0.24 0.77 0.08 0.00 0.00 0.00 175.76 176.84 3g6j s VAL 369 N -1.72 5.00 -0.02 0.00 1.01 -1.24 -1.36 120.40 122.07 3g6j s VAL 369 Ca 0.10 1.58 -0.30 0.00 0.00 0.00 0.00 61.98 63.36 3g6j s VAL 369 Cb -0.07 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 3g6j s VAL 369 CO 0.05 0.22 1.79 -1.58 0.00 0.00 0.00 175.10 175.57 3g6j s GLN 370 N 0.94 4.16 0.00 2.72 0.74 -0.61 -1.04 119.66 126.57 3g6j s GLN 370 Ca 0.40 2.37 0.00 0.00 0.05 0.00 0.00 55.36 58.18 3g6j s GLN 370 Cb -0.18 -4.06 0.00 0.00 1.10 0.00 0.00 33.01 29.86 3g6j s GLN 370 CO 0.20 -0.90 0.00 0.41 -0.55 0.00 0.00 175.29 174.44 3g6j n GLY 371 N 4.32 3.26 3.89 2.59 0.00 -1.26 -4.90 105.19 113.08 3g6j n GLY 371 Ca 0.18 -1.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 3g6j n GLY 371 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6j s GLU 372 N 0.00 3.47 0.08 1.61 0.41 -0.21 -5.12 118.70 118.95 3g6j s GLU 372 Ca 0.00 -0.19 0.01 0.00 -0.41 0.00 0.00 54.97 54.38 3g6j s GLU 372 Cb 0.00 -3.14 -0.04 0.00 -1.78 0.00 0.00 34.13 29.17 3g6j s GLU 372 CO 0.00 0.72 0.20 -0.51 -0.49 0.00 0.00 175.26 175.17 3g6j s ASP 373 N -1.50 6.18 0.00 -0.19 1.01 -1.26 -4.23 116.67 116.68 3g6j s ASP 373 Ca 0.22 0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.67 3g6j s ASP 373 Cb -0.13 -1.85 0.00 0.00 1.01 0.00 0.00 42.92 41.95 3g6j s ASP 373 CO 0.12 0.15 0.00 0.41 0.21 0.00 0.00 175.17 176.06 3g6j n THR 374 N 0.15 0.00 -1.49 -1.27 -1.04 -1.26 -4.85 114.28 104.52 3g6j n THR 374 Ca -0.06 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.83 3g6j n THR 374 Cb 0.52 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.93 3g6j n THR 374 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3g6j n VAL 375 N -1.04 0.00 -4.04 12.58 0.31 -1.26 -4.73 118.33 120.15 3g6j n VAL 375 Ca 0.00 -0.11 -0.10 0.00 -0.01 0.00 0.00 64.34 64.13 3g6j n VAL 375 Cb 0.00 -1.69 -0.06 0.00 -0.91 0.00 0.00 33.84 31.18 3g6j n VAL 375 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g6j s GLN 376 N 8.07 1.48 -0.29 5.55 -2.07 -1.26 -3.66 119.66 127.48 3g6j s GLN 376 Ca 0.71 -1.33 0.05 0.00 -1.82 0.00 0.00 55.36 52.98 3g6j s GLN 376 Cb -0.06 0.43 0.20 0.00 -1.09 0.00 0.00 33.01 32.49 3g6j s GLN 376 CO 0.16 -0.59 0.58 -1.54 -1.32 0.00 0.00 175.29 172.57 3g6j s SER 377 N -3.05 -1.49 -0.39 12.60 1.04 -1.25 -4.98 113.70 116.18 3g6j s SER 377 Ca 0.26 0.18 -0.36 0.00 0.48 0.00 0.00 55.95 56.51 3g6j s SER 377 Cb 0.01 1.98 -0.15 0.00 0.10 0.00 0.00 66.02 67.95 3g6j s SER 377 CO 0.10 -0.30 1.30 0.18 0.98 0.00 0.00 173.24 175.50 3g6j n LEU 378 N 5.42 0.88 -4.63 2.42 4.77 -1.26 -4.45 117.00 120.15 3g6j n LEU 378 Ca 0.04 0.86 -0.40 0.00 -0.03 0.00 0.00 56.01 56.49 3g6j n LEU 378 Cb 0.54 -0.68 0.03 0.00 -2.33 0.00 0.00 43.42 40.97 3g6j n LEU 378 CO -0.05 -0.64 0.62 1.07 -1.33 0.00 0.00 177.39 177.06 3g6j n THR 379 N 3.38 2.90 -3.01 -5.08 5.66 -0.67 -4.73 114.28 112.74 3g6j n THR 379 Ca 0.27 -0.50 -0.01 0.00 -3.05 0.00 0.00 64.05 60.76 3g6j n THR 379 Cb -0.04 -1.23 0.00 0.00 -1.55 0.00 0.00 70.33 67.51 3g6j n THR 379 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3g6j n GLN 380 N -0.28 0.99 -0.17 1.09 6.02 -1.12 -1.26 117.38 122.65 3g6j n GLN 380 Ca 0.10 -0.12 0.19 0.00 -0.01 0.00 0.00 57.00 57.16 3g6j n GLN 380 Cb 0.42 -0.01 0.55 0.00 1.02 0.00 0.00 30.24 32.22 3g6j n GLN 380 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 3g6j h GLY 381 N 0.00 0.60 2.00 1.08 0.00 -1.90 -0.11 103.07 104.75 3g6j h GLY 381 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.18 3g6j h GLY 381 CO 0.01 0.03 0.00 2.09 0.00 0.00 0.00 176.54 178.67 3g6j n ASP 382 N -4.46 0.27 0.00 0.19 5.75 -1.26 -4.90 116.55 112.15 3g6j n ASP 382 Ca 0.16 0.54 0.00 0.00 -0.01 0.00 0.00 54.79 55.48 3g6j n ASP 382 Cb 0.64 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 3g6j n ASP 382 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3g6j n GLY 383 N 0.76 0.70 3.59 6.12 0.00 -0.05 -4.86 105.19 111.44 3g6j n GLY 383 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3g6j n GLY 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6j s VAL 384 N -2.73 4.05 0.10 1.61 1.01 -1.26 -1.41 120.40 121.78 3g6j s VAL 384 Ca 0.00 -0.32 0.10 0.00 0.00 0.00 0.00 61.98 61.76 3g6j s VAL 384 Cb 0.00 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 3g6j s VAL 384 CO 0.00 0.55 -0.25 0.00 0.00 0.00 0.00 175.10 175.40 3g6j s ALA 385 N -0.30 2.40 -0.18 5.51 0.00 -0.31 -2.77 121.76 126.10 3g6j s ALA 385 Ca 0.06 -1.40 -0.03 0.00 0.00 0.00 0.00 51.96 50.59 3g6j s ALA 385 Cb -0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3g6j s ALA 385 CO 0.02 0.55 -0.05 0.21 0.00 0.00 0.00 175.76 176.49 3g6j s LYS 386 N -1.86 3.49 -0.23 0.00 2.20 -1.26 -1.32 119.74 120.76 3g6j s LYS 386 Ca 0.14 -0.59 0.02 0.00 -0.36 0.00 0.00 55.97 55.18 3g6j s LYS 386 Cb -0.10 -2.92 0.05 0.00 -1.51 0.00 0.00 37.83 33.35 3g6j s LYS 386 CO 0.06 0.03 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.45 3g6j s LEU 387 N 0.89 2.93 -0.43 5.43 1.43 -0.73 -4.41 118.68 123.78 3g6j s LEU 387 Ca -0.01 -1.17 -0.16 0.00 -1.03 0.00 0.00 54.13 51.76 3g6j s LEU 387 Cb -0.15 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.68 3g6j s LEU 387 CO 0.01 -0.16 0.38 -0.94 0.23 0.00 0.00 176.35 175.87 3g6j s SER 388 N 1.22 6.15 -0.15 2.29 1.04 -1.26 -0.60 113.70 122.39 3g6j s SER 388 Ca -0.05 -0.92 -0.11 0.00 0.48 0.00 0.00 55.95 55.35 3g6j s SER 388 Cb -0.18 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.70 3g6j s SER 388 CO -0.07 -0.55 0.21 -0.63 0.98 0.00 0.00 173.24 173.18 3g6j s ILE 389 N 1.86 5.37 0.38 -1.02 1.01 0.31 -4.89 121.20 124.21 3g6j s ILE 389 Ca 0.07 0.36 -0.25 0.00 0.00 0.00 0.00 60.65 60.84 3g6j s ILE 389 Cb -0.20 -3.52 -0.09 0.00 0.01 0.00 0.00 42.46 38.66 3g6j s ILE 389 CO 0.10 0.48 1.08 0.20 0.00 0.00 0.00 174.94 176.81 3g6j s ASN 390 N -0.08 6.80 0.05 3.58 0.01 -1.26 0.44 114.94 124.49 3g6j s ASN 390 Ca 0.14 2.14 0.05 0.00 -0.71 0.00 0.00 52.86 54.48 3g6j s ASN 390 Cb -0.12 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 38.91 3g6j s ASN 390 CO 0.03 -0.47 -0.14 0.42 -1.51 0.00 0.00 177.10 175.43 3g6j s THR 391 N -1.51 1.08 0.32 1.60 -4.23 -1.25 -4.84 115.64 106.81 3g6j s THR 391 Ca 0.55 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.97 3g6j s THR 391 Cb -0.26 -1.01 -0.03 0.00 1.34 0.00 0.00 72.50 72.54 3g6j s THR 391 CO 0.32 -0.10 0.49 -1.00 -0.54 0.00 0.00 174.62 173.80 3g6j s HIS 392 N -1.03 3.48 -0.53 3.99 0.09 -1.26 -2.90 115.29 117.14 3g6j s HIS 392 Ca -0.00 0.23 0.06 0.00 -0.00 0.00 0.00 55.06 55.35 3g6j s HIS 392 Cb -0.09 -1.80 0.34 0.00 -0.00 0.00 0.00 32.58 31.03 3g6j s HIS 392 CO 0.02 0.21 1.10 -2.30 -0.00 0.00 0.00 174.74 173.77 3g6j n PRO 393 N -1.67 0.04 -1.56 8.40 -0.02 -1.26 -3.05 135.00 135.87 3g6j n PRO 393 Ca -0.06 0.47 -0.39 0.00 -2.02 0.00 0.00 63.50 61.50 3g6j n PRO 393 Cb 0.56 -1.76 0.04 0.00 -0.02 0.00 0.00 33.50 32.32 3g6j n PRO 393 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3g6j n SER 394 N -1.67 0.24 -1.62 2.55 3.41 -1.26 -4.83 113.62 110.45 3g6j n SER 394 Ca -0.00 0.83 0.03 0.00 -0.26 0.00 0.00 58.87 59.46 3g6j n SER 394 Cb 0.14 -1.31 0.30 0.00 -0.26 0.00 0.00 64.21 63.08 3g6j n SER 394 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g6j n GLN 395 N -0.47 3.81 -2.51 4.33 1.13 -1.26 -4.85 117.38 117.57 3g6j n GLN 395 Ca 0.12 -2.42 -0.41 0.00 -1.94 0.00 0.00 57.00 52.35 3g6j n GLN 395 Cb 0.46 -2.08 -0.04 0.00 0.11 0.00 0.00 30.24 28.69 3g6j n GLN 395 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3g6j s LYS 396 N -2.38 4.54 0.60 -1.09 2.20 -1.26 -4.81 119.74 117.55 3g6j s LYS 396 Ca 0.42 1.71 -0.18 0.00 -0.36 0.00 0.00 55.97 57.56 3g6j s LYS 396 Cb 0.33 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 33.30 3g6j s LYS 396 CO 0.12 -0.03 1.18 -2.14 -0.36 0.00 0.00 175.35 174.12 3g6j s PRO 397 N 0.17 2.95 -0.25 4.03 0.02 -1.26 -4.79 135.00 135.87 3g6j s PRO 397 Ca 0.52 1.72 -0.23 0.00 0.02 0.00 0.00 61.00 63.03 3g6j s PRO 397 Cb -0.29 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.29 3g6j s PRO 397 CO 0.33 -1.20 0.77 -0.51 -0.33 0.00 0.00 177.00 176.05 3g6j s LEU 398 N -4.22 4.08 -0.38 -5.54 1.43 -0.02 -4.91 118.68 109.12 3g6j s LEU 398 Ca 0.75 0.89 -0.14 0.00 -1.03 0.00 0.00 54.13 54.60 3g6j s LEU 398 Cb -0.28 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 42.87 3g6j s LEU 398 CO 0.34 -0.49 0.27 -0.55 0.23 0.00 0.00 176.35 176.15 3g6j s SER 399 N 1.41 6.07 -0.15 2.29 0.15 -1.26 0.33 113.70 122.55 3g6j s SER 399 Ca 0.32 -0.70 0.02 0.00 0.70 0.00 0.00 55.95 56.29 3g6j s SER 399 Cb -0.15 -2.15 0.01 0.00 -1.71 0.00 0.00 66.02 62.02 3g6j s SER 399 CO 0.08 -0.36 -0.19 -0.63 1.20 0.00 0.00 173.24 173.35 3g6j s ILE 400 N 1.69 2.29 -0.24 6.45 1.01 0.14 -4.99 121.20 127.55 3g6j s ILE 400 Ca 0.05 -0.90 -0.06 0.00 0.00 0.00 0.00 60.65 59.74 3g6j s ILE 400 Cb -0.18 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.33 3g6j s ILE 400 CO 0.10 0.53 0.04 -0.89 0.00 0.00 0.00 174.94 174.72 3g6j s THR 401 N 0.87 4.08 0.16 2.92 2.01 -1.26 0.48 115.64 124.89 3g6j s THR 401 Ca -0.05 -0.25 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 3g6j s THR 401 Cb -0.15 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 3g6j s THR 401 CO -0.02 0.37 0.34 -0.69 -0.69 0.00 0.00 174.62 173.93 3g6j s VAL 402 N 1.50 5.25 0.01 3.82 1.01 -0.10 -1.58 120.40 130.32 3g6j s VAL 402 Ca 0.06 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.67 3g6j s VAL 402 Cb -0.15 