#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4h h GLU 5 N 0.00 0.00 -0.05 -1.46 4.81 -2.03 -2.08 114.58 113.77 2c4h h GLU 5 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2c4h h GLU 5 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2c4h h GLU 5 CO 0.00 0.06 0.00 1.28 -0.73 0.00 0.00 179.01 179.62 2c4h n LEU 6 N -3.34 2.16 -4.37 1.64 4.77 -1.26 -4.82 117.00 111.77 2c4h n LEU 6 Ca -0.01 -0.75 -0.34 0.00 -0.03 0.00 0.00 56.01 54.87 2c4h n LEU 6 Cb 0.22 -0.02 -0.14 0.00 -2.33 0.00 0.00 43.42 41.15 2c4h n LEU 6 CO 0.27 0.37 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.10 2c4h s LEU 7 N -1.93 2.97 -0.05 2.23 1.98 -0.78 0.39 118.68 123.48 2c4h s LEU 7 Ca 0.34 -0.31 0.02 0.00 -2.89 0.00 0.00 54.13 51.29 2c4h s LEU 7 Cb 0.20 -1.74 0.02 0.00 0.66 0.00 0.00 46.19 45.34 2c4h s LEU 7 CO 0.32 0.05 -0.08 -0.69 -1.89 0.00 0.00 176.35 174.06 2c4h s VAL 8 N 1.03 0.78 -0.31 1.68 1.01 -0.02 -4.80 120.40 119.77 2c4h s VAL 8 Ca 0.01 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 2c4h s VAL 8 Cb -0.15 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2c4h s VAL 8 CO 0.00 0.27 0.23 0.21 0.00 0.00 0.00 175.10 175.82 2c4h s ASN 9 N 0.73 6.06 0.53 3.32 2.47 -1.26 -0.42 114.94 126.37 2c4h s ASN 9 Ca -0.12 -0.18 0.06 0.00 0.42 0.00 0.00 52.86 53.04 2c4h s ASN 9 Cb -0.14 -2.14 0.03 0.00 -1.45 0.00 0.00 41.25 37.55 2c4h s ASN 9 CO 0.02 -0.15 0.42 0.42 -3.72 0.00 0.00 177.10 174.08 2c4h s THR 10 N 1.78 1.83 0.26 -5.21 -4.23 0.01 -4.93 115.64 105.15 2c4h s THR 10 Ca 0.07 -1.45 0.33 0.00 -1.18 0.00 0.00 61.69 59.47 2c4h s THR 10 Cb -0.17 -2.28 0.37 0.00 1.34 0.00 0.00 72.50 71.76 2c4h s THR 10 CO 0.11 0.00 2.05 0.11 -0.54 0.00 0.00 174.62 176.35 2c4h h LYS 11 N 0.77 0.00 0.00 3.99 1.57 -1.94 -2.07 116.57 118.90 2c4h h LYS 11 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 2c4h h LYS 11 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2c4h h LYS 11 CO 0.57 0.05 -0.79 0.43 -0.57 0.00 0.00 179.45 179.13 2c4h n SER 12 N -3.22 0.63 0.00 0.86 7.64 -1.26 -4.91 113.62 113.36 2c4h n SER 12 Ca -0.01 -0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.62 2c4h n SER 12 Cb 0.27 0.54 0.00 0.00 -1.01 0.00 0.00 64.21 64.01 2c4h n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c4h n GLY 13 N 1.42 1.00 3.81 0.23 0.00 -0.78 -0.98 105.19 109.90 2c4h n GLY 13 Ca 0.03 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.71 2c4h n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c4h s LYS 14 N -1.09 4.33 0.02 1.61 1.02 -1.25 -0.81 119.74 123.57 2c4h s LYS 14 Ca 0.00 1.01 0.04 0.00 0.02 0.00 0.00 55.97 57.04 2c4h s LYS 14 Cb 0.00 -2.76 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 2c4h s LYS 14 CO 0.00 0.31 -0.12 0.54 -0.92 0.00 0.00 175.35 175.15 2c4h s VAL 15 N -1.64 0.95 -0.21 3.17 0.11 0.44 -0.89 120.40 122.34 2c4h s VAL 15 Ca 0.48 -0.81 0.01 0.00 -2.93 0.00 0.00 61.98 58.73 2c4h s VAL 15 Cb -0.16 -0.86 0.04 0.00 -1.53 0.00 0.00 36.38 33.88 2c4h s VAL 15 CO 0.21 0.05 -0.12 -0.32 -3.33 0.00 0.00 175.10 171.59 2c4h s MET 16 N -0.87 2.22 0.00 1.54 1.75 -0.29 -0.84 119.30 122.80 2c4h s MET 16 Ca 0.01 -0.94 0.00 0.00 -1.25 0.00 0.00 55.69 53.52 2c4h s MET 16 Cb -0.07 -2.53 0.00 0.00 2.84 0.00 0.00 34.83 35.07 2c4h s MET 16 CO 0.01 -0.42 0.00 0.41 -0.65 0.00 0.00 175.02 174.36 2c4h n GLY 17 N 4.63 0.19 3.07 2.11 0.00 0.16 -0.75 105.19 114.60 2c4h n GLY 17 Ca -0.15 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 43.96 2c4h n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2c4h s THR 18 N 0.47 0.42 -0.22 2.61 -1.32 0.64 -4.69 115.64 113.54 2c4h s THR 18 Ca 0.00 -1.36 -0.20 0.00 -1.21 0.00 0.00 61.69 58.92 2c4h s THR 18 Cb 0.00 -0.92 -0.02 0.00 -1.51 0.00 0.00 72.50 70.04 2c4h s THR 18 CO 0.00 -0.63 0.62 -0.60 -2.21 0.00 0.00 174.62 171.80 2c4h s ARG 19 N -2.46 4.17 0.07 7.08 3.52 -1.26 -0.75 118.95 129.31 2c4h s ARG 19 Ca -0.04 0.57 0.09 0.00 -0.13 0.00 0.00 55.73 56.23 2c4h s ARG 19 Cb -0.03 -3.61 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 2c4h s ARG 19 CO -0.03 -0.30 -0.25 0.14 -0.81 0.00 0.00 175.30 174.05 2c4h s VAL 20 N 2.13 2.27 0.36 7.11 -7.23 -0.54 -4.98 120.40 119.52 2c4h s VAL 20 Ca 0.27 -1.46 -0.19 0.00 -1.81 0.00 0.00 61.98 58.80 2c4h s VAL 20 Cb -0.16 -1.93 -0.10 0.00 0.56 0.00 0.00 36.38 34.76 2c4h s VAL 20 CO 0.09 0.29 0.84 -2.16 -0.31 0.00 0.00 175.10 173.86 2c4h s PRO 21 N -1.49 4.17 -0.30 4.82 0.04 -1.26 -1.37 135.00 139.61 2c4h s PRO 21 Ca 0.13 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 2c4h s PRO 21 Cb -0.10 -2.40 0.13 0.00 0.04 0.00 0.00 34.50 32.17 2c4h s PRO 21 CO 0.04 0.11 0.68 0.54 0.04 0.00 0.00 177.00 178.40 2c4h s VAL 22 N -1.99 -0.90 -1.21 -0.36 0.11 -0.03 -4.90 120.40 111.10 2c4h s VAL 22 Ca 0.56 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.30 2c4h s VAL 22 Cb -0.11 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.77 2c4h s VAL 22 CO 0.16 0.00 0.68 0.18 -3.33 0.00 0.00 175.10 172.79 2c4h n LEU 23 N 5.35 -0.78 -2.37 2.54 4.32 -1.26 -0.89 117.00 123.91 2c4h n LEU 23 Ca -0.12 -1.25 -0.19 0.00 -0.02 0.00 0.00 56.01 54.43 2c4h n LEU 23 Cb 0.50 -1.77 -0.01 0.00 -1.62 0.00 0.00 43.42 40.51 2c4h n LEU 23 CO -0.04 0.74 -0.24 -1.54 -1.22 0.00 0.00 177.39 175.09 2c4h n SER 24 N -2.28 -5.47 -0.21 -1.43 3.41 -1.26 -4.93 113.62 101.45 2c4h n SER 24 Ca -0.12 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2c4h n SER 24 Cb 0.57 -4.58 0.00 0.00 -0.26 0.00 0.00 64.21 59.94 2c4h n SER 24 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2c4h n SER 25 N -1.93 0.00 -3.72 4.04 2.88 -0.07 -5.19 113.62 109.62 2c4h n SER 25 Ca -0.22 -0.21 -0.10 0.00 -1.33 0.00 0.00 58.87 57.00 2c4h n SER 25 Cb 0.67 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.07 2c4h n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2c4h s HIS 26 N -2.59 -0.09 0.26 0.66 0.09 -1.26 -0.85 115.29 111.50 2c4h s HIS 26 Ca 0.00 -0.18 -0.08 0.00 -0.00 0.00 0.00 55.06 54.80 2c4h s HIS 26 Cb 0.00 0.13 -0.01 0.00 -0.00 0.00 0.00 32.58 32.70 2c4h s HIS 26 CO 0.00 -0.60 0.41 0.96 -0.00 0.00 0.00 174.74 175.51 2c4h s ILE 27 N -3.39 0.00 0.04 0.60 -4.36 -0.47 -4.39 121.20 109.22 2c4h s ILE 27 Ca 0.01 -1.57 -0.07 0.00 -0.26 0.00 0.00 60.65 58.76 2c4h s ILE 27 Cb 0.02 -2.36 -0.05 0.00 1.25 0.00 0.00 42.46 41.31 2c4h s ILE 27 CO -0.09 0.00 0.31 -0.44 0.24 0.00 0.00 174.94 174.96 2c4h s SER 28 N -3.09 6.53 -0.05 4.36 0.01 -0.21 -1.47 113.70 119.76 2c4h s SER 28 Ca 0.28 0.61 0.01 0.00 1.31 0.00 0.00 55.95 58.15 2c4h s SER 28 Cb 0.01 -2.11 0.02 0.00 0.21 0.00 0.00 66.02 64.15 2c4h s SER 28 CO 0.12 0.22 -0.06 0.00 0.41 0.00 0.00 173.24 173.93 2c4h s ALA 29 N -1.35 0.81 -0.36 1.44 0.00 0.07 -0.53 121.76 121.83 2c4h s ALA 29 Ca 0.30 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.12 2c4h s ALA 29 Cb -0.13 -0.50 0.10 0.00 0.00 0.00 0.00 23.12 22.59 2c4h s ALA 29 CO 0.18 -0.05 0.10 -0.06 0.00 0.00 0.00 175.76 175.92 2c4h s PHE 30 N 1.01 3.67 -0.07 0.00 0.40 0.55 -0.26 117.98 123.28 2c4h s PHE 30 Ca -0.09 -2.73 -0.02 0.00 -0.60 0.00 0.00 56.93 53.48 2c4h s PHE 30 Cb -0.14 -2.99 -0.04 0.00 0.51 0.00 0.00 43.02 40.36 2c4h s PHE 30 CO -0.00 -0.95 0.05 -0.51 0.70 0.00 0.00 175.22 174.50 2c4h s LEU 31 N 1.01 3.81 -0.35 -0.37 1.43 -0.15 -0.20 118.68 123.85 2c4h s LEU 31 Ca 0.09 0.20 -0.00 0.00 -1.03 0.00 0.00 54.13 53.38 2c4h s LEU 31 Cb -0.20 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.02 2c4h s LEU 31 CO -0.06 0.35 0.06 0.61 0.23 0.00 0.00 176.35 177.54 2c4h n GLY 32 N 1.82 0.31 3.68 -3.19 0.00 -1.15 -4.03 105.19 102.63 2c4h n GLY 32 Ca -0.17 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 2c4h n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c4h s ILE 33 N -2.44 4.54 0.16 -0.61 1.01 -0.30 -4.77 121.20 118.79 2c4h s ILE 33 Ca 0.03 1.84 -0.30 0.00 0.00 0.00 0.00 60.65 62.22 2c4h s ILE 33 Cb -0.01 -4.18 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 2c4h s ILE 33 CO 0.04 -0.03 1.08 -2.16 0.00 0.00 0.00 174.94 173.87 2c4h s PRO 34 N 2.31 4.61 0.00 2.79 0.04 -1.26 -0.13 135.00 143.36 2c4h s PRO 34 Ca 0.51 1.66 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2c4h s PRO 34 Cb -0.21 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2c4h s PRO 34 CO 0.18 0.09 0.30 1.97 0.04 0.00 0.00 177.00 179.58 2c4h n PHE 35 N 2.52 0.00 -3.80 0.56 1.16 -1.11 -4.86 117.46 111.92 2c4h n PHE 35 Ca 0.03 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.51 2c4h n PHE 35 Cb 0.47 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.28 2c4h n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2c4h s ALA 36 N -0.38 -0.46 0.44 1.98 0.00 -1.26 -3.04 121.76 119.04 2c4h s ALA 36 Ca 0.00 -0.47 -0.23 0.00 0.00 0.00 0.00 51.96 51.26 2c4h s ALA 36 Cb 0.00 0.67 -0.08 0.00 0.00 0.00 0.00 23.12 23.72 2c4h s ALA 36 CO 0.00 -0.61 1.13 -1.21 0.00 0.00 0.00 175.76 175.07 2c4h s GLU 37 N -3.87 3.89 -0.07 0.00 0.41 0.95 -4.40 118.70 115.61 2c4h s GLU 37 Ca 0.08 1.70 -0.33 0.00 -0.41 0.00 0.00 54.97 56.00 2c4h s GLU 37 Cb 0.03 -2.46 -0.11 0.00 -1.78 0.00 0.00 34.13 29.81 2c4h s GLU 37 CO -0.08 -0.42 1.91 -2.30 -0.49 0.00 0.00 175.26 173.88 2c4h n PRO 38 N -0.34 2.32 -1.25 0.39 -0.02 -1.26 -4.65 135.00 130.19 2c4h n PRO 38 Ca 0.06 0.85 -0.36 0.00 -2.02 0.00 0.00 63.50 62.03 2c4h n PRO 38 Cb 0.48 -2.73 -0.02 0.00 -0.02 0.00 0.00 33.50 31.21 2c4h n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2c4h n PRO 39 N 6.91 3.22 -4.18 0.52 -0.04 -1.26 -4.89 135.00 135.28 2c4h n PRO 39 Ca 0.22 -2.10 -0.24 0.00 -0.04 0.00 0.00 63.50 61.34 2c4h n PRO 39 Cb 0.32 -2.80 -0.07 0.00 -0.04 0.00 0.00 33.50 30.91 2c4h n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2c4h s VAL 40 N 2.63 2.57 0.00 0.52 -7.23 -1.26 -3.88 120.40 113.75 2c4h s VAL 40 Ca 0.61 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 2c4h s VAL 40 Cb 0.16 -2.94 0.00 0.00 0.56 0.00 0.00 36.38 34.16 2c4h s VAL 40 CO -0.05 -0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 2c4h n GLY 41 N -1.14 3.28 0.00 2.32 0.00 -1.26 -1.43 105.19 106.96 2c4h n GLY 41 Ca -0.02 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.95 2c4h n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2c4h n ASN 42 N 6.60 0.00 -0.10 1.61 0.23 -1.26 -2.24 115.26 120.11 2c4h n ASN 42 Ca 0.00 -0.31 0.13 0.00 -0.53 0.00 0.00 54.58 53.87 2c4h n ASN 42 Cb 0.00 -0.14 0.35 0.00 -2.08 0.00 0.00 39.78 37.90 2c4h n ASN 42 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2c4h n MET 43 N -1.14 0.35 -2.03 -3.83 2.81 -0.51 -4.83 117.12 107.94 2c4h n MET 43 Ca 0.12 -0.19 -0.42 0.00 -1.81 0.00 0.00 57.70 55.40 2c4h n MET 43 Cb 0.11 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 2c4h n MET 43 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2c4h s ARG 44 N -2.78 4.27 0.00 0.03 3.52 -0.95 -1.83 118.95 121.21 2c4h s ARG 44 Ca 0.17 2.27 0.00 0.00 -0.13 0.00 0.00 55.73 58.04 2c4h s ARG 44 Cb 0.18 -3.15 0.00 0.00 -1.56 0.00 0.00 34.95 30.42 2c4h s ARG 44 CO 0.61 -0.47 0.00 1.19 -0.81 0.00 0.00 175.30 175.82 2c4h n PHE 45 N 3.15 0.00 -2.74 5.12 3.72 -1.26 -4.91 117.46 120.54 2c4h n PHE 45 Ca 0.10 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.24 2c4h n PHE 45 Cb 0.40 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 38.94 2c4h n PHE 45 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2c4h s ARG 46 N -0.00 3.23 0.64 -1.08 0.52 -0.76 -4.04 118.95 117.45 2c4h s ARG 46 Ca 0.00 -0.10 -0.18 0.00 -0.52 0.00 0.00 55.73 54.93 2c4h s ARG 46 Cb 0.00 -2.43 -0.01 0.00 0.52 0.00 0.00 34.95 33.03 2c4h s ARG 46 CO 0.00 -0.33 1.26 1.03 0.02 0.00 0.00 175.30 177.28 2c4h s ARG 47 N -4.72 2.63 0.62 3.54 0.52 -1.26 -4.89 118.95 115.39 2c4h s ARG 47 Ca 0.49 1.95 -0.14 0.00 -0.52 0.00 0.00 55.73 57.51 2c4h s ARG 47 Cb -0.10 -1.87 -0.02 0.00 0.52 0.00 0.00 34.95 33.47 2c4h s ARG 47 CO 0.42 -1.50 1.05 -1.25 0.02 0.00 0.00 175.30 174.04 2c4h s PRO 48 N -3.43 3.24 -0.01 3.54 0.04 -1.26 -5.06 135.00 132.06 2c4h s PRO 48 Ca 0.80 1.08 0.05 0.00 0.04 0.00 0.00 61.00 62.97 2c4h s PRO 48 Cb -0.34 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 2c4h s PRO 48 CO 0.38 -0.86 -0.16 -1.21 0.04 0.00 0.00 177.00 175.19 2c4h s GLU 49 N -4.46 2.33 0.52 4.56 0.41 -1.26 -5.02 118.70 115.78 2c4h s GLU 49 Ca 0.61 -0.81 -0.22 0.00 -0.41 0.00 0.00 54.97 54.13 2c4h s GLU 49 Cb -0.15 -2.29 -0.06 0.00 -1.78 0.00 0.00 34.13 29.86 2c4h s GLU 49 CO 0.44 0.59 1.34 -1.25 -0.49 0.00 0.00 175.26 175.89 2c4h s PRO 50 N -0.99 3.28 0.06 0.39 0.04 -1.26 -0.04 135.00 136.48 2c4h s PRO 50 Ca 0.13 2.20 -0.31 0.00 0.04 0.00 0.00 61.00 63.07 2c4h s PRO 50 Cb -0.11 -2.33 -0.08 0.00 0.04 0.00 0.00 34.50 32.03 2c4h s PRO 50 CO 0.02 -1.07 1.56 0.21 0.04 0.00 0.00 177.00 177.76 2c4h s LYS 51 N -2.82 4.23 0.18 4.56 2.47 -1.17 -4.05 119.74 123.14 2c4h s LYS 51 Ca 0.69 2.22 -0.32 0.00 -1.56 0.00 0.00 55.97 57.00 2c4h s LYS 51 Cb -0.39 -3.53 -0.11 0.00 -1.46 0.00 0.00 37.83 32.34 2c4h s LYS 51 CO 0.47 -0.66 1.70 0.15 0.16 0.00 0.00 175.35 177.18 2c4h s LYS 52 N 2.33 4.15 0.59 4.03 1.02 -1.26 -4.92 119.74 125.69 2c4h s LYS 52 Ca 0.70 2.54 -0.18 0.00 0.02 0.00 0.00 55.97 59.05 2c4h s LYS 52 Cb -0.38 -3.19 -0.07 0.00 -0.52 0.00 0.00 37.83 33.68 2c4h s LYS 52 CO 0.30 -0.73 0.69 -2.30 -0.92 0.00 0.00 175.35 172.40 2c4h n PRO 53 N 4.30 0.63 -4.30 -1.68 -0.02 -1.26 -5.01 135.00 127.65 2c4h n PRO 53 Ca 0.16 0.25 -0.24 0.00 -2.02 0.00 0.00 63.50 61.64 2c4h n PRO 53 Cb 0.37 -1.89 -0.12 0.00 -0.02 0.00 0.00 33.50 31.83 2c4h n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2c4h s TRP 54 N -1.66 1.85 0.35 6.00 -2.14 -0.15 -5.02 118.94 118.17 2c4h s TRP 54 Ca 0.72 -0.42 -0.01 0.00 2.66 0.00 0.00 56.10 59.05 2c4h s TRP 54 Cb -0.43 -1.00 -0.04 0.00 -3.10 0.00 0.00 33.47 28.91 2c4h s TRP 54 CO 0.51 0.24 0.56 -1.54 -2.66 0.00 0.00 176.95 174.07 2c4h s SER 55 N -2.05 6.31 0.00 -2.66 1.04 -1.26 -4.48 113.70 110.60 2c4h s SER 55 Ca 0.09 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.03 2c4h s SER 55 Cb -0.09 -2.06 0.00 0.00 0.10 0.00 0.00 66.02 63.97 2c4h s SER 55 CO 0.05 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2c4h n GLY 56 N -1.69 -2.03 3.42 7.32 0.00 -1.26 -4.88 105.19 106.07 2c4h n GLY 56 Ca -0.04 -1.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 2c4h n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c4h s VAL 57 N -0.07 3.73 -0.13 1.61 1.01 -1.26 -3.91 120.40 121.38 2c4h s VAL 57 Ca 0.00 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 2c4h s VAL 57 Cb 0.00 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2c4h s VAL 57 CO 0.00 0.45 0.97 0.86 0.00 0.00 0.00 175.10 177.38 2c4h s TRP 58 N 0.92 3.48 -0.40 5.22 -0.11 -0.07 -4.90 118.94 123.08 2c4h s TRP 58 Ca 0.00 1.52 -0.29 0.00 1.22 0.00 0.00 56.10 58.55 2c4h s TRP 58 Cb -0.14 -3.16 0.01 0.00 -1.50 0.00 0.00 33.47 28.67 2c4h s TRP 58 CO 0.01 -0.25 1.41 1.21 -4.62 0.00 0.00 176.95 174.72 2c4h s ASN 59 N 1.11 6.36 -0.46 5.86 3.84 -1.26 -1.14 114.94 129.25 2c4h s ASN 59 Ca 0.46 0.88 0.04 0.00 0.21 0.00 0.00 52.86 54.46 2c4h s ASN 59 Cb -0.18 -2.54 0.42 0.00 -0.55 0.00 0.00 41.25 38.41 2c4h s ASN 59 CO 0.16 -1.40 1.26 0.00 -2.79 0.00 0.00 177.10 174.33 2c4h n ALA 60 N 8.71 5.26 0.50 1.71 0.00 0.08 -4.70 120.51 132.07 2c4h n ALA 60 Ca 0.16 -4.17 0.11 0.00 0.00 0.00 0.00 53.44 49.55 2c4h n ALA 60 Cb 0.48 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 19.16 2c4h n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2c4h n SER 61 N -0.55 0.54 -4.18 0.00 3.41 -1.25 -0.98 113.62 110.62 2c4h n SER 61 Ca 0.42 -0.34 -0.11 0.00 -0.26 0.00 0.00 58.87 58.58 2c4h n SER 61 Cb 0.68 1.18 -0.10 0.00 -0.26 0.00 0.00 64.21 65.71 2c4h n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2c4h s THR 62 N -3.24 0.76 0.57 6.66 -4.23 -1.26 -4.84 115.64 110.06 2c4h s THR 62 Ca 0.01 -1.95 -0.20 0.00 -1.18 0.00 0.00 61.69 58.37 2c4h s THR 62 Cb 0.15 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 2c4h s THR 62 CO 0.85 -0.85 1.31 -0.31 -0.54 0.00 0.00 174.62 175.08 2c4h s TYR 63 N -3.56 2.29 0.89 3.99 2.02 -1.26 -3.75 117.35 117.96 2c4h s TYR 63 Ca 0.12 1.43 -0.11 0.00 -0.37 0.00 0.00 57.07 58.15 2c4h s TYR 63 Cb 0.05 -3.70 0.18 0.00 -0.40 0.00 0.00 41.96 38.09 2c4h s TYR 63 CO -0.04 -2.71 1.22 -1.25 -1.57 0.00 0.00 175.55 171.19 2c4h s PRO 64 N -3.08 0.94 0.86 -1.71 0.04 -1.26 -4.88 135.00 125.92 2c4h s PRO 64 Ca 0.75 -0.68 -0.11 0.00 0.04 0.00 0.00 61.00 60.99 2c4h s PRO 64 Cb -0.37 -2.01 0.11 0.00 0.04 0.00 0.00 34.50 32.26 2c4h s PRO 64 CO 0.43 -2.12 1.09 -0.80 0.04 0.00 0.00 177.00 175.64 2c4h s ASN 65 N -4.86 3.76 0.11 6.66 0.01 -1.26 -4.77 114.94 114.59 2c4h s ASN 65 Ca 0.72 1.60 0.02 0.00 -0.71 0.00 0.00 52.86 54.49 2c4h s ASN 65 Cb -0.04 -2.28 -0.04 0.00 0.41 0.00 0.00 41.25 39.30 2c4h s ASN 65 CO 0.50 -2.47 0.18 0.20 -1.51 0.00 0.00 177.10 174.00 2c4h s ASN 66 N -3.40 5.98 0.68 -1.22 0.02 0.04 -4.77 114.94 112.27 2c4h s ASN 66 Ca 0.63 0.09 -0.16 0.00 -1.02 0.00 0.00 52.86 52.40 2c4h s ASN 66 Cb -0.18 -1.72 0.01 0.00 0.02 0.00 0.00 41.25 39.38 2c4h s ASN 66 CO 0.57 0.11 1.17 0.00 0.02 0.00 0.00 177.10 178.97 2c4h s GLN 68 N -3.86 4.17 0.11 0.00 -1.52 -1.21 -4.58 119.66 112.78 2c4h s GLN 68 Ca 0.72 2.48 -0.26 0.00 -1.95 0.00 0.00 55.36 56.36 2c4h s GLN 68 Cb -0.26 -3.05 0.07 0.00 -0.22 0.00 0.00 33.01 29.55 2c4h s GLN 68 CO 0.41 -0.55 0.85 1.14 -0.25 0.00 0.00 175.29 176.89 2c4h s GLN 69 N -0.50 1.15 0.41 2.91 -2.07 -1.26 -4.66 119.66 115.64 2c4h s GLN 69 Ca 0.62 -0.54 -0.26 0.00 -1.82 0.00 0.00 55.36 53.35 2c4h s GLN 69 Cb -0.46 0.45 -0.09 0.00 -1.09 0.00 0.00 33.01 31.82 2c4h s GLN 69 CO 0.47 -0.52 1.33 -0.47 -1.32 0.00 0.00 175.29 174.78 2c4h s TYR 70 N -3.37 2.75 -0.16 9.60 5.04 -1.26 -5.01 117.35 124.96 2c4h s TYR 70 Ca 0.08 1.37 -0.00 0.00 -2.44 0.00 0.00 57.07 56.08 2c4h s TYR 70 Cb -0.02 -3.73 -0.01 0.00 0.35 0.00 0.00 41.96 38.56 2c4h s TYR 70 CO -0.03 -2.27 -0.13 0.08 -1.34 0.00 0.00 175.55 171.86 2c4h s VAL 71 N -1.24 2.89 -0.31 3.14 1.01 -1.26 -4.90 120.40 119.73 2c4h s VAL 71 Ca 0.57 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 2c4h s VAL 71 Cb -0.39 -2.