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 3g6j s VAL 402 CO 0.02 -0.08 -0.02 -0.13 0.00 0.00 0.00 175.10 174.89 3g6j s ARG 403 N -3.08 0.17 0.49 2.72 0.52 -0.47 -2.51 118.95 116.79 3g6j s ARG 403 Ca 0.38 -0.22 -0.19 0.00 -0.52 0.00 0.00 55.73 55.17 3g6j s ARG 403 Cb -0.11 -0.05 -0.08 0.00 0.52 0.00 0.00 34.95 35.22 3g6j s ARG 403 CO 0.28 0.01 1.01 0.95 0.02 0.00 0.00 175.30 177.57 3g6j s THR 404 N -0.45 4.04 -0.38 0.02 -4.23 -0.68 -0.25 115.64 113.72 3g6j s THR 404 Ca -0.04 1.20 0.13 0.00 -1.18 0.00 0.00 61.69 61.79 3g6j s THR 404 Cb -0.03 -3.51 0.39 0.00 1.34 0.00 0.00 72.50 70.69 3g6j s THR 404 CO -0.00 -0.35 0.86 0.29 -0.54 0.00 0.00 174.62 174.88 3g6j n LYS 405 N -1.08 1.47 -2.32 3.99 4.76 0.25 -4.57 118.16 120.65 3g6j n LYS 405 Ca 0.08 -3.58 -0.42 0.00 -2.87 0.00 0.00 58.31 51.52 3g6j n LYS 405 Cb 0.53 -1.64 -0.03 0.00 -1.84 0.00 0.00 35.03 32.05 3g6j n LYS 405 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3g6j s LYS 406 N -2.88 4.39 0.02 1.97 2.47 -1.26 -4.64 119.74 119.82 3g6j s LYS 406 Ca 0.37 1.90 -0.24 0.00 -1.56 0.00 0.00 55.97 56.44 3g6j s LYS 406 Cb 0.39 -3.30 -0.17 0.00 -1.46 0.00 0.00 37.83 33.29 3g6j s LYS 406 CO -0.05 -0.31 1.43 1.96 0.16 0.00 0.00 175.35 178.54 3g6j h GLN 407 N 6.61 0.07 0.00 4.03 4.20 -1.98 -3.07 115.11 124.98 3g6j h GLN 407 Ca -0.42 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.26 3g6j h GLN 407 Cb 1.21 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.99 3g6j h GLN 407 CO 0.82 0.39 0.00 1.05 -0.67 0.00 0.00 178.83 180.42 3g6j h GLU 408 N -0.25 0.00 -7.29 1.46 -0.00 -2.06 -3.44 114.58 103.00 3g6j h GLU 408 Ca 0.01 0.00 -0.46 0.00 -0.00 0.00 0.00 59.36 58.91 3g6j h GLU 408 Cb 0.36 0.00 0.17 0.00 -0.00 0.00 0.00 28.75 29.28 3g6j h GLU 408 CO 0.00 0.00 0.16 -0.51 -0.00 0.00 0.00 179.01 178.66 3g6j s LEU 409 N -5.06 1.58 0.44 3.06 1.02 -1.16 -5.09 118.68 113.47 3g6j s LEU 409 Ca 0.07 1.38 0.08 0.00 0.02 0.00 0.00 54.13 55.68 3g6j s LEU 409 Cb 0.10 -3.55 -0.00 0.00 0.02 0.00 0.00 46.19 42.76 3g6j s LEU 409 CO 0.56 -3.32 0.44 -0.94 0.02 0.00 0.00 176.35 173.11 3g6j s SER 410 N -3.17 5.12 0.22 2.29 1.04 -1.26 -4.99 113.70 112.95 3g6j s SER 410 Ca 0.66 -0.75 -0.08 0.00 0.48 0.00 0.00 55.95 56.27 3g6j s SER 410 Cb -0.20 -0.43 0.36 0.00 0.10 0.00 0.00 66.02 65.85 3g6j s SER 410 CO 0.59 -0.76 1.72 -0.33 0.98 0.00 0.00 173.24 175.44 3g6j h GLU 411 N 0.87 0.33 0.00 4.02 4.39 -1.97 -1.66 114.58 120.56 3g6j h GLU 411 Ca -0.40 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.28 3g6j h GLU 411 Cb 1.27 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3g6j h GLU 411 CO 0.54 0.22 -0.03 0.00 -1.16 0.00 0.00 179.01 178.58 3g6j h ALA 412 N 1.50 1.87 -0.01 3.43 0.00 -1.96 -2.14 119.26 121.96 3g6j h ALA 412 Ca 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3g6j h ALA 412 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3g6j h ALA 412 CO -0.40 0.04 -0.22 0.39 0.00 0.00 0.00 179.25 179.06 3g6j n GLU 413 N -4.39 0.90 -2.56 0.00 1.02 -0.64 -4.69 120.64 110.28 3g6j n GLU 413 Ca -0.03 -0.51 -0.41 0.00 -0.02 0.00 0.00 57.16 56.19 3g6j n GLU 413 Cb 0.11 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.01 3g6j n GLU 413 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3g6j s GLN 414 N -2.45 4.57 0.49 3.49 -1.52 -0.81 -4.08 119.66 119.35 3g6j s GLN 414 Ca 0.26 1.63 -0.20 0.00 -1.95 0.00 0.00 55.36 55.10 3g6j s GLN 414 Cb 0.19 -3.34 -0.08 0.00 -0.22 0.00 0.00 33.01 29.56 3g6j s GLN 414 CO 0.50 -0.00 1.04 0.00 -0.25 0.00 0.00 175.29 176.57 3g6j s ALA 415 N 0.34 2.87 -0.17 6.09 0.00 -1.26 -4.89 121.76 124.73 3g6j s ALA 415 Ca 0.52 0.59 -0.13 0.00 0.00 0.00 0.00 51.96 52.94 3g6j s ALA 415 Cb -0.27 -3.25 0.05 0.00 0.00 0.00 0.00 23.12 19.65 3g6j s ALA 415 CO 0.31 -0.33 0.43 -0.08 0.00 0.00 0.00 175.76 176.09 3g6j s THR 416 N -2.01 -0.01 -0.09 0.00 -1.32 -1.26 -1.68 115.64 109.27 3g6j s THR 416 Ca 0.67 0.03 -0.15 0.00 -1.21 0.00 0.00 61.69 61.03 3g6j s THR 416 Cb -0.16 -0.61 0.03 0.00 -1.51 0.00 0.00 72.50 70.25 3g6j s THR 416 CO 0.21 0.01 0.38 -0.60 -2.21 0.00 0.00 174.62 172.40 3g6j s ARG 417 N 0.60 0.57 0.14 7.08 6.06 -1.04 -4.87 118.95 127.50 3g6j s ARG 417 Ca -0.03 0.24 0.08 0.00 -2.50 0.00 0.00 55.73 53.52 3g6j s ARG 417 Cb -0.05 0.27 -0.04 0.00 0.06 0.00 0.00 34.95 35.19 3g6j s ARG 417 CO -0.04 -0.12 -0.11 -0.08 -2.50 0.00 0.00 175.30 172.45 3g6j s THR 418 N -0.48 3.18 0.23 4.11 -1.32 -1.26 -0.92 115.64 119.18 3g6j s THR 418 Ca -0.06 -1.50 -0.02 0.00 -1.21 0.00 0.00 61.69 58.90 3g6j s THR 418 Cb -0.04 -2.52 -0.03 0.00 -1.51 0.00 0.00 72.50 68.40 3g6j s THR 418 CO 0.03 0.00 0.23 0.00 -2.21 0.00 0.00 174.62 172.67 3g6j s MET 419 N -2.49 1.38 -0.05 7.08 0.23 0.18 -4.98 119.30 120.65 3g6j s MET 419 Ca 0.22 -1.63 0.02 0.00 -1.03 0.00 0.00 55.69 53.27 3g6j s MET 419 Cb -0.10 0.32 0.01 0.00 -1.53 0.00 0.00 34.83 33.54 3g6j s MET 419 CO 0.14 -0.49 -0.08 -1.14 -2.03 0.00 0.00 175.02 171.41 3g6j s GLN 420 N -3.97 1.16 -0.14 3.16 0.74 -1.26 -0.68 119.66 118.67 3g6j s GLN 420 Ca 0.36 -0.26 -0.02 0.00 0.05 0.00 0.00 55.36 55.49 3g6j s GLN 420 Cb 0.05 -1.05 -0.02 0.00 1.10 0.00 0.00 33.01 33.09 3g6j s GLN 420 CO 0.14 0.01 -0.07 0.00 -0.55 0.00 0.00 175.29 174.82 3g6j s ALA 421 N 0.64 2.88 0.07 1.58 0.00 0.15 -4.90 121.76 122.19 3g6j s ALA 421 Ca -0.11 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 50.96 3g6j s ALA 421 Cb -0.14 -1.43 -0.05 0.00 0.00 0.00 0.00 23.12 21.51 3g6j s ALA 421 CO 0.02 0.26 0.30 -0.51 0.00 0.00 0.00 175.76 175.83 3g6j s LEU 422 N 0.26 4.33 0.36 0.00 1.43 -0.32 -0.84 118.68 123.90 3g6j s LEU 422 Ca -0.05 0.53 -0.25 0.00 -1.03 0.00 0.00 54.13 53.33 3g6j s LEU 422 Cb -0.14 -2.97 -0.10 0.00 0.03 0.00 0.00 46.19 43.01 3g6j s LEU 422 CO 0.04 0.16 0.99 -2.84 0.23 0.00 0.00 176.35 174.93 3g6j s PRO 423 N -2.22 4.39 -0.30 1.29 0.02 -1.26 -1.74 135.00 135.18 3g6j s PRO 423 Ca 0.34 1.41 -0.29 0.00 0.02 0.00 0.00 61.00 62.48 3g6j s PRO 423 Cb -0.13 -2.67 -0.01 0.00 0.02 0.00 0.00 34.50 31.71 3g6j s PRO 423 CO 0.21 0.09 1.51 -0.47 -0.33 0.00 0.00 177.00 178.01 3g6j s TYR 424 N -1.65 2.29 0.03 6.54 5.04 0.95 -4.76 117.35 125.79 3g6j s TYR 424 Ca 0.54 0.67 -0.22 0.00 -2.44 0.00 0.00 57.07 55.62 3g6j s TYR 424 Cb -0.20 -4.05 -0.06 0.00 0.35 0.00 0.00 41.96 38.00 3g6j s TYR 424 CO 0.25 -2.39 0.65 -1.54 -1.34 0.00 0.00 175.55 171.18 3g6j s SER 425 N 3.99 7.08 0.57 4.32 1.04 -0.68 -4.64 113.70 125.39 3g6j s SER 425 Ca 0.66 1.29 -0.05 0.00 0.48 0.00 0.00 55.95 58.34 3g6j s SER 425 Cb -0.20 -2.40 0.01 0.00 0.10 0.00 0.00 66.02 63.53 3g6j s SER 425 CO 0.29 0.12 0.86 0.42 0.98 0.00 0.00 173.24 175.91 3g6j s THR 426 N -0.38 3.56 -0.27 2.02 -4.23 -1.26 -4.65 115.64 110.43 3g6j s THR 426 Ca 0.33 -0.13 -0.26 0.00 -1.18 0.00 0.00 61.69 60.45 3g6j s THR 426 Cb -0.19 -3.40 0.00 0.00 1.34 0.00 0.00 72.50 70.25 3g6j s THR 426 CO 0.20 -0.39 0.91 -0.69 -0.54 0.00 0.00 174.62 174.11 3g6j s VAL 427 N -2.93 4.73 -1.30 2.29 1.01 -1.26 -3.63 120.40 119.32 3g6j s VAL 427 Ca 0.54 1.60 0.00 0.00 0.00 0.00 0.00 61.98 64.11 3g6j s VAL 427 Cb -0.10 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.06 3g6j s VAL 427 CO 0.44 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.93 3g6j n GLY 428 N 3.80 0.60 3.94 4.51 0.00 -1.26 -2.18 105.19 114.59 3g6j n GLY 428 Ca 0.08 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 3g6j n GLY 428 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g6j n ASN 429 N -0.41 -1.01 0.20 1.61 4.13 -1.24 -4.89 115.26 113.65 3g6j n ASN 429 Ca -0.15 -1.03 0.08 0.00 1.68 0.00 0.00 54.58 55.16 3g6j n ASN 429 Cb 0.54 -2.98 0.34 0.00 -1.54 0.00 0.00 39.78 36.13 3g6j n ASN 429 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 3g6j h SER 430 N -1.87 0.00 -2.04 6.41 4.64 -1.70 -3.47 113.55 115.52 3g6j h SER 430 Ca -0.64 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.30 3g6j h SER 430 Cb 1.38 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.37 3g6j h SER 430 CO 0.60 0.29 -0.41 0.59 -0.87 0.00 0.00 176.83 177.04 3g6j n ASN 431 N -3.36 -5.19 -4.80 4.97 3.02 -1.26 -4.90 115.26 103.74 3g6j n ASN 431 Ca 0.01 0.27 -0.37 0.00 -0.03 0.00 0.00 54.58 54.46 3g6j n ASN 431 Cb 0.51 -4.49 -0.07 0.00 -0.61 0.00 0.00 39.78 35.12 3g6j n ASN 431 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3g6j s ASN 432 N -2.35 6.47 0.23 6.41 0.01 -1.26 -4.77 114.94 119.67 3g6j s ASN 432 Ca 0.00 0.55 0.01 0.00 -0.71 0.00 0.00 52.86 52.72 3g6j s ASN 432 Cb 0.00 -2.15 -0.05 0.00 0.41 0.00 0.00 41.25 39.47 3g6j s ASN 432 CO 0.00 0.27 0.07 -0.31 -1.51 0.00 0.00 177.10 175.61 3g6j s TYR 433 N -0.40 1.40 -0.09 2.20 2.02 -0.14 -4.84 117.35 117.50 3g6j s TYR 433 Ca 0.16 -1.14 0.02 0.00 -0.37 0.00 0.00 57.07 55.74 3g6j s TYR 433 Cb -0.13 -0.81 0.01 0.00 -0.40 0.00 0.00 41.96 40.64 3g6j s TYR 433 CO 0.05 -0.31 -0.14 -1.17 -1.57 0.00 0.00 175.55 172.41 3g6j s LEU 434 N -3.25 1.67 -0.17 -1.29 2.96 -1.26 -2.30 118.68 115.02 3g6j s LEU 434 Ca 0.33 -0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 53.86 3g6j s LEU 434 Cb 0.07 -0.98 0.00 0.00 0.50 0.00 0.00 46.19 45.78 3g6j s LEU 434 CO 0.10 0.02 -0.14 -2.28 -1.32 0.00 0.00 176.35 172.73 3g6j s HIS 435 N 0.88 2.82 -0.11 5.38 5.65 -1.04 -4.53 115.29 124.34 3g6j s HIS 435 Ca -0.10 -1.17 -0.17 0.00 0.25 0.00 0.00 55.06 53.87 3g6j s HIS 435 Cb -0.15 -1.94 -0.04 0.00 -1.18 0.00 0.00 32.58 29.26 3g6j s HIS 435 CO 0.01 -0.57 0.43 -0.51 -0.65 0.00 0.00 174.74 173.45 3g6j s LEU 436 N 1.07 4.30 -0.04 8.88 1.43 -1.26 -1.27 118.68 131.78 3g6j s LEU 436 Ca -0.00 0.78 0.04 0.00 -1.03 0.00 0.00 54.13 53.92 3g6j s LEU 436 Cb -0.14 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 43.45 3g6j s LEU 436 CO -0.04 0.06 -0.17 -0.94 0.23 0.00 0.00 176.35 175.49 3g6j s SER 437 N 0.36 2.13 0.01 2.29 1.04 -0.91 -4.99 113.70 113.64 3g6j s SER 437 Ca 0.24 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.32 3g6j s SER 437 Cb -0.15 -0.60 -0.01 0.00 0.10 0.00 0.00 66.02 65.36 3g6j s SER 437 CO 0.09 0.15 -0.03 -0.69 0.98 0.00 0.00 173.24 173.75 3g6j s VAL 438 N 0.06 0.15 0.41 5.02 1.01 -1.26 -1.92 120.40 123.87 3g6j s VAL 438 Ca -0.04 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 3g6j s VAL 438 Cb -0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 36.38 35.96 3g6j s VAL 438 CO 0.02 -0.25 0.84 -0.22 0.00 0.00 0.00 175.10 175.48 3g6j s LEU 439 N -0.83 3.86 -0.82 3.92 2.96 -1.26 -5.02 118.68 121.48 3g6j s LEU 439 Ca -0.08 1.35 -0.11 0.00 -0.22 0.00 0.00 54.13 55.07 3g6j s LEU 439 Cb -0.06 -4.22 0.21 0.00 0.50 0.00 0.00 46.19 42.63 3g6j s LEU 439 CO -0.00 -0.39 0.74 -0.60 -1.32 0.00 0.00 176.35 174.78 3g6j s ARG 440 N -3.58 3.45 -0.06 1.98 6.06 -1.26 -4.99 118.95 120.55 3g6j s ARG 440 Ca 0.55 -2.59 -0.02 0.00 -2.50 0.00 0.00 55.73 51.17 3g6j s ARG 440 Cb -0.10 -4.29 0.04 0.00 0.06 0.00 0.00 34.95 30.66 3g6j s ARG 440 CO 0.25 -1.26 0.13 0.95 -2.50 0.00 0.00 175.30 172.87 3g6j s THR 441 N -0.09 -0.05 -0.25 4.11 -4.23 -1.26 -5.10 115.64 108.77 3g6j s THR 441 Ca 0.19 0.18 -0.38 0.00 -1.18 0.00 0.00 61.69 60.51 3g6j s THR 441 Cb -0.12 -0.22 -0.14 0.00 1.34 0.00 0.00 72.50 73.36 3g6j s THR 441 CO -0.08 0.08 1.86 -0.62 -0.54 0.00 0.00 174.62 175.32 3g6j n GLU 442 N 4.20 1.39 -3.19 3.99 -0.58 -1.26 -4.91 120.64 120.28 3g6j n GLU 442 Ca -0.27 0.49 -0.36 0.00 -0.42 0.00 0.00 57.16 56.60 3g6j n GLU 442 Cb 0.51 -2.30 -0.06 0.00 -0.57 0.00 0.00 31.44 29.03 3g6j n GLU 442 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3g6j s LEU 443 N 4.37 4.38 0.01 -4.62 1.43 -1.26 -4.89 118.68 118.10 3g6j s LEU 443 Ca 0.99 1.31 0.05 0.00 -1.03 0.00 0.00 54.13 55.45 3g6j s LEU 443 Cb -0.94 -3.38 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 3g6j s LEU 443 CO 0.60 0.10 -0.15 -0.13 0.23 0.00 0.00 176.35 176.99 3g6j s ARG 444 N -1.81 1.13 -0.57 1.70 0.52 -1.26 -1.32 118.95 117.34 3g6j s ARG 444 Ca 0.39 -0.65 -0.26 0.00 -0.52 0.00 0.00 55.73 54.69 3g6j s ARG 444 Cb -0.17 -1.13 -0.07 0.00 0.52 0.00 0.00 34.95 34.10 3g6j s ARG 444 CO 0.20 0.30 2.31 -1.25 0.02 0.00 0.00 175.30 176.89 3g6j s PRO 445 N -0.69 2.10 0.00 3.54 0.04 -1.26 -2.09 135.00 136.64 3g6j s PRO 445 Ca 0.05 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.17 3g6j s PRO 445 Cb -0.07 -4.61 0.00 0.00 0.04 0.00 0.00 34.50 29.87 3g6j s PRO 445 CO 0.00 -3.40 0.00 0.41 0.04 0.00 0.00 177.00 174.05 3g6j n GLY 446 N 6.12 1.77 3.72 0.56 0.00 -0.34 -4.81 105.19 112.22 3g6j n GLY 446 Ca 0.36 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 3g6j n GLY 446 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g6j s GLU 447 N 0.00 0.68 0.01 1.61 -1.05 -0.89 -4.78 118.70 114.28 3g6j s GLU 447 Ca 0.00 0.39 0.06 0.00 -0.15 0.00 0.00 54.97 55.26 3g6j s GLU 447 Cb 0.00 -1.78 -0.02 0.00 -0.44 0.00 0.00 34.13 31.89 3g6j s GLU 447 CO 0.00 -2.53 -0.17 -0.08 0.95 0.00 0.00 175.26 173.43 3g6j s THR 448 N -3.11 1.37 -0.23 1.83 -1.32 -1.26 -2.52 115.64 110.41 3g6j s THR 448 Ca 0.65 -0.88 -0.04 0.00 -1.21 0.00 0.00 61.69 60.21 3g6j s THR 448 Cb -0.17 -1.17 -0.00 0.00 -1.51 0.00 0.00 72.50 69.65 3g6j s THR 448 CO 0.56 0.28 -0.04 -0.22 -2.21 0.00 0.00 174.62 172.98 3g6j s LEU 449 N -0.70 2.96 0.01 9.08 2.96 0.14 -4.96 118.68 128.17 3g6j s LEU 449 Ca 0.06 -0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 53.22 3g6j s LEU 449 Cb -0.07 -1.74 -0.06 0.00 0.50 0.00 0.00 46.19 44.82 3g6j s LEU 449 CO 0.00 -0.04 1.39 0.20 -1.32 0.00 0.00 176.35 176.59 3g6j s ASN 450 N 1.47 6.86 -0.24 3.68 -0.87 -1.26 -1.65 114.94 122.92 3g6j s ASN 450 Ca 0.05 2.12 -0.03 0.00 -1.57 0.00 0.00 52.86 53.43 3g6j s ASN 450 Cb -0.15 -2.56 0.01 0.00 -0.02 0.00 0.00 41.25 38.53 3g6j s ASN 450 CO -0.03 -0.71 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.06 3g6j s VAL 451 N 2.28 3.20 -0.19 1.60 1.01 -0.41 -4.50 120.40 123.38 3g6j s VAL 451 Ca 0.64 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 61.69 3g6j s VAL 451 Cb -0.32 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 3g6j s VAL 451 CO 0.27 0.27 0.33 0.20 0.00 0.00 0.00 175.10 176.16 3g6j s ASN 452 N 1.41 6.39 -0.43 3.32 0.01 -0.81 -0.49 114.94 124.34 3g6j s ASN 452 Ca 0.03 0.46 -0.09 0.00 -0.71 0.00 0.00 52.86 52.54 3g6j s ASN 452 Cb -0.16 -2.20 0.09 0.00 0.41 0.00 0.00 41.25 39.39 3g6j s ASN 452 CO -0.03 0.01 0.28 -0.36 -1.51 0.00 0.00 177.10 175.48 3g6j s PHE 453 N 0.96 3.36 -0.40 2.20 0.08 -0.01 -2.13 117.98 122.05 3g6j s PHE 453 Ca 0.17 -1.61 -0.18 0.00 0.12 0.00 0.00 56.93 55.43 3g6j s PHE 453 Cb -0.14 -3.08 0.01 0.00 -0.57 0.00 0.00 43.02 39.24 3g6j s PHE 453 CO 0.06 -0.88 0.50 -1.17 -0.10 0.00 0.00 175.22 173.63 3g6j s LEU 454 N 1.41 4.59 -0.49 -0.37 2.96 -0.40 -2.40 118.68 123.98 3g6j s LEU 454 Ca 0.04 -0.37 -0.27 0.00 -0.22 0.00 0.00 54.13 53.30 3g6j s LEU 454 Cb -0.24 -2.52 0.03 0.00 0.50 0.00 0.00 46.19 43.96 3g6j s LEU 454 CO 0.01 -0.58 1.05 -0.22 -1.32 0.00 0.00 176.35 175.30 3g6j s LEU 455 N 2.37 3.78 -0.91 -0.68 2.96 0.83 -2.50 118.68 124.52 3g6j s LEU 455 Ca 0.16 0.21 -0.00 0.00 -0.22 0.00 0.00 54.13 54.29 3g6j s LEU 455 Cb -0.16 -3.30 0.30 0.00 0.50 0.00 0.00 46.19 43.53 3g6j s LEU 455 CO 0.15 -1.22 1.34 -1.14 -1.32 0.00 0.00 176.35 174.16 3g6j n ARG 456 N 7.66 4.14 -4.41 1.98 0.63 -0.97 -4.88 116.66 120.81 3g6j n ARG 456 Ca 0.09 -4.65 -0.22 0.00 -0.92 0.00 0.00 57.85 52.15 3g6j n ARG 456 Cb 0.49 -2.41 -0.13 0.00 0.45 0.00 0.00 32.46 30.85 3g6j n ARG 456 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 3g6j s MET 457 N -3.17 1.07 0.32 -0.14 1.75 -1.26 -0.97 119.30 116.90 3g6j s MET 457 Ca 0.37 -0.87 -0.27 0.00 -1.25 0.00 0.00 55.69 53.67 3g6j s MET 457 Cb 0.13 -1.13 -0.09 0.00 2.84 0.00 0.00 34.83 36.57 3g6j s MET 457 CO 0.00 0.28 1.03 -0.51 -0.65 0.00 0.00 175.02 175.17 3g6j s ASP 458 N -1.28 7.20 0.44 1.11 1.01 -1.26 -4.86 116.67 119.02 3g6j s ASP 458 Ca 0.03 2.06 0.22 0.00 0.71 0.00 0.00 52.55 55.58 3g6j s ASP 458 Cb -0.08 -2.60 1.21 0.00 1.01 0.00 0.00 42.92 42.45 3g6j s ASP 458 CO 0.02 -0.18 1.80 0.08 0.21 0.00 0.00 175.17 177.10 3g6j h ARG 459 N 3.35 0.29 -0.04 8.23 0.11 -2.01 -3.14 114.38 121.18 3g6j h ARG 459 Ca -0.47 -0.02 0.01 0.00 0.10 0.00 0.00 59.98 59.61 3g6j h ARG 459 Cb 1.21 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 32.22 3g6j h ARG 459 CO 0.65 0.19 0.04 0.00 0.10 0.00 0.00 179.97 180.95 3g6j h ALA 460 N 1.58 1.76 0.00 0.08 0.00 -2.04 -3.00 119.26 117.64 3g6j h ALA 460 Ca 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 3g6j h ALA 460 Cb 1.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.40 3g6j h ALA 460 CO -0.21 -0.06 0.00 0.72 0.00 0.00 0.00 179.25 179.70 3g6j n HIS 461 N -4.11 0.00 0.05 0.00 8.25 -1.19 -4.81 115.22 113.42 3g6j n HIS 461 Ca -0.02 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.60 3g6j n HIS 461 Cb 0.13 0.00 0.64 0.00 1.12 0.00 0.00 29.99 31.88 3g6j n HIS 461 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 3g6j h GLU 462 N 0.00 0.07 0.00 -0.41 -0.00 -1.62 -1.21 114.58 111.41 3g6j h GLU 462 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 3g6j h GLU 462 Cb 0.12 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 28.85 3g6j h GLU 462 CO 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 179.01 179.06 3g6j n ALA 463 N -2.59 1.08 0.19 1.06 0.00 -1.26 -1.37 120.51 117.62 3g6j n ALA 463 Ca 0.07 0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.71 3g6j n ALA 463 Cb 0.44 -1.20 0.12 0.00 0.00 0.00 0.00 19.45 18.81 3g6j n ALA 463 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3g6j h LYS 464 N 0.00 0.00 -6.52 0.00 3.64 -1.61 -3.44 116.57 108.64 3g6j h LYS 464 Ca 0.00 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.81 3g6j h LYS 464 Cb 0.03 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.78 3g6j h LYS 464 CO 0.00 0.13 0.87 0.42 -2.27 0.00 0.00 179.45 178.60 3g6j s ILE 465 N -3.15 4.34 -0.46 2.00 -1.09 -0.47 -4.84 121.20 117.53 3g6j s ILE 465 Ca 0.06 1.39 0.05 0.00 -2.23 0.00 0.00 60.65 59.92 3g6j s ILE 465 Cb 0.06 -4.52 -0.00 0.00 -1.58 0.00 0.00 42.46 36.42 3g6j s ILE 465 CO 0.70 -0.79 0.45 0.54 -1.23 0.00 0.00 174.94 174.60 3g6j n ARG 466 N 7.43 2.44 -3.56 2.79 5.12 -1.26 -4.57 116.66 125.04 3g6j n ARG 466 Ca 0.12 -0.43 -0.10 0.00 -1.93 0.00 0.00 57.85 55.50 3g6j n ARG 466 Cb 0.48 -0.92 -0.04 0.00 -1.16 0.00 0.00 32.46 30.81 3g6j n ARG 466 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 3g6j s TYR 467 N -0.92 -0.36 -0.13 -1.55 -0.85 -1.26 -1.70 117.35 110.57 3g6j s TYR 467 Ca 0.04 0.55 -0.04 0.00 -0.52 0.00 0.00 57.07 57.10 3g6j s TYR 467 Cb 0.04 0.47 -0.03 0.00 0.38 0.00 0.00 41.96 42.82 3g6j s TYR 467 CO 0.13 -0.38 0.00 0.71 -1.52 0.00 0.00 175.55 174.49 3g6j s TYR 468 N -1.54 3.14 -0.26 -3.49 2.02 0.17 -4.74 117.35 112.65 3g6j s TYR 468 Ca -0.00 -0.00 -0.18 0.00 -0.37 0.00 0.00 57.07 56.51 3g6j s TYR 468 Cb -0.01 -1.92 -0.02 0.00 -0.40 0.00 0.00 41.96 39.61 3g6j s TYR 468 CO -0.00 0.22 0.54 0.99 -1.57 0.00 0.00 175.55 175.73 3g6j s THR 469 N -0.15 5.05 0.11 -0.71 2.01 -0.46 -1.41 115.64 120.08 3g6j s THR 469 Ca 0.05 0.91 0.09 0.00 