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.75 2c4h s VAL 71 CO 0.51 0.51 1.43 -0.62 0.00 0.00 0.00 175.10 176.93 2c4h s ASP 72 N 0.74 6.47 -0.16 3.32 3.68 -1.26 -4.86 116.67 124.61 2c4h s ASP 72 Ca -0.06 1.20 0.14 0.00 2.13 0.00 0.00 52.55 55.97 2c4h s ASP 72 Cb -0.15 -2.54 0.37 0.00 -1.45 0.00 0.00 42.92 39.15 2c4h s ASP 72 CO 0.01 -1.25 1.19 -0.62 0.13 0.00 0.00 175.17 174.63 2c4h n GLU 73 N 7.66 1.28 -0.30 4.34 1.02 -1.26 -4.75 120.64 128.63 2c4h n GLU 73 Ca 0.17 -2.89 -0.05 0.00 -0.02 0.00 0.00 57.16 54.36 2c4h n GLU 73 Cb 0.47 -1.37 0.07 0.00 -0.02 0.00 0.00 31.44 30.59 2c4h n GLU 73 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2c4h h GLN 74 N 0.71 1.15 -2.47 3.49 5.75 -2.01 -3.34 115.11 118.40 2c4h h GLN 74 Ca -0.02 -0.15 -0.59 0.00 -0.15 0.00 0.00 58.65 57.74 2c4h h GLN 74 Cb 1.11 -0.22 -0.40 0.00 1.07 0.00 0.00 27.48 29.05 2c4h h GLN 74 CO 0.01 0.86 -0.84 1.19 -2.65 0.00 0.00 178.83 177.40 2c4h n PHE 75 N -4.38 0.87 -1.61 3.99 3.72 -1.26 -5.11 117.46 113.67 2c4h n PHE 75 Ca 0.08 -3.73 -0.51 0.00 -0.05 0.00 0.00 57.45 53.24 2c4h n PHE 75 Cb 0.11 -0.19 -0.06 0.00 -0.94 0.00 0.00 39.48 38.40 2c4h n PHE 75 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2c4h n PRO 76 N 2.09 1.36 -0.10 -1.08 -0.02 -1.26 -1.31 135.00 134.68 2c4h n PRO 76 Ca 0.26 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2c4h n PRO 76 Cb 0.45 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2c4h n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c4h n GLY 77 N 2.84 2.75 3.69 -1.23 0.00 -1.26 -5.00 105.19 106.97 2c4h n GLY 77 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2c4h n GLY 77 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2c4h s PHE 78 N -3.07 3.48 0.33 1.61 5.36 -0.43 -4.94 117.98 120.33 2c4h s PHE 78 Ca 0.00 1.56 0.07 0.00 -0.96 0.00 0.00 56.93 57.61 2c4h s PHE 78 Cb 0.00 -3.21 0.60 0.00 -0.34 0.00 0.00 43.02 40.07 2c4h s PHE 78 CO 0.00 -0.31 1.80 0.66 -1.46 0.00 0.00 175.22 175.91 2c4h h SER 79 N 7.14 0.27 -0.79 6.13 4.64 -1.94 -1.29 113.55 127.71 2c4h h SER 79 Ca -0.30 -0.08 0.13 0.00 -0.47 0.00 0.00 61.79 61.06 2c4h h SER 79 Cb 1.14 -0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 63.10 2c4h h SER 79 CO 0.86 0.53 0.52 1.23 -0.87 0.00 0.00 176.83 179.11 2c4h h GLY 80 N 0.98 0.95 0.00 -0.77 0.00 -1.93 -2.03 103.07 100.27 2c4h h GLY 80 Ca 0.04 -0.25 -0.38 0.00 0.00 0.00 0.00 47.33 46.74 2c4h h GLY 80 CO 0.04 0.11 -2.43 -1.14 0.00 0.00 0.00 176.54 173.12 2c4h n SER 81 N -4.51 1.45 0.26 0.19 3.41 -1.14 -4.46 113.62 108.82 2c4h n SER 81 Ca 0.14 -0.10 0.12 0.00 -0.26 0.00 0.00 58.87 58.78 2c4h n SER 81 Cb 0.43 0.00 0.71 0.00 -0.26 0.00 0.00 64.21 65.09 2c4h n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2c4h h GLU 82 N 0.00 0.00 0.00 4.33 4.39 -1.20 -2.56 114.58 119.54 2c4h h GLU 82 Ca -0.56 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.14 2c4h h GLU 82 Cb 1.99 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.64 2c4h h GLU 82 CO -0.05 0.13 0.00 0.00 -1.16 0.00 0.00 179.01 177.92 2c4h n MET 83 N -3.68 0.06 -0.01 2.33 0.00 -0.77 -1.94 117.12 113.12 2c4h n MET 83 Ca -0.02 0.36 0.10 0.00 0.00 0.00 0.00 57.70 58.14 2c4h n MET 83 Cb 0.24 -1.63 -0.14 0.00 0.00 0.00 0.00 33.22 31.70 2c4h n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2c4h n TRP 84 N -1.74 0.00 -1.47 3.17 7.02 -0.96 -4.73 117.44 118.72 2c4h n TRP 84 Ca 0.02 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.20 2c4h n TRP 84 Cb 0.15 -0.27 0.08 0.00 -2.42 0.00 0.00 31.31 28.85 2c4h n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2c4h s ASN 85 N -3.70 4.73 0.24 -0.99 0.01 -0.82 -4.72 114.94 109.69 2c4h s ASN 85 Ca -0.01 1.53 -0.31 0.00 -0.71 0.00 0.00 52.86 53.36 2c4h s ASN 85 Cb 0.13 -2.31 -0.12 0.00 0.41 0.00 0.00 41.25 39.37 2c4h s ASN 85 CO 0.81 -1.85 1.68 -2.84 -1.51 0.00 0.00 177.10 173.39 2c4h s PRO 86 N -5.05 4.12 0.00 -0.60 0.02 -1.26 -4.87 135.00 127.36 2c4h s PRO 86 Ca 0.60 2.61 0.16 0.00 0.02 0.00 0.00 61.00 64.39 2c4h s PRO 86 Cb -0.15 -3.05 0.33 0.00 0.02 0.00 0.00 34.50 31.65 2c4h s PRO 86 CO 0.55 -0.71 1.24 0.27 -0.33 0.00 0.00 177.00 178.02 2c4h n ASN 87 N 3.23 2.99 -3.55 2.53 2.04 -1.26 -4.96 115.26 116.29 2c4h n ASN 87 Ca 0.13 -1.88 -0.21 0.00 -0.44 0.00 0.00 54.58 52.18 2c4h n ASN 87 Cb 0.36 -0.21 -0.05 0.00 -2.53 0.00 0.00 39.78 37.35 2c4h n ASN 87 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 2c4h n ARG 88 N 0.99 0.85 -2.61 -3.83 5.12 -1.26 -5.12 116.66 110.80 2c4h n ARG 88 Ca 0.14 -2.63 -0.37 0.00 -1.93 0.00 0.00 57.85 53.07 2c4h n ARG 88 Cb 0.48 1.11 -0.05 0.00 -1.16 0.00 0.00 32.46 32.84 2c4h n ARG 88 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2c4h s GLU 89 N -3.23 4.28 0.14 5.56 -1.05 -1.26 -4.70 118.70 118.43 2c4h s GLU 89 Ca 0.09 1.46 -0.14 0.00 -0.15 0.00 0.00 54.97 56.23 2c4h s GLU 89 Cb 0.00 -2.60 -0.07 0.00 -0.44 0.00 0.00 34.13 31.02 2c4h s GLU 89 CO 0.06 -0.03 0.53 -1.64 0.95 0.00 0.00 175.26 175.13 2c4h s MET 90 N -2.40 3.95 -0.08 -4.83 -1.94 -1.26 -0.78 119.30 111.97 2c4h s MET 90 Ca 0.56 0.45 -0.30 0.00 -1.71 0.00 0.00 55.69 54.69 2c4h s MET 90 Cb -0.21 -2.94 0.10 0.00 2.01 0.00 0.00 34.83 33.79 2c4h s MET 90 CO 0.26 0.49 0.84 0.45 -0.01 0.00 0.00 175.02 177.06 2c4h s SER 91 N -1.72 -0.49 0.50 3.03 0.15 0.08 -4.88 113.70 110.37 2c4h s SER 91 Ca 0.37 0.45 0.31 0.00 0.70 0.00 0.00 55.95 57.78 2c4h s SER 91 Cb -0.15 0.42 1.17 0.00 -1.71 0.00 0.00 66.02 65.74 2c4h s SER 91 CO 0.19 -0.51 1.90 -0.33 1.20 0.00 0.00 173.24 175.69 2c4h h GLU 92 N 2.63 0.00 -5.21 5.44 5.08 -1.94 -3.21 114.58 117.38 2c4h h GLU 92 Ca -0.23 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.43 2c4h h GLU 92 Cb 1.17 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.27 2c4h h GLU 92 CO 0.34 0.00 1.44 0.34 -1.00 0.00 0.00 179.01 180.14 2c4h s ASP 93 N -5.59 6.86 0.00 1.42 3.68 -1.26 -4.24 116.67 117.53 2c4h s ASP 93 Ca 0.03 -2.50 0.00 0.00 2.13 0.00 0.00 52.55 52.21 2c4h s ASP 93 Cb 0.08 -2.46 0.00 0.00 -1.45 0.00 0.00 42.92 39.10 2c4h s ASP 93 CO 0.55 -0.99 0.53 0.00 0.13 0.00 0.00 175.17 175.38 2c4h s LEU 95 N -0.20 4.19 0.18 0.00 1.43 -1.26 -4.72 118.68 118.30 2c4h s LEU 95 Ca 0.00 -2.15 0.01 0.00 -1.03 0.00 0.00 54.13 50.96 2c4h s LEU 95 Cb 0.00 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.67 2c4h s LEU 95 CO 0.00 -1.18 0.03 -0.31 0.23 0.00 0.00 176.35 175.12 2c4h s TYR 96 N 3.67 1.18 0.10 0.29 1.51 -1.26 -2.77 117.35 120.08 2c4h s TYR 96 Ca 0.45 -1.10 0.03 0.00 -1.01 0.00 0.00 57.07 55.44 2c4h s TYR 96 Cb -0.00 -0.67 -0.04 0.00 -0.11 0.00 0.00 41.96 41.14 2c4h s TYR 96 CO -0.03 -0.31 -0.08 -0.48 -1.11 0.00 0.00 175.55 173.54 2c4h s LEU 97 N -3.17 2.46 0.10 -1.29 0.05 0.82 -3.27 118.68 114.39 2c4h s LEU 97 Ca 0.26 -0.91 0.10 0.00 0.05 0.00 0.00 54.13 53.64 2c4h s LEU 97 Cb 0.07 -0.18 -0.04 0.00 -2.05 0.00 0.00 46.19 43.99 2c4h s LEU 97 CO 0.05 -0.37 -0.26 0.20 -0.55 0.00 0.00 176.35 175.43 2c4h s ASN 98 N -2.74 3.12 -0.03 1.48 -0.87 0.26 -1.15 114.94 115.01 2c4h s ASN 98 Ca 0.08 -0.69 0.00 0.00 -1.57 0.00 0.00 52.86 50.68 2c4h s ASN 98 Cb 0.01 -0.22 0.03 0.00 -0.02 0.00 0.00 41.25 41.05 2c4h s ASN 98 CO -0.02 0.18 -0.01 -0.63 -2.57 0.00 0.00 177.10 174.05 2c4h s ILE 99 N -1.01 0.25 -0.24 0.60 1.01 0.72 -1.20 121.20 121.33 2c4h s ILE 99 Ca 0.12 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.76 2c4h s ILE 99 Cb -0.10 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.02 2c4h s ILE 99 CO 0.05 0.16 0.02 0.26 0.00 0.00 0.00 174.94 175.43 2c4h s TRP 100 N 1.03 3.04 -0.13 3.97 0.51 0.43 -0.33 118.94 127.45 2c4h s TRP 100 Ca -0.10 -0.78 0.01 0.00 -2.12 0.00 0.00 56.10 53.11 2c4h s TRP 100 Cb -0.14 -2.18 -0.01 0.00 -0.81 0.00 0.00 33.47 30.34 2c4h s TRP 100 CO -0.01 -0.49 -0.16 0.08 -0.51 0.00 0.00 176.95 