0.31 0.00 0.00 61.69 63.05 3g6j s THR 469 Cb -0.13 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 3g6j s THR 469 CO 0.02 0.06 -0.21 -0.72 -0.69 0.00 0.00 174.62 173.08 3g6j s TYR 470 N 2.36 2.47 0.01 4.92 -0.85 -1.14 -0.77 117.35 124.34 3g6j s TYR 470 Ca 0.22 -0.30 0.02 0.00 -0.52 0.00 0.00 57.07 56.49 3g6j s TYR 470 Cb -0.16 -1.34 -0.01 0.00 0.38 0.00 0.00 41.96 40.84 3g6j s TYR 470 CO 0.09 0.34 -0.06 -0.51 -1.52 0.00 0.00 175.55 173.89 3g6j s LEU 471 N -1.97 2.06 -0.22 -3.49 1.02 0.46 -1.46 118.68 115.09 3g6j s LEU 471 Ca 0.16 -0.20 0.00 0.00 0.02 0.00 0.00 54.13 54.12 3g6j s LEU 471 Cb -0.10 -0.26 0.03 0.00 0.02 0.00 0.00 46.19 45.88 3g6j s LEU 471 CO 0.08 0.01 -0.12 -0.63 0.02 0.00 0.00 176.35 175.71 3g6j s ILE 472 N -0.40 2.47 -0.15 -0.59 1.01 0.18 0.09 121.20 123.81 3g6j s ILE 472 Ca -0.00 -1.07 -0.14 0.00 0.00 0.00 0.00 60.65 59.44 3g6j s ILE 472 Cb -0.04 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 3g6j s ILE 472 CO -0.00 0.30 0.30 -0.04 0.00 0.00 0.00 174.94 175.50 3g6j s MET 473 N 1.28 4.21 -0.09 2.79 -1.94 0.07 -0.85 119.30 124.77 3g6j s MET 473 Ca 0.01 0.12 -0.06 0.00 -1.71 0.00 0.00 55.69 54.05 3g6j s MET 473 Cb -0.16 -3.40 0.04 0.00 2.01 0.00 0.00 34.83 33.31 3g6j s MET 473 CO -0.08 0.28 0.22 1.21 -0.01 0.00 0.00 175.02 176.64 3g6j s ASN 474 N 0.32 -0.22 -1.74 3.03 3.84 -0.76 -1.08 114.94 118.33 3g6j s ASN 474 Ca 0.17 0.45 0.00 0.00 0.21 0.00 0.00 52.86 53.69 3g6j s ASN 474 Cb -0.13 0.38 0.00 0.00 -0.55 0.00 0.00 41.25 40.95 3g6j s ASN 474 CO 0.05 -0.13 0.00 0.29 -2.79 0.00 0.00 177.10 174.52 3g6j n LYS 475 N 3.75 -1.60 -1.07 0.43 5.02 -1.26 -2.10 118.16 121.33 3g6j n LYS 475 Ca -0.21 0.99 -0.02 0.00 -2.02 0.00 0.00 58.31 57.04 3g6j n LYS 475 Cb 0.55 -5.59 -0.01 0.00 -0.02 0.00 0.00 35.03 29.96 3g6j n LYS 475 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g6j n GLY 476 N -1.00 0.58 3.43 0.72 0.00 -1.26 -4.90 105.19 102.77 3g6j n GLY 476 Ca -0.24 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 44.95 3g6j n GLY 476 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3g6j s ARG 477 N -1.81 1.58 -0.51 1.61 1.04 -0.89 -4.80 118.95 115.17 3g6j s ARG 477 Ca 0.00 -1.57 -0.28 0.00 -1.04 0.00 0.00 55.73 52.84 3g6j s ARG 477 Cb 0.00 0.40 0.02 0.00 -2.04 0.00 0.00 34.95 33.32 3g6j s ARG 477 CO 0.00 -0.62 1.33 -0.51 -0.04 0.00 0.00 175.30 175.46 3g6j s LEU 478 N -3.15 3.50 -0.13 -1.89 1.43 -1.26 -1.83 118.68 115.35 3g6j s LEU 478 Ca 0.31 0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 53.60 3g6j s LEU 478 Cb 0.02 -3.30 -0.26 0.00 0.03 0.00 0.00 46.19 42.67 3g6j s LEU 478 CO 0.15 -1.51 0.69 0.25 0.23 0.00 0.00 176.35 176.15 3g6j h LEU 479 N 12.32 0.13 -7.22 1.79 5.85 -1.28 -3.45 115.31 123.44 3g6j h LEU 479 Ca -0.26 -0.90 -0.09 0.00 0.84 0.00 0.00 57.88 57.47 3g6j h LEU 479 Cb 1.08 -0.04 -0.21 0.00 0.37 0.00 0.00 40.66 41.86 3g6j h LEU 479 CO 1.14 1.22 -0.07 -0.75 -0.34 0.00 0.00 178.44 179.64 3g6j s LYS 480 N -2.31 0.74 -0.02 1.25 2.20 -1.16 -5.01 119.74 115.43 3g6j s LYS 480 Ca -0.19 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.82 3g6j s LYS 480 Cb -0.00 0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 36.67 3g6j s LYS 480 CO 0.71 -0.17 -0.09 0.00 -0.36 0.00 0.00 175.35 175.44 3g6j s ALA 481 N -0.50 0.83 0.00 3.13 0.00 -1.26 0.49 121.76 124.45 3g6j s ALA 481 Ca -0.06 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.53 3g6j s ALA 481 Cb -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.83 3g6j s ALA 481 CO 0.04 0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.38 3g6j n GLY 482 N 3.07 4.84 2.70 0.00 0.00 -0.53 -5.01 105.19 110.27 3g6j n GLY 482 Ca -0.16 -1.25 -0.19 0.00 0.00 0.00 0.00 46.02 44.43 3g6j n GLY 482 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g6j s ARG 483 N 1.20 -0.06 -0.54 1.61 1.81 -1.26 -2.90 118.95 118.80 3g6j s ARG 483 Ca 0.00 0.37 -0.20 0.00 -1.72 0.00 0.00 55.73 54.18 3g6j s ARG 483 Cb 0.00 -0.45 0.07 0.00 -0.45 0.00 0.00 34.95 34.12 3g6j s ARG 483 CO 0.00 -0.30 0.69 -1.14 -0.68 0.00 0.00 175.30 173.87 3g6j s GLN 484 N 2.00 3.11 0.67 3.54 2.00 -0.50 -4.96 119.66 125.53 3g6j s GLN 484 Ca 0.03 -0.97 -0.15 0.00 -2.00 0.00 0.00 55.36 52.26 3g6j s GLN 484 Cb -0.12 -4.15 0.01 0.00 0.80 0.00 0.00 33.01 29.55 3g6j s GLN 484 CO -0.03 -1.37 1.14 0.14 -0.50 0.00 0.00 175.29 174.66 3g6j s VAL 485 N 2.82 2.99 0.02 1.34 -7.23 -1.26 -0.66 120.40 118.42 3g6j s VAL 485 Ca 0.15 0.47 0.00 0.00 -1.81 0.00 0.00 61.98 60.80 3g6j s VAL 485 Cb -0.20 -3.00 -0.02 0.00 0.56 0.00 0.00 36.38 33.72 3g6j s VAL 485 CO 0.11 -0.28 -0.03 -0.60 -0.31 0.00 0.00 175.10 173.99 3g6j s ARG 486 N -4.02 0.27 0.02 4.82 3.52 -0.69 -4.84 118.95 118.04 3g6j s ARG 486 Ca 0.69 -0.48 0.06 0.00 -0.13 0.00 0.00 55.73 55.87 3g6j s ARG 486 Cb -0.23 0.03 -0.02 0.00 -1.56 0.00 0.00 34.95 33.17 3g6j s ARG 486 CO 0.42 -0.02 -0.17 -1.21 -0.81 0.00 0.00 175.30 173.51 3g6j s GLU 487 N -1.11 1.20 0.04 5.12 2.02 -1.26 -4.38 118.70 120.33 3g6j s GLU 487 Ca -0.11 -0.75 -0.38 0.00 0.02 0.00 0.00 54.97 53.74 3g6j s GLU 487 Cb -0.08 -1.23 -0.18 0.00 0.10 0.00 0.00 34.13 32.74 3g6j s GLU 487 CO -0.01 0.32 1.20 -2.30 0.02 0.00 0.00 175.26 174.49 3g6j n PRO 488 N 2.15 0.56 0.00 0.39 -0.02 -1.26 -1.33 135.00 135.48 3g6j n PRO 488 Ca -0.17 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3g6j n PRO 488 Cb 0.54 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 3g6j n PRO 488 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g6j n GLY 489 N 2.00 3.27 3.55 -1.23 0.00 -1.26 -5.00 105.19 106.51 3g6j n GLY 489 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3g6j n GLY 489 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6j s GLN 490 N -0.59 2.58 0.26 1.61 -0.21 -0.44 -4.81 119.66 118.06 3g6j s GLN 490 Ca 0.00 0.23 0.11 0.00 0.02 0.00 0.00 55.36 55.72 3g6j s GLN 490 Cb 0.00 -4.69 0.30 0.00 1.00 0.00 0.00 33.01 29.62 3g6j s GLN 490 CO 0.00 -3.03 1.57 -0.44 -2.12 0.00 0.00 175.29 171.27 3g6j h ASP 491 N 13.41 0.00 -3.56 5.90 5.19 -1.90 -3.45 116.42 132.02 3g6j h ASP 491 Ca -0.10 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 55.98 3g6j h ASP 491 Cb 1.09 0.00 -0.33 0.00 0.18 0.00 0.00 39.33 40.27 3g6j h ASP 491 CO 1.21 0.64 -0.75 -0.22 -3.12 0.00 0.00 179.24 177.01 3g6j s LEU 492 N -7.34 1.32 0.00 1.55 0.20 -1.26 -0.12 118.68 113.03 3g6j s LEU 492 Ca -0.01 -0.03 0.02 0.00 0.69 0.00 0.00 54.13 54.81 3g6j s LEU 492 Cb 0.12 -0.21 -0.01 0.00 -0.43 0.00 0.00 46.19 45.66 3g6j s LEU 492 CO 0.76 -0.08 -0.07 0.68 -0.29 0.00 0.00 176.35 177.35 3g6j s VAL 493 N 0.82 0.55 -0.20 1.68 -7.23 -1.01 -4.98 120.40 110.03 3g6j s VAL 493 Ca -0.08 -0.43 -0.06 0.00 -1.81 0.00 0.00 61.98 59.59 3g6j s VAL 493 Cb -0.11 -0.49 -0.03 0.00 0.56 0.00 0.00 36.38 36.30 3g6j s VAL 493 CO -0.01 0.06 0.04 0.68 -0.31 0.00 0.00 175.10 175.56 3g6j s VAL 494 N -0.37 4.42 -0.36 1.32 -7.23 -1.26 -0.83 120.40 116.10 3g6j s VAL 494 Ca 0.01 -0.15 -0.20 0.00 -1.81 0.00 0.00 61.98 59.82 3g6j s VAL 494 Cb -0.04 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 33.90 3g6j s VAL 494 CO -0.00 0.43 0.63 -0.22 -0.31 0.00 0.00 175.10 175.63 3g6j s LEU 495 N 0.77 4.26 -0.80 1.32 2.96 0.36 -4.92 118.68 122.64 3g6j s LEU 495 Ca 0.02 0.14 -0.26 0.00 -0.22 0.00 0.00 54.13 53.81 3g6j s LEU 495 Cb -0.14 -2.78 0.02 0.00 0.50 0.00 0.00 46.19 43.80 3g6j s LEU 495 CO 0.02 -0.59 1.43 -2.84 -1.32 0.00 0.00 176.35 173.05 3g6j s PRO 496 N 2.70 3.17 -0.21 0.98 0.02 -1.26 -1.29 135.00 139.11 3g6j s PRO 496 Ca 0.24 -0.34 -0.17 0.00 0.02 0.00 0.00 61.00 60.76 3g6j s PRO 496 Cb -0.14 -4.54 -0.04 0.00 0.02 0.00 0.00 34.50 29.80 3g6j s PRO 496 CO 0.15 -2.31 0.43 -1.17 -0.33 0.00 0.00 177.00 173.77 3g6j s LEU 497 N 6.24 4.13 0.05 -5.54 2.96 -0.66 -4.94 118.68 120.93 3g6j s LEU 497 Ca 0.44 0.53 -0.16 0.00 -0.22 0.00 0.00 54.13 54.71 3g6j s LEU 497 Cb -0.07 -2.56 -0.06 0.00 0.50 0.00 0.00 46.19 44.00 3g6j s LEU 497 CO 0.09 -0.13 0.49 -0.94 -1.32 0.00 0.00 176.35 174.54 3g6j s SER 498 N 1.17 6.91 -0.13 3.68 1.04 -1.26 0.28 113.70 125.39 3g6j s SER 498 Ca 0.20 1.09 -0.15 0.00 0.48 0.00 0.00 55.95 57.57 3g6j s SER 498 Cb -0.15 -2.30 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 3g6j s SER 498 CO 0.09 0.27 0.36 -0.63 0.98 0.00 0.00 173.24 174.30 3g6j s ILE 499 N -1.16 5.24 0.40 -1.02 -1.09 -1.05 -4.93 121.20 117.61 3g6j s ILE 499 Ca 0.28 0.69 0.04 0.00 -2.23 0.00 0.00 60.65 59.43 3g6j s ILE 499 Cb -0.18 -3.69 -0.05 0.00 -1.58 0.00 0.00 42.46 36.97 3g6j s ILE 499 CO 0.17 0.40 0.06 0.42 -1.23 0.00 0.00 174.94 174.75 3g6j s THR 500 N 0.28 1.17 0.25 2.92 -4.23 -1.26 -1.19 115.64 113.57 3g6j s THR 500 Ca 0.20 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.07 3g6j s THR 500 Cb -0.14 -2.58 0.38 0.00 1.34 0.00 0.00 72.50 71.49 3g6j s THR 500 CO 0.07 0.00 2.08 0.71 -0.54 0.00 0.00 174.62 176.94 3g6j h THR 501 N 1.81 0.00 0.00 3.99 1.35 -1.94 -0.86 112.91 117.26 3g6j h THR 501 Ca -0.41 -0.17 -0.02 0.00 -0.55 0.00 0.00 66.41 65.26 3g6j h THR 501 Cb 1.27 1.06 -0.00 0.00 -1.73 0.00 0.00 68.15 68.75 3g6j h THR 501 CO 0.69 0.00 -0.09 0.44 -0.25 0.00 0.00 175.52 176.31 3g6j h ASP 502 N 0.00 0.00 0.60 5.36 5.19 -1.98 -2.75 116.42 122.84 3g6j h ASP 502 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3g6j h ASP 502 Cb 0.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.70 3g6j h ASP 502 CO 0.00 0.09 0.00 0.49 -3.12 0.00 0.00 179.24 176.70 3g6j n PHE 503 N -3.68 0.00 -2.54 4.55 3.72 -0.33 -4.80 117.46 114.38 3g6j n PHE 503 Ca -0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.98 3g6j n PHE 503 Cb 0.20 -0.34 -0.05 0.00 -0.94 0.00 0.00 39.48 38.35 3g6j n PHE 503 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3g6j s ILE 504 N -2.68 3.68 -0.01 4.37 1.01 -1.04 -2.50 121.20 124.04 3g6j s ILE 504 Ca 0.22 1.64 0.11 0.00 0.00 0.00 0.00 60.65 62.62 3g6j s ILE 504 Cb 0.18 -4.04 -0.16 0.00 0.01 0.00 0.00 42.46 38.44 3g6j s ILE 504 CO 0.42 0.37 1.06 1.55 0.00 0.00 0.00 174.94 178.34 3g6j h PRO 505 N 4.17 0.00 -3.07 2.79 0.13 -1.90 -3.45 132.00 130.67 3g6j h PRO 505 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3g6j h PRO 505 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3g6j h PRO 505 CO 0.68 0.66 0.23 -1.54 -0.23 0.00 0.00 178.00 177.81 3g6j s SER 506 N -6.35 -0.03 0.21 1.44 1.04 -1.04 -1.63 113.70 107.34 3g6j s SER 506 Ca -0.01 -1.02 -0.21 0.00 0.48 0.00 0.00 55.95 55.20 3g6j s SER 506 Cb 0.09 0.81 0.04 0.00 0.10 0.00 0.00 66.02 67.06 3g6j s SER 506 CO 0.81 -1.57 0.62 0.72 0.98 0.00 0.00 173.24 174.79 3g6j s PHE 507 N -2.80 -0.30 -0.07 5.02 -0.71 -0.19 -4.39 117.98 114.54 3g6j s PHE 507 Ca 0.15 -0.03 0.04 0.00 -1.04 0.00 0.00 56.93 56.05 3g6j s PHE 507 Cb -0.05 0.56 -0.00 0.00 -1.21 0.00 0.00 43.02 42.32 3g6j s PHE 507 CO 0.11 -1.00 -0.20 1.03 -1.34 0.00 0.00 175.22 173.82 3g6j s ARG 508 N -3.84 2.36 -0.35 1.99 0.52 -0.24 0.08 118.95 119.47 3g6j s ARG 508 Ca 0.07 -0.72 -0.11 0.00 -0.52 0.00 0.00 55.73 54.45 3g6j s ARG 508 Cb -0.03 -1.90 0.01 0.00 0.52 0.00 0.00 34.95 33.55 3g6j s ARG 508 CO -0.03 0.20 0.20 -1.17 0.02 0.00 0.00 175.30 174.52 3g6j s LEU 509 N 0.24 4.50 -0.15 2.53 1.98 0.65 -0.75 118.68 127.67 3g6j s LEU 509 Ca -0.11 -0.75 -0.02 0.00 -2.89 0.00 0.00 54.13 50.36 3g6j s LEU 509 Cb -0.15 -2.04 -0.02 0.00 0.66 0.00 0.00 46.19 44.64 3g6j s LEU 509 CO 0.05 -0.30 -0.08 -0.69 -1.89 0.00 0.00 176.35 173.44 3g6j s VAL 510 N 1.60 3.46 0.08 1.68 1.01 0.11 -1.12 120.40 127.23 3g6j s VAL 510 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.52 3g6j s VAL 510 Cb -0.18 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 3g6j s VAL 510 CO 0.07 0.50 -0.06 0.00 0.00 0.00 0.00 175.10 175.61 3g6j s ALA 511 N 0.48 0.82 0.18 5.51 0.00 -0.23 0.17 121.76 128.69 3g6j s ALA 511 Ca -0.06 -1.19 -0.18 0.00 0.00 0.00 0.00 51.96 50.53 3g6j s ALA 511 Cb -0.15 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.15 3g6j s ALA 511 CO 0.04 -0.20 0.50 1.52 0.00 0.00 0.00 175.76 177.61 3g6j s TYR 512 N -3.14 -0.17 0.27 0.00 -0.85 0.05 -1.16 117.35 112.35 3g6j s TYR 512 Ca 0.06 -0.16 0.02 0.00 -0.52 0.00 0.00 57.07 56.47 3g6j s TYR 512 Cb 0.02 0.37 -0.05 0.00 0.38 0.00 0.00 41.96 42.68 3g6j s TYR 512 CO -0.04 -0.86 0.09 1.52 -1.52 0.00 0.00 175.55 174.74 3g6j s TYR 513 N -3.85 1.58 -0.05 -3.49 -0.85 0.05 -1.35 117.35 109.40 3g6j s TYR 513 Ca 0.07 -1.17 -0.16 0.00 -0.52 0.00 0.00 57.07 55.29 3g6j s TYR 513 Cb -0.00 -0.94 0.03 0.00 0.38 0.00 0.00 41.96 41.43 3g6j s TYR 513 CO -0.06 -0.31 0.37 -0.08 -1.52 0.00 0.00 175.55 173.96 3g6j s THR 514 N -3.71 0.04 0.16 -3.49 -1.32 -1.26 -2.01 115.64 104.05 3g6j s THR 514 Ca 0.38 -0.32 -0.22 0.00 -1.21 0.00 0.00 61.69 60.33 3g6j s THR 514 Cb 0.08 -0.65 0.08 0.00 -1.51 0.00 0.00 72.50 70.50 3g6j s THR 514 CO 0.14 -0.17 1.03 0.00 -2.21 0.00 0.00 174.62 173.40 3g6j n LEU 515 N 1.58 0.00 -4.14 9.08 -0.00 -0.86 -4.88 117.00 117.78 3g6j n LEU 515 Ca -0.19 -1.31 -0.25 0.00 -0.00 0.00 0.00 56.01 54.26 3g6j n LEU 515 Cb 0.56 2.63 -0.15 0.00 -0.00 0.00 0.00 43.42 46.46 3g6j n LEU 515 CO 0.20 -0.44 -0.50 0.27 -0.00 0.00 0.00 177.39 176.93 3g6j s ILE 516 N -2.07 1.33 0.09 1.47 -5.25 -1.25 -0.49 121.20 115.03 3g6j s ILE 516 Ca 0.23 -0.70 0.00 0.00 -0.99 0.00 0.00 60.65 59.19 3g6j s ILE 516 Cb -0.03 -1.12 0.00 0.00 2.95 0.00 0.00 42.46 44.26 3g6j s ILE 516 CO 0.05 0.38 0.00 0.61 -1.79 0.00 0.00 174.94 174.19 3g6j n GLY 517 N 2.82 -1.57 3.57 6.27 0.00 -1.26 -4.99 105.19 110.03 3g6j n GLY 517 Ca -0.16 0.58 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 3g6j n GLY 517 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g6j s ALA 518 N -1.91 1.79 0.11 4.61 0.00 -1.26 -4.69 121.76 120.40 3g6j s ALA 518 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.22 3g6j s ALA 518 Cb 0.00 -4.59 0.00 0.00 0.00 0.00 0.00 23.12 18.53 3g6j s ALA 518 CO 0.00 -4.82 0.00 -1.13 0.00 0.00 0.00 175.76 169.81 3g6j n SER 519 N 13.69 -2.94 -2.07 0.00 3.41 -1.26 -4.24 113.62 120.21 3g6j n SER 519 Ca 0.41 0.53 -0.14 0.00 -0.26 0.00 0.00 58.87 59.41 3g6j n SER 519 Cb 0.47 -1.49 -0.15 0.00 -0.26 0.00 0.00 64.21 62.78 3g6j n SER 519 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g6j n GLY 520 N -2.11 3.23 3.55 5.00 0.00 -1.26 -4.90 105.19 108.70 3g6j n GLY 520 Ca 0.00 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 3g6j n GLY 520 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6j s GLN 521 N 0.50 3.78 -0.66 1.61 1.11 -1.26 -5.01 119.66 119.72 3g6j s GLN 521 Ca 0.64 -0.46 -0.27 0.00 0.01 0.00 0.00 55.36 55.29 3g6j s GLN 521 Cb 0.32 -3.02 0.00 0.00 -1.01 0.00 0.00 33.01 29.30 3g6j s GLN 521 CO -0.04 0.25 1.59 0.50 0.01 0.00 0.00 175.29 177.60 3g6j s ARG 522 N 0.38 2.91 -0.02 2.91 6.06 -1.26 -3.95 118.95 125.97 3g6j s ARG 522 Ca -0.02 0.24 -0.11 0.00 -2.50 0.00 0.00 55.73 53.35 3g6j s ARG 522 Cb -0.14 -4.28 -0.05 0.00 0.06 0.00 0.00 34.95 30.54 3g6j s ARG 522 CO 0.02 -2.44 0.31 -2.00 -2.50 0.00 0.00 175.30 168.69 3g6j s GLU 523 N 6.40 3.71 -0.07 5.12 2.12 0.35 -4.96 118.70 131.37 3g6j s GLU 523 Ca 0.53 0.16 0.02 0.00 0.36 0.00 0.00 54.97 56.04 3g6j s GLU 523 Cb -0.11 -3.16 0.01 0.00 0.26 0.00 0.00 34.13 31.13 3g6j s GLU 523 CO 0.19 0.70 -0.13 0.08 -0.54 0.00 0.00 175.26 175.55 3g6j s VAL 524 N -1.14 1.21 -0.06 3.70 1.01 -1.26 -2.03 120.40 121.83 3g6j s VAL 524 Ca 0.23 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.73 3g6j s VAL 524 Cb -0.14 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.13 3g6j s VAL 524 CO 0.12 0.37 -0.18 -0.69 0.00 0.00 0.00 175.10 174.72 3g6j s VAL 525 N 0.71 1.57 0.11 2.92 1.01 -0.85 -4.73 120.40 121.13 3g6j s VAL 525 Ca -0.14 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.03 3g6j s VAL 525 Cb -0.16 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 3g6j s VAL 525 CO 0.03 0.45 0.14 0.00 0.00 0.00 0.00 175.10 175.72 3g6j s ALA 526 N 0.23 0.23 0.02 5.51 0.00 -1.26 -0.77 121.76 125.72 3g6j s ALA 526 Ca -0.10 -1.01 -0.19 0.00 0.00 0.00 0.00 51.96 50.67 3g6j s ALA 526 Cb -0.14 0.64 0.04 0.00 0.00 0.00 0.00 23.12 23.65 3g6j s ALA 526 CO 0.04 -0.52 0.42 0.34 0.00 0.00 0.00 175.76 176.05 3g6j s ASP 527 N -2.95 -0.31 0.25 0.00 2.15 -0.31 -4.65 116.67 110.86 3g6j s ASP 527 Ca 0.13 0.13 0.06 0.00 0.43 0.00 0.00 52.55 53.30 3g6j s ASP 527 Cb 0.06 0.41 -0.05 0.00 -0.30 0.00 0.00 42.92 43.03 3g6j s ASP 527 CO -0.05 -0.60 -0.06 -0.94 -0.17 0.00 0.00 175.17 173.35 3g6j s SER 528 N -1.71 2.51 -0.22 -0.34 1.04 -1.26 -1.07 113.70 112.66 3g6j s SER 528 Ca -0.08 -1.17 -0.12 0.00 0.48 0.00 0.00 55.95 55.06 3g6j s SER 528 Cb -0.02 -0.12 0.07 0.00 0.10 0.00 0.00 66.02 66.05 3g6j s SER 528 CO 0.01 -0.35 0.53 0.54 0.98 0.00 0.00 173.24 174.95 3g6j s VAL 529 N -3.10 -0.01 -0.09 5.02 0.11 -0.28 -2.51 120.40 119.54 3g6j s VAL 529 Ca 0.28 0.05 -0.15 0.00 -2.93 0.00 0.00 61.98 59.23 3g6j s VAL 529 Cb 0.03 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 34.06 3g6j s VAL 529 CO 0.10 0.02 0.37 0.86 -3.33 0.00 0.00 175.10 173.12 3g6j s TRP 530 N 1.45 3.58 -0.05 1.54 -0.00 -0.86 -0.26 118.94 124.35 3g6j s TRP 530 Ca -0.09 0.81 0.01 0.00 -0.00 0.00 0.00 56.10 56.83 3g6j s TRP 530 Cb -0.07 -2.35 0.02 0.00 -0.00 0.00 0.00 33.47 31.07 3g6j s TRP 530 CO -0.15 0.40 -0.05 0.08 -0.00 0.00 0.00 176.95 177.22 3g6j s VAL 531 N -0.14 0.60 0.15 5.86 1.01 0.11 -4.98 120.40 123.02 3g6j s VAL 531 Ca 0.21 -0.16 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 3g6j s VAL 531 Cb -0.15 -0.61 -0.07 0.00 0.00 0.00 0.00 36.38 35.55 3g6j s VAL 531 CO 0.09 0.24 0.59 -0.62 0.00 0.00 0.00 175.10 175.40 3g6j s ASP 532 N 0.87 6.90 0.25 3.32 2.15 -1.26 -1.03 116.67 127.87 3g6j s ASP 532 Ca -0.12 1.17 0.12 0.00 0.43 0.00 0.00 52.55 54.15 3g6j s ASP 532 Cb -0.15 -2.32 -0.05 0.00 -0.30 0.00 0.00 42.92 40.10 3g6j s ASP 532 CO 0.01 0.11 -0.21 -0.69 -0.17 0.00 0.00 175.17 174.22 3g6j s VAL 533 N -1.44 2.47 0.07 1.11 1.01 -0.65 -4.02 120.40 118.96 3g6j s VAL 533 Ca 0.38 -2.27 -0.30 0.00 0.00 0.00 0.00 61.98 59.79 3g6j s VAL 533 Cb -0.16 -2.26 -0.09 0.00 0.00 0.00 0.00 36.38 33.87 3g6j s VAL 533 CO 0.19 -0.30 1.84 -0.75 0.00 0.00 0.00 175.10 176.08 3g6j s LYS 534 N -3.23 4.15 -1.29 2.72 2.47 -0.43 -4.69 119.74 119.43 3g6j s LYS 534 Ca 0.27 2.53 -0.09 0.00 -1.56 0.00 0.00 55.97 57.13 3g6j s LYS 534 Cb -0.06 -3.83 -0.08 0.00 -1.46 0.00 0.00 37.83 32.40 3g6j s LYS 534 CO 0.13 -0.87 2.98 -0.25 0.16 0.00 0.00 175.35 177.51 3g6j n ASP 535 N 6.46 8.05 -3.88 1.43 9.92 -1.26 -4.92 116.55 132.35 3g6j n ASP 535 Ca 0.18 -2.66 -0.29 0.00 -0.53 0.00 0.00 54.79 51.49 3g6j n ASP 535 Cb 0.40 -1.50 0.20 0.00 -0.64 0.00 0.00 41.12 39.58 3g6j n ASP 535 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3g6j n SER 536 N 3.05 0.09 -4.75 -2.24 3.41 -1.26 -4.85 113.62 107.07 3g6j n SER 536 Ca 0.70 -1.47 -0.32 0.00 -0.26 0.00 0.00 58.87 57.52 3g6j n SER 536 Cb 0.35 -1.01 0.08 0.00 -0.26 0.00 0.00 64.21 63.38 3g6j n SER 536 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g6j h VAL 538 N -0.71 0.48 0.00 0.00 2.07 -1.97 -3.45 116.25 