175.86 2c4h s VAL 101 N 1.53 2.75 0.83 4.03 1.01 0.31 -1.64 120.40 129.22 2c4h s VAL 101 Ca 0.05 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 2c4h s VAL 101 Cb -0.15 -2.14 0.05 0.00 0.00 0.00 0.00 36.38 34.13 2c4h s VAL 101 CO 0.00 0.53 0.85 -2.65 0.00 0.00 0.00 175.10 173.83 2c4h n PRO 102 N 3.73 0.06 -4.54 2.72 -0.02 -1.26 -1.04 135.00 134.65 2c4h n PRO 102 Ca -0.19 0.09 -0.27 0.00 -2.02 0.00 0.00 63.50 61.11 2c4h n PRO 102 Cb 0.52 -2.15 -0.17 0.00 -0.02 0.00 0.00 33.50 31.69 2c4h n PRO 102 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2c4h s SER 103 N -1.96 2.24 0.66 2.55 0.15 -1.26 -2.80 113.70 113.28 2c4h s SER 103 Ca 0.67 -0.39 -0.15 0.00 0.70 0.00 0.00 55.95 56.78 2c4h s SER 103 Cb -0.28 -1.01 -0.00 0.00 -1.71 0.00 0.00 66.02 63.02 2c4h s SER 103 CO 0.57 0.03 1.12 -2.16 1.20 0.00 0.00 173.24 174.00 2c4h s PRO 104 N 0.86 2.78 0.09 5.44 0.04 -1.26 -4.97 135.00 137.99 2c4h s PRO 104 Ca -0.10 1.45 -0.36 0.00 0.04 0.00 0.00 61.00 62.03 2c4h s PRO 104 Cb -0.15 -1.94 -0.17 0.00 0.04 0.00 0.00 34.50 32.27 2c4h s PRO 104 CO 0.01 -1.28 1.27 -2.13 0.04 0.00 0.00 177.00 174.91 2c4h n ARG 105 N -2.35 1.00 -1.23 4.56 0.63 -1.12 -4.96 116.66 113.18 2c4h n ARG 105 Ca 0.11 0.36 -0.28 0.00 -0.92 0.00 0.00 57.85 57.11 2c4h n ARG 105 Cb 0.52 -1.95 0.22 0.00 0.45 0.00 0.00 32.46 31.70 2c4h n ARG 105 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2c4h n PRO 106 N 2.26 -2.48 -0.07 -0.14 -0.02 -1.26 -4.99 135.00 128.30 2c4h n PRO 106 Ca 0.18 -1.74 -0.09 0.00 -2.02 0.00 0.00 63.50 59.83 2c4h n PRO 106 Cb 0.19 -1.47 -0.06 0.00 -0.02 0.00 0.00 33.50 32.13 2c4h n PRO 106 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2c4h n LYS 107 N -4.36 0.40 -2.75 -0.52 4.76 -1.25 -4.07 118.16 110.38 2c4h n LYS 107 Ca 0.15 0.07 -0.06 0.00 -2.87 0.00 0.00 58.31 55.60 2c4h n LYS 107 Cb 0.55 -1.27 0.04 0.00 -1.84 0.00 0.00 35.03 32.51 2c4h n LYS 107 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2c4h n SER 108 N -2.87 -2.96 -4.79 4.39 2.88 -0.89 -4.46 113.62 104.91 2c4h n SER 108 Ca -0.23 -2.98 -0.22 0.00 -1.33 0.00 0.00 58.87 54.11 2c4h n SER 108 Cb 0.75 1.70 -0.05 0.00 -0.75 0.00 0.00 64.21 65.86 2c4h n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2c4h s THR 109 N 0.74 3.19 0.28 2.46 -1.32 0.25 -4.55 115.64 116.69 2c4h s THR 109 Ca 0.31 -1.54 -0.29 0.00 -1.21 0.00 0.00 61.69 58.95 2c4h s THR 109 Cb 0.14 -3.06 -0.13 0.00 -1.51 0.00 0.00 72.50 67.93 2c4h s THR 109 CO -0.16 -0.16 1.21 0.41 -2.21 0.00 0.00 174.62 173.71 2c4h n THR 110 N -1.26 1.64 -5.05 5.08 -1.04 -1.26 -0.06 114.28 112.32 2c4h n THR 110 Ca -0.02 -0.41 -0.32 0.00 -2.04 0.00 0.00 64.05 61.26 2c4h n THR 110 Cb 0.61 -1.29 -0.14 0.00 -1.82 0.00 0.00 70.33 67.68 2c4h n THR 110 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2c4h s VAL 111 N -0.74 2.67 -0.09 12.58 1.01 -0.65 -1.60 120.40 133.56 2c4h s VAL 111 Ca 0.61 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2c4h s VAL 111 Cb -0.66 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2c4h s VAL 111 CO 0.57 0.59 -0.11 -0.04 0.00 0.00 0.00 175.10 176.11 2c4h s MET 112 N -0.66 1.76 -0.21 2.72 -1.94 -0.70 -0.68 119.30 119.59 2c4h s MET 112 Ca 0.10 -0.39 -0.03 0.00 -1.71 0.00 0.00 55.69 53.65 2c4h s MET 112 Cb -0.11 -1.58 -0.01 0.00 2.01 0.00 0.00 34.83 35.15 2c4h s MET 112 CO 0.00 -0.09 -0.05 0.08 -0.01 0.00 0.00 175.02 174.94 2c4h s VAL 113 N 1.09 3.31 -0.10 -6.03 1.01 0.32 -0.35 120.40 119.66 2c4h s VAL 113 Ca -0.06 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 2c4h s VAL 113 Cb -0.14 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 2c4h s VAL 113 CO -0.02 0.43 0.50 0.86 0.00 0.00 0.00 175.10 176.88 2c4h s TRP 114 N 1.41 3.54 -0.26 5.22 -0.11 0.13 -0.66 118.94 128.21 2c4h s TRP 114 Ca 0.05 0.95 0.01 0.00 1.22 0.00 0.00 56.10 58.33 2c4h s TRP 114 Cb -0.14 -2.56 0.05 0.00 -1.50 0.00 0.00 33.47 29.31 2c4h s TRP 114 CO -0.03 0.21 -0.09 0.42 -4.62 0.00 0.00 176.95 172.83 2c4h s ILE 115 N 0.47 2.48 0.65 5.86 1.01 -0.03 -2.37 121.20 129.26 2c4h s ILE 115 Ca 0.27 -1.38 -0.16 0.00 0.00 0.00 0.00 60.65 59.39 2c4h s ILE 115 Cb -0.16 -2.36 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 2c4h s ILE 115 CO 0.12 0.07 1.15 -0.72 0.00 0.00 0.00 174.94 175.55 2c4h s TYR 116 N 1.20 2.45 0.00 3.97 -0.85 -1.26 -3.58 117.35 119.28 2c4h s TYR 116 Ca -0.05 1.56 0.00 0.00 -0.52 0.00 0.00 57.07 58.06 2c4h s TYR 116 Cb -0.18 -3.30 0.00 0.00 0.38 0.00 0.00 41.96 38.86 2c4h s TYR 116 CO -0.05 -1.97 0.00 0.41 -1.52 0.00 0.00 175.55 172.42 2c4h n GLY 117 N -0.07 1.32 0.00 5.49 0.00 -1.21 -3.52 105.19 107.20 2c4h n GLY 117 Ca 0.12 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.17 2c4h n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4h n GLY 118 N 5.00 0.97 2.47 -0.02 0.00 -1.26 -4.12 105.19 108.23 2c4h n GLY 118 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2c4h n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4h n GLY 119 N 0.00 1.19 3.45 -0.02 0.00 -1.26 -1.45 105.19 107.10 2c4h n GLY 119 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2c4h n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c4h n PHE 120 N -2.74 0.00 0.41 1.61 3.72 -1.26 -4.72 117.46 114.48 2c4h n PHE 120 Ca -0.20 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.24 2c4h n PHE 120 Cb 0.65 -1.27 -0.03 0.00 -0.94 0.00 0.00 39.48 37.89 2c4h n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2c4h n TYR 121 N -2.07 0.00 -3.79 1.38 0.18 -0.72 -0.35 117.16 111.79 2c4h n TYR 121 Ca 0.00 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.68 2c4h n TYR 121 Cb 0.12 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.09 2c4h n TYR 121 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 2c4h n SER 122 N -0.84 -1.68 0.00 9.48 3.41 -0.53 -3.99 113.62 119.48 2c4h n SER 122 Ca 0.02 -2.47 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 2c4h n SER 122 Cb 0.16 2.88 0.00 0.00 -0.26 0.00 0.00 64.21 66.99 2c4h n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c4h n GLY 123 N -0.47 3.89 3.08 5.00 0.00 -1.26 -4.11 105.19 111.31 2c4h n GLY 123 Ca -0.05 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.34 2c4h n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c4h s SER 124 N 0.00 -0.01 0.00 1.61 0.01 -1.26 -4.68 113.70 109.37 2c4h s SER 124 Ca 0.00 -0.08 0.26 0.00 1.31 0.00 0.00 55.95 57.44 2c4h s SER 124 Cb 0.00 0.23 0.69 0.00 0.21 0.00 0.00 66.02 67.15 2c4h s SER 124 CO 0.00 -0.27 1.54 -1.54 0.41 0.00 0.00 173.24 173.38 2c4h n SER 125 N 1.90 0.47 -0.79 2.44 3.41 -1.26 -4.09 113.62 115.70 2c4h n SER 125 Ca -0.20 -0.21 0.12 0.00 -0.26 0.00 0.00 58.87 58.32 2c4h n SER 125 Cb 0.56 0.10 0.29 0.00 -0.26 0.00 0.00 64.21 64.90 2c4h n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2c4h n THR 126 N -1.38 0.14 -1.69 6.66 -2.24 -1.26 -4.84 114.28 109.67 2c4h n THR 126 Ca 0.07 -0.45 -0.37 0.00 -2.27 0.00 0.00 64.05 61.03 2c4h n THR 126 Cb 0.33 0.91 0.06 0.00 -2.10 0.00 0.00 70.33 69.54 2c4h n THR 126 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2c4h n LEU 127 N 0.86 5.21 -0.12 3.22 4.77 -1.26 -4.89 117.00 124.79 2c4h n LEU 127 Ca 0.17 0.81 0.01 0.00 -0.03 0.00 0.00 56.01 56.97 2c4h n LEU 127 Cb 0.48 -1.50 0.29 0.00 -2.33 0.00 0.00 43.42 40.37 2c4h n LEU 127 CO 0.15 -1.33 1.15 0.44 -1.33 0.00 0.00 177.39 176.47 2c4h h ASP 128 N 0.48 0.71 0.44 -1.43 3.32 -1.94 -1.56 116.42 116.44 2c4h h ASP 128 Ca -0.50 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.50 2c4h h ASP 128 Cb 1.35 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2c4h h ASP 128 CO 0.52 0.57 0.00 0.55 -1.72 0.00 0.00 179.24 179.15 2c4h n VAL 129 N -4.40 0.42 -0.07 -1.35 3.14 -1.26 -2.50 118.33 112.31 2c4h n VAL 129 Ca 0.05 0.11 0.06 0.00 -2.96 0.00 0.00 64.34 61.60 2c4h n VAL 129 Cb 0.09 -0.77 0.15 0.00 -1.06 0.00 0.00 33.84 32.25 2c4h n VAL 129 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 2c4h n TYR 130 N -1.33 0.43 -1.68 1.45 4.01 -0.59 -4.64 117.16 114.82 2c4h n TYR 130 Ca 0.09 -0.41 -0.43 0.00 -0.16 0.00 0.00 57.90 56.99 2c4h n TYR 130 Cb 0.18 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.16 2c4h n TYR 130 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2c4h s ASN 131 N -1.01 5.88 0.00 7.72 3.84 -1.04 -4.86 114.94 125.47 2c4h s ASN 131 Ca 0.24 2.13 0.23 0.00 0.21 0.00 0.00 52.86 55.68 2c4h s ASN 131 Cb 0.13 -2.52 1.23 0.00 -0.55 0.00 0.00 41.25 39.54 2c4h s ASN 131 CO 0.18 -1.59 1.81 0.61 -2.79 0.00 0.00 177.10 175.32 2c4h n GLY 132 N 5.24 -0.64 0.27 1.21 0.00 -1.26 -4.21 105.19 105.80 2c4h n GLY 132 Ca 0.25 -0.23 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2c4h n GLY 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2c4h h LYS 133 N 0.69 0.89 -0.75 1.61 2.10 -1.92 -0.13 116.57 119.06 2c4h h LYS 133 Ca 0.00 -0.10 0.01 0.00 -2.00 0.00 0.00 60.65 58.56 2c4h h LYS 133 Cb 0.15 -0.18 -0.04 0.00 -0.90 0.00 0.00 32.23 31.26 2c4h h LYS 133 CO 0.00 0.66 0.49 1.88 -2.00 0.00 0.00 179.45 180.48 2c4h h TYR 134 N 0.88 0.95 -0.07 0.07 0.05 -1.81 0.50 116.97 117.53 2c4h h TYR 134 Ca 0.23 0.02 -0.16 0.00 0.05 0.00 0.00 58.73 58.87 2c4h h TYR 134 Cb 0.02 -0.32 0.01 0.00 1.01 0.00 0.00 36.73 37.45 2c4h h TYR 134 CO -0.01 0.60 -0.57 1.25 -1.05 0.00 0.00 178.16 178.38 2c4h h LEU 135 N 1.02 0.63 -0.71 3.88 5.85 -1.70 -0.73 115.31 123.55 2c4h h LEU 135 Ca 0.27 -0.68 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2c4h h LEU 135 Cb -0.11 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2c4h h LEU 135 CO -0.06 1.21 0.45 0.00 -0.34 0.00 0.00 178.44 179.70 2c4h h ALA 136 N 0.43 0.90 0.11 1.25 0.00 -0.84 -0.97 119.26 120.14 2c4h h ALA 136 Ca -0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2c4h h ALA 136 Cb 1.23 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2c4h h ALA 136 CO 0.12 0.34 -0.05 -0.92 0.00 0.00 0.00 179.25 178.73 2c4h h TYR 137 N 0.96 -0.14 -0.75 0.00 3.20 -0.93 -1.61 116.97 117.70 2c4h h TYR 137 Ca 0.26 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 2c4h h TYR 137 Cb -0.08 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 2c4h h TYR 137 CO -0.02 0.34 0.31 1.15 -1.64 0.00 0.00 178.16 178.31 2c4h h THR 138 N -0.75 1.25 -0.02 1.81 2.02 -1.10 -3.22 112.91 112.88 2c4h h THR 138 Ca -0.02 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2c4h h THR 138 Cb 0.55 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 2c4h h THR 138 CO 0.03 0.31 -0.04 -0.62 0.37 0.00 0.00 175.52 175.56 2c4h n GLU 139 N -4.30 1.42 -3.34 6.66 -0.58 -0.37 -5.01 120.64 115.12 2c4h n GLU 139 Ca 0.07 -1.43 -0.16 0.00 -0.42 0.00 0.00 57.16 55.22 2c4h n GLU 139 Cb 0.17 -1.32 0.08 0.00 -0.57 0.00 0.00 31.44 29.80 2c4h n GLU 139 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2c4h n GLU 140 N 0.83 -4.49 -4.31 3.49 -0.58 -0.63 -5.03 120.64 109.92 2c4h n GLU 140 Ca 0.10 0.86 -0.17 0.00 -0.42 0.00 0.00 57.16 57.52 2c4h n GLU 140 Cb 0.42 -5.85 -0.10 0.00 -0.57 0.00 0.00 31.44 25.34 2c4h n GLU 140 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2c4h s VAL 141 N -3.38 1.53 -0.36 2.62 -7.23 -1.04 -4.62 120.40 107.92 2c4h s VAL 141 Ca 0.22 -2.13 -0.18 0.00 -1.81 0.00 0.00 61.98 58.09 2c4h s VAL 141 Cb -0.03 -1.95 -0.00 0.00 0.56 0.00 0.00 36.38 34.96 2c4h s VAL 141 CO 0.74 -0.63 0.49 -0.69 -0.31 0.00 0.00 175.10 174.69 2c4h s VAL 142 N -3.03 5.04 -0.26 1.32 1.01 -0.63 -4.41 120.40 119.44 2c4h s VAL 142 Ca 0.20 0.20 -0.11 0.00 0.00 0.00 0.00 61.98 62.27 2c4h s VAL 142 Cb 0.00 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2c4h s VAL 142 CO 0.04 -0.24 0.20 -0.22 0.00 0.00 0.00 175.10 174.88 2c4h s LEU 143 N 2.33 4.06 -0.03 3.92 1.98 -0.65 -1.71 118.68 128.58 2c4h s LEU 143 Ca 0.17 0.08 0.04 0.00 -2.89 0.00 0.00 54.13 51.53 2c4h s LEU 143 Cb -0.16 -2.15 -0.03 0.00 0.66 0.00 0.00 46.19 44.52 2c4h s LEU 143 CO 0.13 -0.01 -0.16 -0.69 -1.89 0.00 0.00 176.35 173.73 2c4h s VAL 144 N 1.49 2.96 -0.10 1.68 1.01 0.52 -0.43 120.40 127.53 2c4h s VAL 144 Ca 0.08 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.25 2c4h s VAL 144 Cb -0.15 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.08 2c4h s VAL 144 CO 0.08 0.55 -0.11 -0.94 0.00 0.00 0.00 175.10 174.68 2c4h s SER 145 N -0.85 2.16 0.43 3.32 1.04 -0.34 0.17 113.70 119.63 2c4h s SER 145 Ca 0.12 -0.35 0.06 0.00 0.48 0.00 0.00 55.95 56.27 2c4h s SER 145 Cb -0.11 -0.93 0.06 0.00 0.10 0.00 0.00 66.02 65.15 2c4h s SER 145 CO 0.01 -0.03 0.53 0.00 0.98 0.00 0.00 173.24 174.73 2c4h n LEU 146 N 4.40 0.00 -4.03 2.42 -0.00 -1.00 -0.57 117.00 118.22 2c4h n LEU 146 Ca -0.18 -1.94 -0.08 0.00 -0.00 0.00 0.00 56.01 53.81 2c4h n LEU 146 Cb 0.51 -0.25 -0.09 0.00 -0.00 0.00 0.00 43.42 43.59 2c4h n LEU 146 CO 0.21 -0.62 -0.24 -0.94 -0.00 0.00 0.00 177.39 175.81 2c4h s SER 147 N -3.62 0.30 0.00 1.45 1.04 -1.20 -4.54 113.70 107.13 2c4h s SER 147 Ca 0.40 -0.94 -0.26 0.00 0.48 0.00 0.00 55.95 55.63 2c4h s SER 147 Cb -0.03 0.29 0.06 0.00 0.10 0.00 0.00 66.02 66.43 2c4h s SER 147 CO 0.26 -0.70 0.59 -0.72 0.98 0.00 0.00 173.24 173.64 2c4h s TYR 148 N -3.94 -0.53 0.31 5.02 1.13 -1.26 -4.49 117.35 113.59 2c4h s TYR 148 Ca 0.12 0.77 -0.29 0.00 -1.41 0.00 0.00 57.07 56.26 2c4h s TYR 148 Cb 0.07 0.37 -0.10 0.00 -1.10 0.00 0.00 41.96 41.19 2c4h s TYR 148 CO -0.06 -0.62 1.40 1.03 -2.51 0.00 0.00 175.55 174.79 2c4h s ARG 149 N -1.80 4.27 0.48 -3.49 0.52 -1.26 -4.90 118.95 112.77 2c4h s ARG 149 Ca -0.09 2.33 0.03 0.00 -0.52 0.00 0.00 55.73 57.48 2c4h s ARG 149 Cb -0.01 -3.06 -0.03 0.00 0.52 0.00 0.00 34.95 32.37 2c4h s ARG 149 CO 0.04 -0.35 0.01 0.14 0.02 0.00 0.00 175.30 175.16 2c4h s VAL 150 N -0.68 1.32 0.00 3.52 -7.23 -1.26 -4.14 120.40 111.92 2c4h s VAL 150 Ca 0.54 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 2c4h s VAL 150 Cb -0.42 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.16 2c4h s VAL 150 CO 0.51 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.91 2c4h n GLY 151 N -1.18 0.67 0.25 2.32 0.00 0.53 -2.58 105.19 105.20 2c4h n GLY 151 Ca -0.15 -0.83 0.07 0.00 0.00 0.00 0.00 46.02 45.10 2c4h n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4h h ALA 152 N -0.86 1.86 -0.39 4.61 0.00 -1.90 -0.89 119.26 121.69 2c4h h ALA 152 Ca 0.00 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.87 2c4h h ALA 152 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2c4h h ALA 152 CO 0.00 0.10 0.26 0.74 0.00 0.00 0.00 179.25 180.35 2c4h h PHE 153 N 0.00 0.40 0.00 0.00 0.04 -1.91 -1.49 116.94 113.98 2c4h h PHE 153 Ca -0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 2c4h h PHE 153 Cb 0.14 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2c4h h PHE 153 CO 0.00 0.24 -0.91 0.41 -0.60 0.00 0.00 178.31 177.45 2c4h n GLY 154 N -1.50 -0.19 0.00 -1.45 0.00 -0.82 -4.11 105.19 97.11 2c4h n GLY 154 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2c4h n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c4h n PHE 155 N -1.51 0.00 -1.68 1.61 3.72 -0.40 -0.76 117.46 118.44 2c4h n PHE 155 Ca 0.00 -0.13 -0.45 0.00 -0.05 0.00 0.00 57.45 56.82 2c4h n PHE 155 Cb 0.21 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.70 2c4h n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2c4h n LEU 156 N -0.13 3.36 -3.85 4.37 7.94 -0.57 -4.47 117.00 123.65 2c4h n LEU 156 Ca 0.00 1.09 -0.27 0.00 -1.11 0.00 0.00 56.01 55.72 2c4h n LEU 156 Cb 0.40 -1.47 -0.17 0.00 0.53 0.00 0.00 43.42 42.72 2c4h n LEU 156 CO 0.00 -0.19 -0.41 0.00 -1.11 0.00 0.00 177.39 175.68 2c4h s ALA 157 N 0.77 1.29 -0.61 1.96 0.00 -1.26 -3.26 121.76 120.65 2c4h s ALA 157 Ca 0.76 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 52.07 2c4h s ALA 157 Cb -0.63 -1.08 0.21 0.00 0.00 0.00 0.00 23.12 21.63 2c4h s ALA 157 CO 0.39 -0.80 0.59 1.28 0.00 0.00 0.00 175.76 177.22 2c4h n LEU 158 N 4.94 2.64 -4.56 0.00 4.77 -0.05 -2.68 117.00 122.06 2c4h n LEU 158 Ca -0.11 -5.16 -0.45 0.00 -0.03 0.00 0.00 56.01 50.26 2c4h n LEU 158 Cb 0.48 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 2c4h n LEU 158 CO 0.15 1.93 0.49 1.57 -1.33 0.00 0.00 177.39 180.20 2c4h n HIS 159 N 1.53 1.01 0.00 -1.77 -0.00 -1.26 -1.13 115.22 113.61 2c4h n HIS 159 Ca 0.25 0.74 0.00 0.00 -0.00 0.00 0.00 57.72 58.72 2c4h n HIS 159 Cb 0.41 -2.21 0.00 0.00 -0.00 0.00 0.00 29.99 28.19 2c4h n HIS 159 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2c4h n GLY 160 N 1.36 2.89 3.85 1.57 0.00 -1.26 -5.04 105.19 108.55 2c4h n GLY 160 Ca 0.11 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2c4h n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2c4h s SER 161 N 0.46 6.26 0.00 1.61 0.15 -0.28 -4.98 113.70 116.93 2c4h s SER 161 Ca 0.00 1.53 0.09 0.00 0.70 0.00 0.00 55.95 58.27 2c4h s SER 161 Cb 0.00 -2.49 -0.00 0.00 -1.71 0.00 0.00 66.02 61.82 2c4h s SER 161 CO 0.00 -0.84 0.61 1.67 1.20 0.00 0.00 173.24 175.88 2c4h n GLN 162 N -2.29 2.09 0.00 5.44 -0.06 -1.26 -4.02 117.38 117.29 2c4h n GLN 162 Ca 0.07 -0.59 0.02 0.00 -2.00 0.00 0.00 57.00 54.50 2c4h n GLN 162 Cb 0.54 -1.06 -0.11 0.00 -4.06 0.00 0.00 30.24 25.54 2c4h n GLN 162 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2c4h n GLU 163 N -0.25 0.64 -3.07 3.69 -0.58 -1.26 -4.60 120.64 115.21 2c4h n GLU 163 Ca 0.04 0.05 -0.19 0.00 -0.42 0.00 0.00 57.16 56.64 2c4h n GLU 163 Cb 0.20 -1.68 -0.03 0.00 -0.57 0.00 