112.68 3g6j h VAL 538 Ca -0.45 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3g6j h VAL 538 Cb 1.25 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3g6j h VAL 538 CO 0.51 0.08 0.00 0.61 0.02 0.00 0.00 177.57 178.79 3g6j n GLY 539 N -0.40 1.02 3.48 2.17 0.00 -1.26 -4.99 105.19 105.22 3g6j n GLY 539 Ca -0.10 -0.78 -0.17 0.00 0.00 0.00 0.00 46.02 44.98 3g6j n GLY 539 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6j s SER 540 N -1.00 -0.61 -0.13 1.61 1.04 -1.26 -5.08 113.70 108.27 3g6j s SER 540 Ca 0.00 0.54 -0.06 0.00 0.48 0.00 0.00 55.95 56.92 3g6j s SER 540 Cb 0.00 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.71 3g6j s SER 540 CO 0.00 -0.66 0.29 -0.22 0.98 0.00 0.00 173.24 173.63 3g6j s LEU 541 N -1.49 -0.07 -0.03 2.42 2.96 -1.25 -3.57 118.68 117.66 3g6j s LEU 541 Ca -0.09 0.65 -0.01 0.00 -0.22 0.00 0.00 54.13 54.45 3g6j s LEU 541 Cb -0.00 0.86 0.03 0.00 0.50 0.00 0.00 46.19 47.57 3g6j s LEU 541 CO 0.05 -0.21 0.07 -0.69 -1.32 0.00 0.00 176.35 174.26 3g6j s VAL 542 N 1.92 -0.04 -0.14 1.68 1.01 -1.08 -4.98 120.40 118.77 3g6j s VAL 542 Ca -0.04 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 3g6j s VAL 542 Cb -0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 36.38 36.12 3g6j s VAL 542 CO -0.09 0.06 -0.09 -0.69 0.00 0.00 0.00 175.10 174.28 3g6j s VAL 543 N 0.85 3.38 0.32 2.92 1.01 -1.26 -0.85 120.40 126.77 3g6j s VAL 543 Ca -0.07 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 3g6j s VAL 543 Cb -0.09 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.85 3g6j s VAL 543 CO -0.03 0.52 0.51 -1.59 0.00 0.00 0.00 175.10 174.50 3g6j s LYS 544 N 0.31 1.83 0.05 2.72 -2.85 -0.51 -5.01 119.74 116.28 3g6j s LYS 544 Ca -0.08 -1.57 -0.26 0.00 -1.00 0.00 0.00 55.97 53.07 3g6j s LYS 544 Cb -0.15 0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 36.03 3g6j s LYS 544 CO 0.05 -0.77 0.80 0.45 0.10 0.00 0.00 175.35 175.97 3g6j s SER 545 N -3.15 7.26 0.00 0.03 0.15 -1.26 0.05 113.70 116.78 3g6j s SER 545 Ca 0.26 1.50 0.23 0.00 0.70 0.00 0.00 55.95 58.64 3g6j s SER 545 Cb -0.01 -2.49 0.13 0.00 -1.71 0.00 0.00 66.02 61.95 3g6j s SER 545 CO 0.16 0.00 1.15 0.61 1.20 0.00 0.00 173.24 176.36 3g6j n GLY 546 N 2.37 -1.12 2.74 9.45 0.00 -0.61 -4.70 105.19 113.32 3g6j n GLY 546 Ca -0.02 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 3g6j n GLY 546 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3g6j n GLN 547 N -1.50 2.17 -1.73 1.61 -0.06 -1.22 -4.52 117.38 112.13 3g6j n GLN 547 Ca 0.05 -1.77 -0.05 0.00 -2.00 0.00 0.00 57.00 53.23 3g6j n GLN 547 Cb 0.33 -2.72 -0.01 0.00 -4.06 0.00 0.00 30.24 23.79 3g6j n GLN 547 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 3g6j n SER 548 N 5.31 -0.52 0.00 1.69 3.41 -1.26 -4.63 113.62 117.63 3g6j n SER 548 Ca 0.51 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3g6j n SER 548 Cb 0.25 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 3g6j n SER 548 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3g6j n GLU 549 N -1.32 0.00 -1.71 4.33 0.00 -1.26 -4.74 120.64 115.93 3g6j n GLU 549 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 57.16 57.12 3g6j n GLU 549 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.65 3g6j n GLU 549 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3g6j n ASP 550 N 0.00 -0.71 0.00 -1.84 4.64 -1.26 -4.73 116.55 112.64 3g6j n ASP 550 Ca 0.00 -0.05 0.00 0.00 -1.38 0.00 0.00 54.79 53.36 3g6j n ASP 550 Cb 0.00 -0.21 0.00 0.00 -1.04 0.00 0.00 41.12 39.87 3g6j n ASP 550 CO 0.00 0.00 0.00 -2.11 -0.82 0.00 0.00 177.20 174.27 3g6j n ARG 551 N -0.24 0.00 -1.45 -0.67 1.85 -1.26 -5.13 116.66 109.76 3g6j n ARG 551 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 3g6j n ARG 551 Cb 0.09 -0.01 0.00 0.00 -1.05 0.00 0.00 32.46 31.49 3g6j n ARG 551 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 3g6j n GLN 552 N -2.02 0.00 -1.22 2.89 -0.06 -1.26 -5.05 117.38 110.66 3g6j n GLN 552 Ca 0.00 0.50 -0.30 0.00 -2.00 0.00 0.00 57.00 55.20 3g6j n GLN 552 Cb 0.00 -0.95 0.22 0.00 -4.06 0.00 0.00 30.24 25.45 3g6j n GLN 552 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 3g6j s PRO 553 N -1.09 -0.70 0.14 3.69 0.04 -1.26 -5.08 135.00 130.75 3g6j s PRO 553 Ca 0.00 -0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.09 3g6j s PRO 553 Cb 0.00 -1.65 -0.04 0.00 0.04 0.00 0.00 34.50 32.85 3g6j s PRO 553 CO 0.00 -3.37 -0.17 0.08 0.04 0.00 0.00 177.00 173.57 3g6j s VAL 554 N -3.12 1.67 0.29 -0.36 1.01 -1.26 -5.08 120.40 113.55 3g6j s VAL 554 Ca 0.70 -1.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.59 3g6j s VAL 554 Cb -0.10 -1.72 -0.14 0.00 0.00 0.00 0.00 36.38 34.42 3g6j s VAL 554 CO 0.56 -0.31 1.06 -2.65 0.00 0.00 0.00 175.10 173.76 3g6j n PRO 555 N 0.47 1.46 0.00 2.72 -0.02 -1.26 -1.81 135.00 136.56 3g6j n PRO 555 Ca -0.15 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3g6j n PRO 555 Cb 0.56 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 3g6j n PRO 555 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g6j n GLY 556 N 1.22 2.91 3.77 -1.23 0.00 -1.26 -5.01 105.19 105.60 3g6j n GLY 556 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 3g6j n GLY 556 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3g6j s GLN 557 N -0.13 3.63 0.54 1.61 0.74 -0.75 -5.02 119.66 120.28 3g6j s GLN 557 Ca 0.00 1.72 -0.18 0.00 0.05 0.00 0.00 55.36 56.95 3g6j s GLN 557 Cb 0.00 -2.27 -0.06 0.00 1.10 0.00 0.00 33.01 31.78 3g6j s GLN 557 CO 0.00 -0.65 1.06 -0.65 -0.55 0.00 0.00 175.29 174.50 3g6j s GLN 558 N -2.90 3.51 0.13 1.67 -0.21 -1.26 -4.95 119.66 115.65 3g6j s GLN 558 Ca 0.67 1.31 -0.14 0.00 0.02 0.00 0.00 55.36 57.22 3g6j s GLN 558 Cb -0.27 -2.05 0.02 0.00 1.00 0.00 0.00 33.01 31.71 3g6j s GLN 558 CO 0.32 -0.66 0.36 0.00 -2.12 0.00 0.00 175.29 173.18 3g6j s MET 559 N -3.65 1.06 -0.11 2.91 0.23 -1.26 -5.00 119.30 113.47 3g6j s MET 559 Ca 0.66 -0.81 -0.03 0.00 -1.03 0.00 0.00 55.69 54.48 3g6j s MET 559 Cb -0.17 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.54 3g6j s MET 559 CO 0.29 -0.40 -0.01 0.99 -2.03 0.00 0.00 175.02 173.86 3g6j s THR 560 N -3.83 4.22 -0.19 3.16 2.01 -1.26 -5.03 115.64 114.71 3g6j s THR 560 Ca 0.05 -0.27 0.01 0.00 0.31 0.00 0.00 61.69 61.79 3g6j s THR 560 Cb 0.02 -2.80 0.03 0.00 0.01 0.00 0.00 72.50 69.76 3g6j s THR 560 CO -0.10 0.56 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.99 3g6j s LEU 561 N -0.46 2.29 -0.24 4.42 2.96 -1.26 -1.57 118.68 124.82 3g6j s LEU 561 Ca 0.08 -0.74 -0.24 0.00 -0.22 0.00 0.00 54.13 53.01 3g6j s LEU 561 Cb -0.12 -1.48 -0.01 0.00 0.50 0.00 0.00 46.19 45.08 3g6j s LEU 561 CO 0.02 -0.03 0.81 -0.54 -1.32 0.00 0.00 176.35 175.30 3g6j s LYS 562 N 1.27 4.18 -0.20 1.98 1.02 0.11 -4.84 119.74 123.26 3g6j s LYS 562 Ca 0.03 0.92 -0.06 0.00 0.02 0.00 0.00 55.97 56.88 3g6j s LYS 562 Cb -0.14 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.50 3g6j s LYS 562 CO -0.12 -0.50 0.02 0.42 -0.92 0.00 0.00 175.35 174.25 3g6j s ILE 563 N 2.77 4.11 -0.70 2.17 1.01 -1.26 -1.43 121.20 127.88 3g6j s ILE 563 Ca 0.34 -0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.76 3g6j s ILE 563 Cb -0.15 -2.87 0.17 0.00 0.01 0.00 0.00 42.46 39.62 3g6j s ILE 563 CO 0.08 0.42 0.50 -1.61 0.00 0.00 0.00 174.94 174.32 3g6j s GLU 564 N 1.00 2.54 0.00 2.79 2.02 -0.03 -4.98 118.70 122.04 3g6j s GLU 564 Ca 0.02 -3.13 0.00 0.00 0.02 0.00 0.00 54.97 51.89 3g6j s GLU 564 Cb -0.14 -3.54 0.00 0.00 0.10 0.00 0.00 34.13 30.55 3g6j s GLU 564 CO 0.02 -1.24 0.00 0.41 0.02 0.00 0.00 175.26 174.47 3g6j n GLY 565 N 2.39 4.40 3.83 -1.39 0.00 -1.26 -2.64 105.19 110.53 3g6j n GLY 565 Ca 0.16 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.77 3g6j n GLY 565 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g6j s ASP 566 N -0.27 6.91 0.26 1.61 1.01 -1.23 -4.89 116.67 120.07 3g6j s ASP 566 Ca 0.00 1.36 -0.30 0.00 0.71 0.00 0.00 52.55 54.31 3g6j s ASP 566 Cb 0.00 -2.40 -0.11 0.00 1.01 0.00 0.00 42.92 41.43 3g6j s ASP 566 CO 0.00 -0.10 1.50 -2.28 0.21 0.00 0.00 175.17 174.50 3g6j s HIS 567 N -1.77 2.92 -0.43 4.23 5.65 -1.26 -2.42 115.29 122.21 3g6j s HIS 567 Ca 0.49 0.92 0.00 0.00 0.25 0.00 0.00 55.06 56.72 3g6j s HIS 567 Cb -0.13 -3.92 0.00 0.00 -1.18 0.00 0.00 32.58 27.35 3g6j s HIS 567 CO 0.19 -3.04 0.00 0.41 -0.65 0.00 0.00 174.74 171.65 3g6j n GLY 568 N 2.27 0.63 3.86 1.59 0.00 -1.26 -5.01 105.19 107.28 3g6j n GLY 568 Ca 0.08 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 3g6j n GLY 568 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g6j s ALA 569 N -1.89 3.77 0.37 4.61 0.00 -1.02 -5.09 121.76 122.51 3g6j s ALA 569 Ca 0.00 -0.40 -0.22 0.00 0.00 0.00 0.00 51.96 51.34 3g6j s ALA 569 Cb 0.00 -2.22 -0.10 0.00 0.00 0.00 0.00 23.12 20.80 3g6j s ALA 569 CO 0.00 0.56 0.90 0.50 0.00 0.00 0.00 175.76 177.72 3g6j s ARG 570 N -1.45 4.31 -0.05 0.00 3.52 -1.26 -4.93 118.95 119.09 3g6j s ARG 570 Ca 0.26 1.10 -0.02 0.00 -0.13 0.00 0.00 55.73 56.94 3g6j s ARG 570 Cb -0.14 -2.45 0.03 0.00 -1.56 0.00 0.00 34.95 30.82 3g6j s ARG 570 CO 0.14 0.12 0.04 0.08 -0.81 0.00 0.00 175.30 174.87 3g6j s VAL 571 N -1.93 0.03 0.05 7.11 1.01 -1.26 -5.07 120.40 120.34 3g6j s VAL 571 Ca 0.56 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.88 3g6j s VAL 571 Cb -0.13 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 3g6j s VAL 571 CO 0.17 0.19 0.09 0.68 0.00 0.00 0.00 175.10 176.23 3g6j s VAL 572 N 2.11 4.65 0.16 2.92 -7.23 -1.26 -5.12 120.40 116.63 3g6j s VAL 572 Ca 0.05 -0.64 0.04 