0.00 31.44 29.36 2c4h n GLU 163 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2c4h n ALA 164 N -2.41 1.34 0.26 0.62 0.00 -1.26 -3.16 120.51 115.90 2c4h n ALA 164 Ca -0.12 -2.84 0.16 0.00 0.00 0.00 0.00 53.44 50.64 2c4h n ALA 164 Cb 0.80 -0.96 0.60 0.00 0.00 0.00 0.00 19.45 19.89 2c4h n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2c4h h PRO 165 N 3.93 0.00 0.00 0.00 0.13 -1.74 -0.09 132.00 134.24 2c4h h PRO 165 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2c4h h PRO 165 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2c4h h PRO 165 CO 0.42 0.04 0.00 0.41 -0.23 0.00 0.00 178.00 178.64 2c4h n GLY 166 N 0.16 0.43 3.14 1.56 0.00 -1.20 -4.47 105.19 104.82 2c4h n GLY 166 Ca 0.01 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2c4h n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c4h n ASN 167 N -0.75 -3.56 0.27 1.61 3.02 -1.26 -4.84 115.26 109.75 2c4h n ASN 167 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.65 2c4h n ASN 167 Cb 0.00 -2.60 0.73 0.00 -0.61 0.00 0.00 39.78 37.30 2c4h n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2c4h h VAL 168 N 0.00 0.82 -0.65 2.41 -1.51 -1.86 0.66 116.25 116.13 2c4h h VAL 168 Ca 0.00 -0.10 -0.04 0.00 -1.23 0.00 0.00 66.70 65.32 2c4h h VAL 168 Cb 0.53 1.06 -0.03 0.00 -2.13 0.00 0.00 31.29 30.72 2c4h h VAL 168 CO 0.00 0.03 0.22 1.23 -1.23 0.00 0.00 177.57 177.82 2c4h h GLY 169 N 0.11 1.04 1.82 5.19 0.00 -1.16 0.80 103.07 110.87 2c4h h GLY 169 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 47.33 46.64 2c4h h GLY 169 CO 0.00 0.54 -0.52 1.41 0.00 0.00 0.00 176.54 177.97 2c4h h LEU 170 N 0.94 0.21 -0.87 3.11 3.38 -1.17 -2.39 115.31 118.52 2c4h h LEU 170 Ca 0.21 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 2c4h h LEU 170 Cb 0.23 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2c4h h LEU 170 CO -0.01 0.69 -0.52 -0.07 0.09 0.00 0.00 178.44 178.62 2c4h h LEU 171 N 0.15 0.00 -0.20 1.67 3.38 -0.41 -1.20 115.31 118.70 2c4h h LEU 171 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2c4h h LEU 171 Cb 0.96 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2c4h h LEU 171 CO 0.08 0.52 0.07 0.44 0.09 0.00 0.00 178.44 179.64 2c4h h ASP 172 N 0.00 0.29 -0.42 -0.43 3.45 -0.41 0.16 116.42 119.06 2c4h h ASP 172 Ca -0.01 -0.19 0.02 0.00 0.43 0.00 0.00 57.03 57.28 2c4h h ASP 172 Cb 0.99 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 39.65 2c4h h ASP 172 CO 0.07 0.41 0.23 1.56 -1.57 0.00 0.00 179.24 179.94 2c4h h GLN 173 N 0.16 0.46 -0.68 3.56 4.20 -1.16 -1.24 115.11 120.40 2c4h h GLN 173 Ca 0.07 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2c4h h GLN 173 Cb 0.22 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2c4h h GLN 173 CO -0.00 0.30 0.34 -0.09 -0.67 0.00 0.00 178.83 178.71 2c4h h ARG 174 N 0.47 0.98 -0.50 1.46 2.43 -0.94 -0.08 114.38 118.21 2c4h h ARG 174 Ca 0.17 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2c4h h ARG 174 Cb 0.03 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 2c4h h ARG 174 CO -0.09 0.77 0.17 1.98 -1.51 0.00 0.00 179.97 181.29 2c4h h MET 175 N 0.95 0.73 -0.40 0.20 4.05 -0.21 0.24 114.93 120.49 2c4h h MET 175 Ca 0.24 -0.12 -0.11 0.00 -0.28 0.00 0.00 59.70 59.42 2c4h h MET 175 Cb 0.11 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 2c4h h MET 175 CO -0.03 0.62 -0.21 0.00 0.23 0.00 0.00 176.91 177.52 2c4h h ALA 176 N 1.47 0.87 -0.37 0.39 0.00 -0.55 -0.66 119.26 120.41 2c4h h ALA 176 Ca 0.17 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 2c4h h ALA 176 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2c4h h ALA 176 CO -0.01 0.63 -0.20 -0.07 0.00 0.00 0.00 179.25 179.60 2c4h h LEU 177 N 0.69 0.72 -0.61 0.00 3.38 0.17 -1.25 115.31 118.42 2c4h h LEU 177 Ca 0.10 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2c4h h LEU 177 Cb 0.72 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2c4h h LEU 177 CO 0.06 0.92 0.17 -0.61 0.09 0.00 0.00 178.44 179.07 2c4h h GLN 178 N 0.63 0.96 -0.64 1.13 5.75 -0.20 0.33 115.11 123.07 2c4h h GLN 178 Ca 0.09 -0.22 -0.03 0.00 -0.15 0.00 0.00 58.65 58.35 2c4h h GLN 178 Cb 0.69 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 2c4h h GLN 178 CO 0.05 0.86 0.28 2.35 -2.65 0.00 0.00 178.83 179.72 2c4h h TRP 179 N 0.87 0.95 -0.54 3.99 7.01 -0.75 -0.51 115.95 126.97 2c4h h TRP 179 Ca 0.19 -0.06 -0.05 0.00 2.11 0.00 0.00 58.89 61.09 2c4h h TRP 179 Cb 0.31 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 27.06 2c4h h TRP 179 CO 0.02 0.73 0.15 0.28 -2.79 0.00 0.00 178.44 176.83 2c4h h VAL 180 N 0.89 1.24 -0.58 2.65 2.07 -0.95 0.16 116.25 121.74 2c4h h VAL 180 Ca 0.22 -0.84 0.05 0.00 0.82 0.00 0.00 66.70 66.94 2c4h h VAL 180 Cb 0.16 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 2c4h h VAL 180 CO -0.02 0.31 0.32 -0.74 0.02 0.00 0.00 177.57 177.45 2c4h h HIS 181 N 0.76 0.58 0.00 1.57 -0.00 -0.40 -1.04 115.15 116.62 2c4h h HIS 181 Ca 0.17 0.02 -0.21 0.00 -0.00 0.00 0.00 60.37 60.36 2c4h h HIS 181 Cb 0.32 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.52 2c4h h HIS 181 CO 0.02 0.29 -1.02 -0.44 -0.00 0.00 0.00 177.93 176.78 2c4h h ASP 182 N 0.60 0.00 0.00 3.26 3.32 -0.82 -3.41 116.42 119.37 2c4h h ASP 182 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2c4h h ASP 182 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2c4h h ASP 182 CO -0.16 0.95 -0.12 0.59 -1.72 0.00 0.00 179.24 178.79 2c4h n ASN 183 N -3.31 0.50 0.33 6.45 4.13 0.55 -4.74 115.26 119.16 2c4h n ASN 183 Ca -0.01 -0.46 0.21 0.00 1.68 0.00 0.00 54.58 55.99 2c4h n ASN 183 Cb 0.93 1.00 1.13 0.00 -1.54 0.00 0.00 39.78 41.30 2c4h n ASN 183 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2c4h h ILE 184 N 0.00 0.14 -0.32 2.41 6.09 -1.34 -1.67 117.51 122.83 2c4h h ILE 184 Ca 0.00 -0.02 -0.02 0.00 -1.37 0.00 0.00 64.86 63.45 2c4h h ILE 184 Cb 0.01 1.02 -0.02 0.00 0.47 0.00 0.00 36.82 38.30 2c4h h ILE 184 CO 0.00 0.00 0.11 0.06 -3.07 0.00 0.00 178.15 175.25 2c4h h GLN 185 N 0.00 0.45 0.00 2.19 3.07 -1.80 -0.27 115.11 118.74 2c4h h GLN 185 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 58.68 2c4h h GLN 185 Cb 0.02 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 27.49 2c4h h GLN 185 CO 0.00 0.40 0.00 0.74 0.09 0.00 0.00 178.83 180.06 2c4h h PHE 186 N 0.45 0.00 -0.58 0.06 0.04 -1.59 -1.98 116.94 113.33 2c4h h PHE 186 Ca 0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.88 2c4h h PHE 186 Cb 0.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.28 2c4h h PHE 186 CO 0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 2c4h n PHE 187 N -3.00 0.77 -0.42 -0.55 3.01 -0.58 -4.90 117.46 111.78 2c4h n PHE 187 Ca 0.00 -0.38 0.00 0.00 1.01 0.00 0.00 57.45 58.08 2c4h n PHE 187 Cb 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2c4h n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c4h n GLY 188 N 1.60 0.74 3.88 1.37 0.00 -0.75 -4.46 105.19 107.58 2c4h n GLY 188 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 2c4h n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c4h s GLY 189 N -1.67 2.10 -0.53 -0.02 0.00 -0.22 -0.58 107.32 106.41 2c4h s GLY 189 Ca 0.00 -0.27 -0.18 0.00 0.00 0.00 0.00 44.72 44.27 2c4h s GLY 189 CO 0.00 -0.11 0.60 -0.35 0.00 0.00 0.00 173.10 173.24 2c4h s ASP 190 N -2.74 6.20 0.51 1.64 2.15 0.92 -3.44 116.67 121.91 2c4h s ASP 190 Ca 0.49 -1.21 0.29 0.00 0.43 0.00 0.00 52.55 52.54 2c4h s ASP 190 Cb -0.11 -2.27 1.57 0.00 -0.30 0.00 0.00 42.92 41.81 2c4h s ASP 190 CO 0.25 -0.91 1.86 1.55 -0.17 0.00 0.00 175.17 177.75 2c4h h PRO 191 N 9.00 0.00 -0.09 4.34 0.13 -1.88 0.80 132.00 144.31 2c4h h PRO 191 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2c4h h PRO 191 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2c4h h PRO 191 CO 1.00 0.00 0.00 0.36 -0.23 0.00 0.00 178.00 179.13 2c4h n LYS 192 N -2.62 2.04 -2.88 0.86 2.85 -1.26 -4.24 118.16 112.91 2c4h n LYS 192 Ca -0.02 -1.52 -0.21 0.00 -1.05 0.00 0.00 58.31 55.51 2c4h n LYS 192 Cb 0.19 -1.47 -0.02 0.00 -0.65 0.00 0.00 35.03 33.09 2c4h n LYS 192 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2c4h n THR 193 N 0.81 1.59 -3.76 0.58 -1.04 0.27 -4.68 114.28 108.05 2c4h n THR 193 Ca 0.17 -4.71 -0.36 0.00 -2.04 0.00 0.00 64.05 57.11 2c4h n THR 193 Cb 0.48 -0.66 -0.10 0.00 -1.82 0.00 0.00 70.33 68.23 2c4h n THR 193 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2c4h s VAL 194 N -3.82 5.06 -0.16 12.58 1.01 -1.25 -1.64 120.40 132.18 2c4h s VAL 194 Ca 0.42 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.45 2c4h s VAL 194 Cb 0.36 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2c4h s VAL 194 CO -0.10 0.37 -0.08 -0.89 0.00 0.00 0.00 175.10 174.40 2c4h s THR 195 N 0.98 3.41 -0.14 3.92 2.01 0.14 -0.14 115.64 125.82 2c4h s THR 195 Ca 0.06 -0.52 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 2c4h s THR 195 Cb -0.14 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 2c4h s THR 195 CO 0.03 0.49 0.13 0.27 -0.69 0.00 0.00 174.62 174.86 2c4h s ILE 196 N 0.57 5.41 0.02 1.82 -4.36 -0.83 -0.52 121.20 123.31 2c4h s ILE 196 Ca -0.05 0.18 -0.05 0.00 -0.26 0.00 0.00 60.65 60.46 2c4h s ILE 196 Cb -0.15 -3.38 -0.01 0.00 1.25 0.00 0.00 42.46 40.17 2c4h s ILE 196 CO 0.03 0.57 0.08 0.72 0.24 0.00 0.00 174.94 176.59 2c4h s PHE 197 N -0.64 0.17 0.07 1.37 -0.71 0.16 -1.45 117.98 116.94 2c4h s PHE 197 Ca 0.13 -0.41 -0.27 0.00 -1.04 0.00 0.00 56.93 55.34 2c4h s PHE 197 Cb -0.12 -0.13 0.08 0.00 -1.21 0.00 0.00 43.02 41.65 2c4h s PHE 197 CO 0.02 -0.31 0.91 0.20 -1.34 0.00 0.00 175.22 174.70 2c4h s GLY 198 N -1.80 -0.37 0.00 1.99 0.00 -1.13 -0.86 107.32 105.16 2c4h s GLY 198 Ca -0.10 0.61 0.06 0.00 0.00 0.00 0.00 44.72 45.30 2c4h s GLY 198 CO -0.02 0.19 -0.17 1.85 0.00 0.00 0.00 173.10 174.95 2c4h s GLU 199 N -3.21 2.25 4.31 2.90 -6.30 -1.23 -1.39 118.70 116.03 2c4h s GLU 199 Ca 0.08 -0.87 0.00 0.00 -2.50 0.00 0.00 54.97 51.68 2c4h s GLU 199 Cb -0.01 -2.26 0.00 0.00 0.00 0.00 0.00 34.13 31.86 2c4h s GLU 199 CO -0.04 0.57 0.00 0.45 0.02 0.00 0.00 175.26 176.26 2c4h n SER 200 N 1.87 0.00 0.03 -1.70 2.88 0.12 -0.22 113.62 116.60 2c4h n SER 200 Ca -0.16 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.58 2c4h n SER 200 Cb 0.52 0.00 0.72 0.00 -0.75 0.00 0.00 64.21 64.70 2c4h n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2c4h h ALA 201 N -0.58 2.38 0.01 -1.46 0.00 -1.87 0.72 119.26 118.46 2c4h h ALA 201 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 2c4h h ALA 201 Cb 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2c4h h ALA 201 CO 0.00 -0.66 -0.89 0.78 0.00 0.00 0.00 179.25 178.49 2c4h h GLY 202 N 0.00 0.14 0.92 0.00 0.00 -0.64 -0.43 103.07 103.06 2c4h h GLY 202 Ca 0.24 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.16 2c4h h GLY 202 CO -0.00 0.23 -0.48 -1.33 0.00 0.00 0.00 176.54 174.96 2c4h h GLY 203 N 2.10 0.64 0.99 4.60 0.00 0.24 -1.28 103.07 110.36 2c4h h GLY 203 Ca -0.04 -0.84 0.01 0.00 0.00 0.00 0.00 47.33 46.47 2c4h h GLY 203 CO 0.13 0.75 0.57 0.00 0.00 0.00 0.00 176.54 177.99 2c4h h ALA 204 N 0.53 1.10 -0.42 3.60 0.00 0.08 -1.61 119.26 122.53 2c4h h ALA 204 Ca -0.02 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2c4h h ALA 204 Cb 1.11 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2c4h h ALA 204 CO 0.10 0.49 0.28 0.77 0.00 0.00 0.00 179.25 180.89 2c4h h SER 205 N 1.16 0.47 -0.60 0.00 0.02 -0.94 -0.24 113.55 113.43 2c4h h SER 205 Ca 0.32 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.33 2c4h h SER 205 Cb -0.12 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.24 2c4h h SER 205 CO -0.07 0.34 0.29 0.58 -1.14 0.00 0.00 176.83 176.82 2c4h h VAL 206 N 0.56 0.89 -0.23 2.27 2.07 -0.66 -0.47 116.25 120.68 2c4h h VAL 206 Ca 0.16 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 2c4h h VAL 206 Cb -0.05 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2c4h h VAL 206 CO -0.04 0.10 -0.10 1.23 0.02 0.00 0.00 177.57 178.77 2c4h h GLY 207 N 0.53 0.39 2.00 2.17 0.00 -0.63 -1.84 103.07 105.69 2c4h h GLY 207 Ca 0.28 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 2c4h h GLY 207 CO -0.22 0.23 -0.43 -0.33 0.00 0.00 0.00 176.54 175.79 2c4h h MET 208 N 0.34 0.00 0.00 4.80 2.86 0.49 -1.59 114.93 121.84 2c4h h MET 208 Ca 0.07 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.59 2c4h h MET 208 Cb 0.40 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2c4h h MET 208 CO 0.02 0.43 -0.59 0.45 1.06 0.00 0.00 176.91 178.28 2c4h h HIS 209 N 0.00 0.00 -0.45 -0.22 3.86 -0.66 0.51 115.15 118.19 2c4h h HIS 209 Ca -0.00 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.08 2c4h h HIS 209 Cb 0.88 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.34 2c4h h HIS 209 CO 0.00 0.59 -0.21 0.82 0.86 0.00 0.00 177.93 179.99 2c4h h ILE 210 N 0.00 1.27 0.15 2.45 2.04 -0.86 -3.24 117.51 119.32 2c4h h ILE 210 Ca -0.01 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.48 2c4h h ILE 210 Cb 1.38 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 2c4h h ILE 210 CO 0.08 0.47 -0.07 -0.07 0.00 0.00 0.00 178.15 178.55 2c4h h LEU 211 N 0.77 -0.18 -9.27 1.44 3.38 -1.15 -0.41 115.31 109.90 2c4h h LEU 211 Ca 0.10 -0.34 -0.56 0.00 0.09 0.00 0.00 57.88 57.17 2c4h h LEU 211 Cb 0.79 0.05 0.02 0.00 0.09 0.00 0.00 40.66 41.60 2c4h h LEU 211 CO 0.06 0.40 1.27 -0.24 0.09 0.00 0.00 178.44 180.02 2c4h n SER 212 N -4.90 3.89 -0.32 -0.43 2.88 0.16 -4.64 113.62 110.25 2c4h n SER 212 Ca -0.07 0.79 0.16 0.00 -1.33 0.00 0.00 58.87 58.42 2c4h n SER 212 Cb 0.25 -1.51 0.40 0.00 -0.75 0.00 0.00 64.21 62.61 2c4h n SER 212 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2c4h h PRO 213 N 11.21 0.59 0.00 -1.46 0.11 -1.87 -1.18 132.00 139.39 2c4h h PRO 213 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2c4h h PRO 213 Cb 1.25 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2c4h h PRO 213 CO 0.95 0.39 0.00 0.41 -0.21 0.00 0.00 178.00 179.54 2c4h n GLY 214 N -1.40 -0.73 0.02 -0.55 0.00 -1.26 -3.35 105.19 97.92 2c4h n GLY 214 Ca 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 2c4h n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c4h n SER 215 N -1.16 3.64 -0.34 1.61 7.64 -0.46 -4.78 113.62 119.76 2c4h n SER 215 Ca 0.11 0.00 0.21 0.00 1.01 0.00 0.00 58.87 60.20 2c4h n SER 215 Cb 0.10 0.87 0.44 0.00 -1.01 0.00 0.00 64.21 64.62 2c4h n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2c4h h ARG 216 N 0.00 0.42 0.00 1.43 3.08 -1.53 -1.08 114.38 116.71 2c4h h ARG 216 Ca -0.10 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2c4h h ARG 216 Cb 0.95 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.91 2c4h h ARG 216 CO 0.01 0.28 0.00 -0.25 -1.07 0.00 0.00 179.97 178.93 2c4h n ASP 217 N -4.95 0.00 -0.45 7.04 10.43 -1.26 -3.76 116.55 123.59 2c4h n ASP 217 Ca 0.30 0.27 0.14 0.00 2.57 0.00 0.00 54.79 58.06 2c4h n ASP 217 Cb 0.89 -0.42 0.53 0.00 1.84 0.00 0.00 41.12 43.97 2c4h n ASP 217 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2c4h n LEU 218 N -1.42 1.40 -3.68 0.64 4.77 -0.41 -4.93 117.00 113.37 2c4h n LEU 218 Ca 0.09 -0.49 -0.10 0.00 -0.03 0.00 0.00 56.01 55.48 2c4h n LEU 218 Cb 0.27 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 2c4h n LEU 218 CO 0.23 0.24 0.19 0.72 -1.33 0.00 0.00 177.39 177.44 2c4h s PHE 219 N -1.97 -0.14 -0.21 -1.77 -0.71 -1.25 -4.80 117.98 107.14 2c4h s PHE 219 Ca 0.38 -0.18 -0.18 0.00 -1.04 0.00 0.00 56.93 55.90 2c4h s PHE 219 Cb 0.20 0.29 -0.19 0.00 -1.21 0.00 0.00 43.02 42.11 2c4h s PHE 219 CO 0.33 -0.77 0.15 -2.13 -1.34 0.00 0.00 175.22 171.45 2c4h n ARG 220 N -0.26 0.59 -4.09 1.99 3.00 0.80 -4.95 116.66 113.73 2c4h n ARG 220 Ca -0.14 0.49 -0.16 0.00 -0.00 0.00 0.00 57.85 58.05 2c4h n ARG 220 Cb 0.63 -1.71 -0.04 0.00 0.00 0.00 0.00 32.46 31.35 2c4h n ARG 220 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2c4h s ARG 221 N -2.41 1.99 0.06 -0.14 1.70 -1.11 -4.63 118.95 114.41 2c4h s ARG 221 Ca -0.29 -1.82 -0.09 0.00 -0.47 0.00 0.00 55.73 53.05 2c4h s ARG 221 Cb 0.07 0.45 0.00 0.00 -0.57 0.00 0.00 34.95 34.90 2c4h s ARG 221 CO 0.60 -0.83 0.20 0.00 -1.08 0.00 0.00 175.30 174.19 2c4h s ALA 222 N -2.89 -0.32 -0.06 7.88 0.00 -1.15 -1.96 121.76 123.25 2c4h s ALA 222 Ca 0.31 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.90 2c4h s ALA 222 Cb -0.01 0.35 0.02 0.00 0.00 0.00 0.00 23.12 23.48 2c4h s ALA 222 CO 0.22 -0.41 -0.09 0.42 0.00 0.00 0.00 175.76 175.90 2c4h s ILE 223 N -3.00 0.91 -0.18 0.00 1.01 -0.53 -1.68 121.20 117.73 2c4h s ILE 223 Ca -0.02 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.32 2c4h s ILE 223 Cb 0.01 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.63 2c4h s ILE 223 CO -0.06 0.31 -0.18 -0.76 0.00 0.00 0.00 174.94 174.25 2c4h s LEU 224 N 0.89 2.18 -0.25 2.97 1.02 -0.30 -2.83 118.68 122.37 2c4h s LEU 224 Ca -0.11 -0.70 -0.06 0.00 0.02 0.00 0.00 54.13 53.29 2c4h s LEU 224 Cb -0.15 -1.44 -0.01 0.00 0.02 0.00 0.00 46.19 44.61 2c4h s LEU 224 CO 0.01 -0.03 0.03 -1.10 0.02 0.00 0.00 176.35 175.28 2c4h s GLN 225 N 1.30 3.42 -1.61 1.70 -0.21 -0.48 -2.14 119.66 121.64 2c4h s GLN 225 Ca 0.04 -0.62 -0.16 0.00 0.02 0.00 0.00 55.36 54.64 2c4h s GLN 225 Cb -0.14 -3.22 0.12 0.00 1.00 0.00 0.00 33.01 30.77 2c4h s GLN 225 CO -0.12 -0.25 0.88 0.43 -2.12 0.00 0.00 175.29 174.11 2c4h n SER 226 N 4.86 -4.00 -3.56 