0.00 -1.81 0.00 0.00 61.98 59.62 3g6j s VAL 572 Cb -0.12 -3.21 -0.05 0.00 0.56 0.00 0.00 36.38 33.56 3g6j s VAL 572 CO -0.04 0.19 -0.08 -0.76 -0.31 0.00 0.00 175.10 174.10 3g6j s LEU 573 N -2.21 2.46 -0.08 1.32 1.43 -1.26 -5.16 118.68 115.18 3g6j s LEU 573 Ca 0.28 -1.05 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 3g6j s LEU 573 Cb -0.12 -0.30 0.07 0.00 0.03 0.00 0.00 46.19 45.87 3g6j s LEU 573 CO 0.20 -0.38 0.69 0.54 0.23 0.00 0.00 176.35 177.63 3g6j s VAL 574 N -3.38 0.00 -0.07 -1.59 0.11 -1.26 -5.14 120.40 109.06 3g6j s VAL 574 Ca 0.18 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.26 3g6j s VAL 574 Cb 0.03 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.89 3g6j s VAL 574 CO 0.01 0.00 -0.15 0.00 -3.33 0.00 0.00 175.10 171.63 3g6j s ALA 575 N -0.99 1.48 -0.03 1.54 0.00 -1.26 -5.14 121.76 117.37 3g6j s ALA 575 Ca -0.10 -0.56 0.04 0.00 0.00 0.00 0.00 51.96 51.34 3g6j s ALA 575 Cb -0.01 -0.61 -0.00 0.00 0.00 0.00 0.00 23.12 22.50 3g6j s ALA 575 CO 0.09 0.17 -0.14 0.08 0.00 0.00 0.00 175.76 175.96 3g6j s VAL 576 N 0.53 1.12 -0.13 0.00 1.01 -1.26 -5.09 120.40 116.58 3g6j s VAL 576 Ca -0.14 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 3g6j s VAL 576 Cb -0.16 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3g6j s VAL 576 CO 0.05 0.33 1.65 -0.62 0.00 0.00 0.00 175.10 176.50 3g6j s ASP 577 N -0.01 6.51 0.09 3.32 -1.08 -1.26 -4.87 116.67 119.37 3g6j s ASP 577 Ca -0.01 1.95 0.05 0.00 -0.52 0.00 0.00 52.55 54.02 3g6j s ASP 577 Cb -0.09 -2.53 0.30 0.00 -1.46 0.00 0.00 42.92 39.14 3g6j s ASP 577 CO 0.01 -1.10 1.13 0.29 0.52 0.00 0.00 175.17 176.02 3g6j n LYS 578 N 7.39 0.04 0.21 4.34 5.02 -1.26 -0.27 118.16 133.63 3g6j n LYS 578 Ca 0.18 0.50 0.06 0.00 -2.02 0.00 0.00 58.31 57.04 3g6j n LYS 578 Cb 0.44 -1.67 0.54 0.00 -0.02 0.00 0.00 35.03 34.33 3g6j n LYS 578 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3g6j h GLY 579 N 0.00 0.08 0.63 0.72 0.00 -1.89 -2.22 103.07 100.40 3g6j h GLY 579 Ca 0.00 -0.04 0.11 0.00 0.00 0.00 0.00 47.33 47.40 3g6j h GLY 579 CO 0.00 0.04 0.60 -2.08 0.00 0.00 0.00 176.54 175.10 3g6j h VAL 580 N 0.08 0.95 0.00 4.60 2.07 -1.00 -2.40 116.25 120.55 3g6j h VAL 580 Ca 0.02 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3g6j h VAL 580 Cb 0.14 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 3g6j h VAL 580 CO 0.01 0.17 -0.19 -0.26 0.02 0.00 0.00 177.57 177.31 3g6j h PHE 581 N 0.93 0.00 -0.02 1.57 0.04 -1.52 -1.50 116.94 116.44 3g6j h PHE 581 Ca 0.44 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.19 3g6j h PHE 581 Cb 0.44 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 3g6j h PHE 581 CO -0.00 0.00 -0.08 0.28 -0.60 0.00 0.00 178.31 177.90 3g6j h VAL 582 N 0.00 1.07 0.03 -0.55 2.07 -1.34 -3.21 116.25 114.34 3g6j h VAL 582 Ca 0.00 -0.34 -0.34 0.00 0.82 0.00 0.00 66.70 66.83 3g6j h VAL 582 Cb 0.84 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 3g6j h VAL 582 CO 0.00 0.10 -2.06 0.18 0.02 0.00 0.00 177.57 175.81 3g6j n LEU 583 N -4.42 1.52 -3.62 2.57 4.32 -1.01 -4.94 117.00 111.42 3g6j n LEU 583 Ca -0.02 0.18 -0.04 0.00 -0.02 0.00 0.00 56.01 56.11 3g6j n LEU 583 Cb 0.17 -0.29 -0.06 0.00 -1.62 0.00 0.00 43.42 41.62 3g6j n LEU 583 CO 0.35 0.63 0.44 0.21 -1.22 0.00 0.00 177.39 177.80 3g6j s ASN 584 N -6.30 -0.84 0.00 -1.43 3.84 -0.60 -5.04 114.94 104.57 3g6j s ASN 584 Ca -0.16 1.28 0.00 0.00 0.21 0.00 0.00 52.86 54.19 3g6j s ASN 584 Cb 0.07 1.57 0.00 0.00 -0.55 0.00 0.00 41.25 42.34 3g6j s ASN 584 CO 0.77 -0.19 0.79 2.29 -2.79 0.00 0.00 177.10 177.97 3g6j n LYS 585 N 4.48 1.70 -2.09 0.43 2.85 -1.26 -3.91 118.16 120.37 3g6j n LYS 585 Ca -0.17 -1.11 -0.32 0.00 -1.05 0.00 0.00 58.31 55.66 3g6j n LYS 585 Cb 0.56 -0.90 0.00 0.00 -0.65 0.00 0.00 35.03 34.04 3g6j n LYS 585 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3g6j s LYS 586 N -0.63 3.46 -0.98 -1.58 1.02 -1.26 -4.21 119.74 115.57 3g6j s LYS 586 Ca 0.00 1.09 -0.05 0.00 0.02 0.00 0.00 55.97 57.04 3g6j s LYS 586 Cb 0.00 -2.06 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 3g6j s LYS 586 CO 0.00 -0.69 0.61 0.09 -0.92 0.00 0.00 175.35 174.45 3g6j n ASN 587 N -2.05 -4.81 -4.72 2.83 5.03 -1.26 -4.84 115.26 105.44 3g6j n ASN 587 Ca 0.08 -0.28 -0.38 0.00 0.87 0.00 0.00 54.58 54.86 3g6j n ASN 587 Cb 0.53 -3.53 -0.06 0.00 -1.02 0.00 0.00 39.78 35.71 3g6j n ASN 587 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3g6j s LYS 588 N -5.61 4.35 0.24 3.52 1.02 -1.26 -4.86 119.74 117.15 3g6j s LYS 588 Ca 0.30 0.52 -0.30 0.00 0.02 0.00 0.00 55.97 56.52 3g6j s LYS 588 Cb -0.13 -3.44 -0.10 0.00 -0.52 0.00 0.00 37.83 33.63 3g6j s LYS 588 CO 0.38 0.13 1.50 -1.17 -0.92 0.00 0.00 175.35 175.27 3g6j s LEU 589 N 0.69 4.37 0.03 3.17 2.96 -1.26 -5.02 118.68 123.63 3g6j s LEU 589 Ca 0.28 2.73 -0.04 0.00 -0.22 0.00 0.00 54.13 56.88 3g6j s LEU 589 Cb -0.16 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 42.90 3g6j s LEU 589 CO 0.12 -0.77 0.05 -0.89 -1.32 0.00 0.00 176.35 173.54 3g6j s THR 590 N 0.19 0.14 0.22 3.68 2.01 -1.26 -5.04 115.64 115.58 3g6j s THR 590 Ca 0.62 -1.14 -0.04 0.00 0.31 0.00 0.00 61.69 61.44 3g6j s THR 590 Cb -0.44 -0.83 0.03 0.00 0.01 0.00 0.00 72.50 71.27 3g6j s THR 590 CO 0.42 -0.63 1.63 -0.61 -0.69 0.00 0.00 174.62 174.74 3g6j h GLN 591 N 3.82 0.75 0.00 4.92 5.75 -1.99 -2.26 115.11 126.10 3g6j h GLN 591 Ca -0.33 -0.31 -0.07 0.00 -0.15 0.00 0.00 58.65 57.80 3g6j h GLN 591 Cb 1.18 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.69 3g6j h GLN 591 CO 0.50 0.92 -0.32 0.66 -2.65 0.00 0.00 178.83 177.94 3g6j h SER 592 N 0.65 0.00 0.52 -0.69 4.64 -1.97 -2.60 113.55 114.10 3g6j h SER 592 Ca 0.09 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.29 3g6j h SER 592 Cb 0.74 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 3g6j h SER 592 CO 0.06 0.32 -0.56 0.11 -0.87 0.00 0.00 176.83 175.89 3g6j h LYS 593 N 0.00 0.04 -0.16 4.77 1.57 -1.87 -0.64 116.57 120.28 3g6j h LYS 593 Ca -0.00 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 3g6j h LYS 593 Cb 0.77 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 3g6j h LYS 593 CO 0.04 0.59 -0.13 0.82 -0.57 0.00 0.00 179.45 180.19 3g6j h ILE 594 N 0.03 1.33 -0.30 1.86 2.04 -1.08 -2.59 117.51 118.81 3g6j h ILE 594 Ca -0.00 -1.26 -0.10 0.00 1.00 0.00 0.00 64.86 64.50 3g6j h ILE 594 Cb 1.00 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 3g6j h ILE 594 CO 0.07 0.37 -0.22 -0.50 0.00 0.00 0.00 178.15 177.88 3g6j h TRP 595 N 0.02 0.63 -0.40 1.37 -0.00 -1.46 -1.92 115.95 114.19 3g6j h TRP 595 Ca 0.03 -0.13 0.00 0.00 -0.00 0.00 0.00 58.89 58.79 3g6j h TRP 595 Cb 0.65 -0.16 -0.02 0.00 -0.00 0.00 0.00 29.16 29.63 3g6j h TRP 595 CO 0.08 0.74 0.26 -0.44 -0.00 0.00 0.00 178.44 179.08 3g6j h ASP 596 N 0.50 0.47 -0.21 -3.49 5.19 -1.11 -0.25 116.42 117.52 3g6j h ASP 596 Ca 0.08 -0.03 0.04 0.00 -0.62 0.00 0.00 57.03 56.50 3g6j h ASP 596 Cb 0.65 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.01 3g6j h ASP 596 CO 0.05 0.36 -0.01 0.58 -3.12 0.00 0.00 179.24 177.09 3g6j h VAL 597 N 0.54 0.84 -0.10 -1.35 2.07 -1.34 -2.41 116.25 114.51 3g6j h VAL 597 Ca 0.15 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.65 3g6j h VAL 597 Cb -0.04 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3g6j h VAL 597 CO -0.03 0.01 0.05 0.58 0.02 0.00 0.00 177.57 178.20 3g6j h VAL 598 N 0.06 1.00 0.00 2.57 2.07 -0.79 -2.70 116.25 118.46 3g6j h VAL 598 Ca 0.10 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 3g6j h VAL 598 Cb 0.13 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3g6j h VAL 598 CO -0.17 0.02 -0.26 -0.33 0.02 0.00 0.00 177.57 176.85 3g6j h GLU 599 N 0.11 0.00 0.00 1.57 5.08 -1.04 -1.73 114.58 118.57 3g6j h GLU 599 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3g6j h GLU 599 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3g6j h GLU 599 CO -0.02 0.26 0.00 1.63 -1.00 0.00 0.00 179.01 179.88 3g6j n LYS 600 N -3.52 0.18 -0.73 2.33 5.02 -0.91 -2.86 118.16 117.67 3g6j n LYS 600 Ca -0.00 0.28 0.08 0.00 -2.02 0.00 0.00 58.31 56.65 3g6j n LYS 600 Cb 0.42 -1.77 0.36 0.00 -0.02 0.00 0.00 35.03 34.02 3g6j n LYS 600 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g6j n ALA 601 N -1.72 3.48 -1.77 7.82 0.00 -0.65 -4.98 120.51 122.68 3g6j n ALA 601 Ca 0.04 -1.89 -0.38 0.00 0.00 0.00 0.00 53.44 51.21 3g6j n ALA 601 Cb 0.31 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 3g6j n ALA 601 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3g6j s ASP 602 N -1.03 6.74 0.19 0.00 2.15 -1.14 -4.82 116.67 118.77 3g6j s ASP 602 Ca 0.51 2.17 0.22 0.00 0.43 0.00 0.00 52.55 55.89 3g6j s ASP 602 Cb 0.37 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 40.38 3g6j s ASP 602 CO 0.17 -0.51 1.02 2.30 -0.17 0.00 0.00 175.17 177.98 3g6j n ILE 603 N 0.15 0.59 -2.34 4.11 -5.35 -1.26 -4.85 119.36 110.41 3g6j n ILE 603 Ca 0.04 -0.54 -0.38 0.00 -0.27 0.00 0.00 62.75 61.60 3g6j n ILE 603 Cb 0.48 -0.32 -0.02 0.00 -1.74 0.00 0.00 39.64 38.04 3g6j n ILE 603 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3g6j s GLY 604 N -4.36 2.83 0.00 3.28 0.00 -1.26 -4.34 107.32 103.47 3g6j s GLY 604 Ca -0.01 0.91 0.00 0.00 0.00 0.00 0.00 44.72 45.62 3g6j s GLY 604 CO 0.80 1.40 0.00 0.00 0.00 0.00 0.00 173.10 175.29 3g6j s THR 606 N -1.97 5.39 -0.82 0.00 2.01 -1.16 -4.98 115.64 114.12 3g6j s THR 606 Ca 0.00 -0.08 0.04 0.00 0.31 0.00 0.00 61.69 61.96 3g6j s THR 606 Cb 0.00 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 69.00 3g6j s THR 606 CO 0.00 0.32 1.10 -2.65 -0.69 0.00 0.00 174.62 172.70 3g6j n PRO 607 N 0.94 0.03 0.00 4.92 -0.02 -1.26 -4.83 135.00 134.77 3g6j n PRO 607 Ca -0.10 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3g6j n PRO 607 Cb 0.53 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 3g6j n PRO 607 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g6j n GLY 608 N -1.45 1.94 7.00 -1.23 0.00 -1.26 -2.03 105.19 108.17 3g6j n GLY 608 Ca -0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3g6j n GLY 608 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3g6j n SER 609 N 0.00 -3.87 -3.71 1.61 2.88 -1.05 -4.41 113.62 105.08 3g6j n SER 609 Ca 0.00 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.57 3g6j n SER 609 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3g6j n SER 609 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3g6j s GLY 610 N -4.38 -0.36 0.44 0.46 0.00 -1.26 -4.38 107.32 97.84 3g6j s GLY 610 Ca 0.00 0.58 0.26 0.00 0.00 0.00 0.00 44.72 45.56 3g6j s GLY 610 CO 0.00 2.42 1.72 0.07 0.00 0.00 0.00 173.10 177.30 3g6j h LYS 611 N 2.00 0.00 0.00 2.90 2.10 -1.86 -3.40 116.57 118.31 3g6j h LYS 611 Ca -0.28 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.43 3g6j h LYS 611 Cb 1.19 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.51 3g6j h LYS 611 CO 0.30 0.00 0.30 -0.40 -2.00 0.00 0.00 179.45 177.65 3g6j n ASP 612 N -3.00 -1.15 -0.22 7.07 5.75 -1.26 -1.69 116.55 122.04 3g6j n ASP 612 Ca 0.03 -1.68 -0.06 0.00 -0.01 0.00 0.00 54.79 53.07 3g6j n ASP 612 Cb 0.46 1.89 0.04 0.00 -1.03 0.00 0.00 41.12 42.48 3g6j n ASP 612 CO 0.00 0.00 0.00 0.10 -0.11 0.00 0.00 177.20 177.19 3g6j h TYR 613 N 1.60 0.83 -0.73 2.11 -0.00 -1.85 0.60 116.97 119.53 3g6j h TYR 613 Ca -0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 58.73 58.53 3g6j h TYR 613 Cb 0.73 -0.27 -0.03 0.00 0.00 0.00 0.00 36.73 37.16 3g6j h TYR 613 CO 0.00 0.58 0.39 0.00 -0.00 0.00 0.00 178.16 179.13 3g6j h ALA 614 N 1.18 0.93 -0.48 0.10 0.00 -1.93 -2.65 119.26 116.41 3g6j h ALA 614 Ca 0.22 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3g6j h ALA 614 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3g6j h ALA 614 CO -0.04 0.46 0.19 0.78 0.00 0.00 0.00 179.25 180.64 3g6j h GLY 615 N 1.01 0.73 0.86 0.00 0.00 -1.70 -1.78 103.07 102.19 3g6j h GLY 615 Ca 0.25 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 3g6j h GLY 615 CO -0.04 0.34 0.01 -2.08 0.00 0.00 0.00 176.54 174.77 3g6j h VAL 616 N 0.68 1.25 0.23 4.60 2.07 -0.58 -1.18 116.25 123.32 3g6j h VAL 616 Ca 0.17 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3g6j h VAL 616 Cb 0.13 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 3g6j h VAL 616 CO -0.02 0.28 -0.11 -0.26 0.02 0.00 0.00 177.57 177.48 3g6j h PHE 617 N 0.26 -0.29 -0.16 1.57 0.04 -1.33 -2.88 116.94 114.15 3g6j h PHE 617 Ca 0.08 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.85 3g6j h PHE 617 Cb 0.39 0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 3g6j h PHE 617 CO 0.03 -0.13 0.08 0.77 -0.60 0.00 0.00 178.31 178.46 3g6j h SER 618 N -0.37 0.12 0.09 2.17 0.02 -1.27 0.31 113.55 114.62 3g6j h SER 618 Ca -0.03 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 3g6j h SER 618 Cb 0.28 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3g6j h SER 618 CO 0.05 0.09 -0.07 0.44 -1.14 0.00 0.00 176.83 176.21 3g6j h ASP 619 N 0.17 0.00 -0.11 3.07 5.19 -1.25 -0.61 116.42 122.88 3g6j h ASP 619 Ca 0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 3g6j h ASP 619 Cb 0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.52 3g6j h ASP 619 CO -0.04 0.07 0.00 0.00 -3.12 0.00 0.00 179.24 176.15 3g6j n ALA 620 N -2.48 2.53 -1.93 3.45 0.00 -1.01 -0.16 120.51 120.92 3g6j n ALA 620 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3g6j n ALA 620 Cb 0.15 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3g6j n ALA 620 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g6j n GLY 621 N 1.20 0.86 2.95 0.00 0.00 -0.24 -4.19 105.19 105.77 3g6j n GLY 621 Ca 0.17 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 3g6j n GLY 621 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g6j s LEU 622 N -0.98 1.90 0.33 0.99 1.43 0.05 -1.89 118.68 120.50 3g6j s LEU 622 Ca 0.00 -0.10 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 3g6j s LEU 622 Cb 0.00 -0.31 -0.07 0.00 0.03 0.00 0.00 46.19 45.84 3g6j s LEU 622 CO 0.00 0.05 0.70 0.42 0.23 0.00 0.00 176.35 177.75 3g6j s THR 623 N 0.03 4.79 -0.02 5.49 -4.23 0.41 -3.14 115.64 118.97 3g6j s THR 623 Ca 0.00 0.68 0.01 0.00 -1.18 0.00 0.00 61.69 61.20 3g6j s THR 623 Cb -0.04 -3.66 0.02 0.00 1.34 0.00 0.00 72.50 70.16 3g6j s THR 623 CO -0.00 -0.29 -0.01 0.12 -0.54 0.00 0.00 174.62 173.90 3g6j s PHE 624 N -2.09 0.30 -0.12 3.99 5.36 -1.26 -3.42 117.98 120.74 3g6j s PHE 624 Ca 0.51 -0.01 -0.09 0.00 -0.96 0.00 0.00 56.93 56.38 3g6j s PHE 624 Cb -0.10 -0.35 0.04 0.00 -0.34 0.00 0.00 43.02 42.27 3g6j s PHE 624 CO 0.24 -0.10 0.31 0.99 -1.46 0.00 0.00 175.22 175.20 3g6j s THR 625 N 0.73 -0.02 0.12 0.12 2.01 -1.00 -0.27 115.64 117.33 3g6j s THR 625 Ca -0.07 0.06 0.04 0.00 0.31 0.00 0.00 61.69 62.02 3g6j s THR 625 Cb -0.10 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 3g6j s THR 625 CO -0.01 0.02 -0.10 -0.94 -0.69 0.00 0.00 174.62 172.90 3g6j s SER 626 N 0.66 1.61 0.59 3.53 1.04 -0.31 -1.18 113.70 119.65 3g6j s SER 626 Ca -0.04 -0.91 0.36 0.00 0.48 0.00 0.00 55.95 55.85 3g6j s SER 626 Cb -0.05 0.00 1.85 0.00 0.10 0.00 0.00 66.02 67.91 3g6j s SER 626 CO -0.04 -0.29 2.18 0.77 0.98 0.00 0.00 173.24 176.83 3g6j h SER 627 N 3.21 0.00 -0.36 7.02 4.64 -1.41 -2.55 113.55 124.09 3g6j h SER 627 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3g6j h SER 627 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3g6j h SER 627 CO 0.58 0.03 0.00 -1.20 -0.87 0.00 0.00 176.83 175.37 3g6j n SER 628 N -3.26 2.24 0.00 4.97 7.64 -1.26 -4.93 113.62 119.02 3g6j n SER 628 Ca -0.02 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.78 3g6j n SER 628 Cb 0.18 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 3g6j n SER 628 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g6j n GLY 629 N 0.96 3.29 3.70 0.23 0.00 -0.96 -5.04 105.19 107.37 3g6j n GLY 629 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3g6j n GLY 629 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6j s GLN 630 N -0.66 4.30 0.17 1.61 1.11 -1.26 -4.84 119.66 120.10 3g6j s GLN 630 Ca 0.00 1.97 -0.21 0.00 0.01 0.00 0.00 55.36 57.13 3g6j s GLN 630 Cb 0.00 -3.49 0.05 0.00 -1.01 0.00 0.00 33.01 28.57 3g6j s GLN 630 CO 0.00 -0.52 0.58 1.14 0.01 0.00 0.00 175.29 176.50 3g6j s GLN 631 N 2.02 1.32 0.76 2.91 -2.07 -1.26 -1.16 119.66 122.18 3g6j s GLN 631 Ca 0.64 -0.61 -0.11 0.00 -1.82 0.00 0.00 55.36 53.46 3g6j s GLN 631 Cb -0.32 0.57 0.05 0.00 -1.09 0.00 0.00 33.01 32.21 3g6j s GLN 631 CO 0.27 -0.57 1.08 0.95 -1.32 0.00 0.00 175.29 175.70 3g6j s THR 632 N -3.79 3.51 1.09 3.63 -4.23 0.63 -4.84 115.64 111.64 3g6j s THR 632 Ca 0.03 0.49 -0.15 0.00 -1.18 0.00 0.00 61.69 60.88 3g6j s THR 632 Cb -0.01 -3.07 0.24 0.00 1.34 0.00 0.00 72.50 71.00 3g6j s THR 632 CO -0.09 -0.64 1.10 0.00 -0.54 0.00 0.00 174.62 174.45 3g6j s ALA 633 N -2.96 0.79 -0.03 3.99 0.00 -1.26 -4.89 121.76 117.40 3g6j s ALA 633 Ca 0.60 -0.65 -0.30 0.00 0.00 0.00 0.00 51.96 51.61 3g6j s ALA 633 Cb -0.16 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 3g6j s ALA 633 CO 0.56 -3.19 1.10 -0.65 0.00 0.00 0.00 175.76 173.58 3g6j s GLN 634 N -5.18 4.44 -0.35 0.00 -1.52 -1.26 -5.03 119.66 110.76 3g6j s GLN 634 Ca 0.68 1.57 -0.08 0.00 -1.95 0.00 0.00 55.36 55.58 3g6j s GLN 634 Cb -0.14 -3.48 0.04 0.00 -0.22 0.00 0.00 33.01 29.20 3g6j s GLN 634 CO 0.57 -0.28 0.14 0.50 -0.25 0.00 0.00 175.29 175.97 3g6j s ARG 635 N 1.62 2.69 0.00 2.91 3.52 -1.26 -4.92 118.95 123.51 3g6j s ARG 635 Ca 0.54 -1.15 0.14 0.00 -0.13 0.00 0.00 55.73 55.13 3g6j s ARG 635 Cb -0.23 -3.55 0.14 0.00 -1.56 0.00 0.00 34.95 29.75 3g6j s ARG 635 CO 0.24 -0.68 0.99 0.00 -0.81 0.00 0.00 175.30 175.04 3g6j n ALA 636 N 4.87 2.45 -2.61 6.12 0.00 -1.26 -4.03 120.51 126.06 3g6j n ALA 636 Ca -0.12 -0.67 -0.39 0.00 0.00 0.00 0.00 53.44 52.26 3g6j n ALA 636 Cb 0.45 -0.49 -0.09 0.00 0.00 0.00 0.00 19.45 19.32 3g6j n ALA 636 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3g6j s GLU 637 N -1.18 4.01 0.47 0.00 2.56 -1.26 -4.95 118.70 118.36 3g6j s GLU 637 Ca 0.18 0.12 0.27 0.00 0.00 0.00 0.00 54.97 55.54 3g6j s GLU 637 Cb 0.12 -3.66 0.85 0.00 2.00 0.00 0.00 34.13 33.45 3g6j s GLU 637 CO 0.18 -0.32 1.79 -0.07 -0.56 0.00 0.00 175.26 176.29 3g6j h LEU 638 N 8.68 0.00 -9.86 2.70 3.38 -1.99 -3.45 115.31 114.77 3g6j h LEU 638 Ca -0.31 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.15 3g6j h LEU 638 Cb 1.15 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 3g6j h LEU 638 CO 0.67 0.09 -0.53 -1.58 0.09 0.00 0.00 178.44 177.18 3g6j s GLN 639 N -3.47 2.67 0.75 1.13 2.00 -1.26 -5.04 119.66 116.44 3g6j s GLN 639 Ca 0.03 -1.26 -0.11 0.00 -2.00 0.00 0.00 55.36 52.02 3g6j s GLN 639 Cb 0.08 -2.41 0.04 0.00 0.80 0.00 0.00 33.01 31.52 3g6j s GLN 639 CO 0.62 0.27 1.08 0.00 -0.50 0.00 0.00 175.29 176.76 3g6j s PRO 641 N -4.94 2.50 0.00 0.00 0.02 -1.26 -5.17 135.00 126.15 3g6j s PRO 641 Ca 0.60 1.56 0.00 0.00 0.02 0.00 0.00 61.00 63.18 3g6j s PRO 641 Cb -0.16 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.46 3g6j s PRO 641 CO 0.56 -1.52 0.00 1.04 -0.33 0.00 0.00 177.00 176.75