5.90 7.64 0.31 0.15 113.62 124.93 2c4h n SER 226 Ca -0.16 -0.89 -0.13 0.00 1.01 0.00 0.00 58.87 58.69 2c4h n SER 226 Cb 0.50 -3.35 -0.06 0.00 -1.01 0.00 0.00 64.21 60.30 2c4h n SER 226 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2c4h s GLY 227 N -3.33 -0.39 0.03 0.23 0.00 -1.26 -3.11 107.32 99.49 2c4h s GLY 227 Ca 0.68 1.80 -0.14 0.00 0.00 0.00 0.00 44.72 47.06 2c4h s GLY 227 CO 0.88 1.07 0.30 -0.45 0.00 0.00 0.00 173.10 174.90 2c4h s SER 228 N -1.01 -0.14 0.40 1.64 0.15 -1.26 -4.31 113.70 109.16 2c4h s SER 228 Ca -0.05 -0.12 0.08 0.00 0.70 0.00 0.00 55.95 56.56 2c4h s SER 228 Cb -0.01 0.34 0.82 0.00 -1.71 0.00 0.00 66.02 65.46 2c4h s SER 228 CO 0.04 -0.56 1.99 1.55 1.20 0.00 0.00 173.24 177.46 2c4h h PRO 229 N 3.42 0.42 -1.91 5.44 0.13 -1.81 -3.20 132.00 134.49 2c4h h PRO 229 Ca -0.31 -0.05 -0.52 0.00 -0.87 0.00 0.00 66.00 64.24 2c4h h PRO 229 Cb 1.19 -0.08 -0.19 0.00 0.13 0.00 0.00 31.00 32.06 2c4h h PRO 229 CO 0.44 0.38 0.50 0.27 -0.23 0.00 0.00 178.00 179.36 2c4h n ASN 230 N -4.39 6.65 -4.90 1.44 6.94 -1.26 -4.77 115.26 114.97 2c4h n ASN 230 Ca 0.01 -3.29 -0.29 0.00 -0.02 0.00 0.00 54.58 50.99 2c4h n ASN 230 Cb 0.15 -1.18 0.06 0.00 -2.36 0.00 0.00 39.78 36.45 2c4h n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2c4h h PRO 232 N -0.66 0.00 0.00 0.00 0.13 -1.84 -3.32 132.00 126.31 2c4h h PRO 232 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2c4h h PRO 232 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2c4h h PRO 232 CO 0.63 0.00 -0.93 -2.67 -0.23 0.00 0.00 178.00 174.80 2c4h n TRP 233 N -3.01 0.00 1.44 1.56 4.27 -1.26 -4.62 117.44 115.82 2c4h n TRP 233 Ca 0.02 0.00 0.15 0.00 -3.89 0.00 0.00 57.50 53.77 2c4h n TRP 233 Cb 0.35 -0.08 0.74 0.00 -1.36 0.00 0.00 31.31 30.96 2c4h n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2c4h n ALA 234 N -1.51 2.54 -3.36 -1.67 0.00 -1.25 -4.63 120.51 110.63 2c4h n ALA 234 Ca 0.02 -0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.17 2c4h n ALA 234 Cb 0.27 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 2c4h n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2c4h s SER 235 N -2.55 -0.52 0.16 0.00 1.04 -1.26 -3.47 113.70 107.10 2c4h s SER 235 Ca 0.29 0.04 0.02 0.00 0.48 0.00 0.00 55.95 56.77 2c4h s SER 235 Cb 0.20 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.84 2c4h s SER 235 CO 0.46 -0.90 -0.01 0.68 0.98 0.00 0.00 173.24 174.45 2c4h s VAL 236 N -3.41 0.70 0.87 5.02 -7.23 -0.56 -4.98 120.40 110.81 2c4h s VAL 236 Ca -0.00 -1.98 -0.12 0.00 -1.81 0.00 0.00 61.98 58.07 2c4h s VAL 236 Cb -0.00 -2.05 0.12 0.00 0.56 0.00 0.00 36.38 35.00 2c4h s VAL 236 CO -0.10 -0.54 1.15 -0.94 -0.31 0.00 0.00 175.10 174.36 2c4h s SER 237 N -3.15 3.86 0.17 4.85 1.04 -1.26 -1.43 113.70 117.77 2c4h s SER 237 Ca 0.22 0.92 -0.13 0.00 0.48 0.00 0.00 55.95 57.44 2c4h s SER 237 Cb 0.06 -1.48 0.07 0.00 0.10 0.00 0.00 66.02 64.77 2c4h s SER 237 CO 0.03 -2.33 1.80 0.58 0.98 0.00 0.00 173.24 174.30 2c4h h VAL 238 N -1.35 1.17 -0.32 5.02 2.07 -1.95 -1.17 116.25 119.72 2c4h h VAL 238 Ca -0.49 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 2c4h h VAL 238 Cb 1.33 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2c4h h VAL 238 CO 0.63 0.18 0.13 0.00 0.02 0.00 0.00 177.57 178.53 2c4h h ALA 239 N 1.16 0.42 -0.42 1.67 0.00 -1.95 -0.66 119.26 119.48 2c4h h ALA 239 Ca 0.20 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2c4h h ALA 239 Cb 0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2c4h h ALA 239 CO -0.04 0.02 -0.13 1.49 0.00 0.00 0.00 179.25 180.59 2c4h h GLU 240 N 0.37 0.77 -0.63 0.00 4.57 -1.91 -0.32 114.58 117.44 2c4h h GLU 240 Ca 0.11 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.01 2c4h h GLU 240 Cb 0.19 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 2c4h h GLU 240 CO -0.01 0.87 0.34 0.78 -1.18 0.00 0.00 179.01 179.82 2c4h h GLY 241 N 0.97 0.95 0.92 1.92 0.00 -0.98 -1.50 103.07 105.36 2c4h h GLY 241 Ca 0.11 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2c4h h GLY 241 CO 0.04 0.42 0.09 -0.09 0.00 0.00 0.00 176.54 177.00 2c4h h ARG 242 N 0.86 0.60 -0.77 4.80 2.43 -0.79 -1.60 114.38 119.91 2c4h h ARG 242 Ca 0.22 -0.15 0.05 0.00 -0.81 0.00 0.00 59.98 59.29 2c4h h ARG 242 Cb 0.05 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 2c4h h ARG 242 CO -0.04 0.64 0.47 -0.09 -1.51 0.00 0.00 179.97 179.45 2c4h h ARG 243 N 0.45 0.87 -0.28 0.20 2.43 -0.75 -0.11 114.38 117.19 2c4h h ARG 243 Ca 0.12 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 2c4h h ARG 243 Cb 0.31 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2c4h h ARG 243 CO 0.00 0.57 -0.40 0.00 -1.51 0.00 0.00 179.97 178.64 2c4h h ARG 244 N 0.89 0.68 -0.32 0.20 3.08 -1.11 -0.53 114.38 117.26 2c4h h ARG 244 Ca 0.33 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2c4h h ARG 244 Cb 0.10 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2c4h h ARG 244 CO -0.15 0.96 0.13 0.00 -1.07 0.00 0.00 179.97 179.83 2c4h h ALA 245 N 1.00 0.42 -0.37 0.04 0.00 -0.67 0.44 119.26 120.12 2c4h h ALA 245 Ca 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2c4h h ALA 245 Cb 0.93 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2c4h h ALA 245 CO 0.08 0.02 0.19 0.28 0.00 0.00 0.00 179.25 179.83 2c4h h VAL 246 N 0.37 1.16 -0.41 0.00 2.07 -0.91 -2.02 116.25 116.51 2c4h h VAL 246 Ca 0.11 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 2c4h h VAL 246 Cb 0.19 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2c4h h VAL 246 CO -0.01 0.16 0.16 -0.08 0.02 0.00 0.00 177.57 177.83 2c4h h GLU 247 N 0.47 0.57 -0.39 1.57 4.57 -0.85 0.46 114.58 120.98 2c4h h GLU 247 Ca 0.13 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.21 2c4h h GLU 247 Cb 0.09 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2c4h h GLU 247 CO -0.02 0.48 0.13 1.25 -1.18 0.00 0.00 179.01 179.67 2c4h h LEU 248 N 0.57 0.56 -0.74 1.64 6.46 -0.48 -0.86 115.31 122.46 2c4h h LEU 248 Ca 0.14 -0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 2c4h h LEU 248 Cb 0.12 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.87 2c4h h LEU 248 CO -0.01 0.60 0.44 1.23 -0.62 0.00 0.00 178.44 180.08 2c4h h GLY 249 N 0.48 1.08 1.28 3.75 0.00 -0.60 -1.97 103.07 107.09 2c4h h GLY 249 Ca 0.13 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.01 2c4h h GLY 249 CO -0.01 0.44 0.46 -0.09 0.00 0.00 0.00 176.54 177.35 2c4h h ARG 250 N 1.01 0.89 0.00 4.80 2.43 -0.48 -0.05 114.38 122.99 2c4h h ARG 250 Ca 0.27 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.34 2c4h h ARG 250 Cb -0.02 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 2c4h h ARG 250 CO -0.05 0.59 -0.18 -0.91 -1.51 0.00 0.00 179.97 177.92 2c4h h ASN 251 N 0.92 0.00 -0.40 -3.80 2.35 -0.41 -2.81 115.58 111.43 2c4h h ASN 251 Ca 0.26 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 2c4h h ASN 251 Cb -0.06 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 2c4h h ASN 251 CO -0.06 0.18 0.03 0.18 -1.65 0.00 0.00 177.43 176.10 2c4h n LEU 252 N -3.56 4.59 -3.77 1.61 4.77 -0.27 -4.97 117.00 115.40 2c4h n LEU 252 Ca -0.01 -3.10 -0.23 0.00 -0.03 0.00 0.00 56.01 52.65 2c4h n LEU 252 Cb 0.32 -0.61 0.02 0.00 -2.33 0.00 0.00 43.42 40.82 2c4h n LEU 252 CO 0.32 0.73 -0.09 0.59 -1.33 0.00 0.00 177.39 177.61 2c4h n ASN 253 N -0.29 -1.27 -4.91 -1.43 3.02 -0.83 -4.97 115.26 104.58 2c4h n ASN 253 Ca 0.26 -0.85 -0.28 0.00 -0.03 0.00 0.00 54.58 53.68 2c4h n ASN 253 Cb 1.04 -3.85 -0.03 0.00 -0.61 0.00 0.00 39.78 36.33 2c4h n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c4h s ASN 255 N -3.39 7.04 -0.21 0.00 3.84 -1.26 -4.74 114.94 116.23 2c4h s ASN 255 Ca 0.44 1.82 0.15 0.00 0.21 0.00 0.00 52.86 55.47 2c4h s ASN 255 Cb -0.10 -2.56 0.59 0.00 -0.55 0.00 0.00 41.25 38.62 2c4h s ASN 255 CO 0.32 -0.59 1.50 0.18 -2.79 0.00 0.00 177.10 175.72 2c4h n LEU 256 N 5.24 4.34 0.24 3.21 4.77 -1.26 -3.27 117.00 130.26 2c4h n LEU 256 Ca 0.11 -3.10 0.12 0.00 -0.03 0.00 0.00 56.01 53.12 2c4h n LEU 256 Cb 0.46 -0.59 0.48 0.00 -2.33 0.00 0.00 43.42 41.44 2c4h n LEU 256 CO 0.55 0.73 0.85 0.78 -1.33 0.00 0.00 177.39 178.98 2c4h h ASN 257 N 2.08 0.00 -5.00 -1.43 2.35 -1.96 -3.46 115.58 108.16 2c4h h ASN 257 Ca 0.04 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 2c4h h ASN 257 Cb 1.61 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.85 2c4h h ASN 257 CO 0.32 0.13 0.20 -0.94 -1.65 0.00 0.00 177.43 175.49 2c4h s SER 258 N -6.03 -0.59 0.17 5.81 1.04 -1.26 -5.03 113.70 107.81 2c4h s SER 258 Ca 0.02 0.17 -0.14 0.00 0.48 0.00 0.00 55.95 56.48 2c4h s SER 258 Cb 0.09 0.59 0.11 0.00 0.10 0.00 0.00 66.02 66.90 2c4h s SER 258 CO 0.61 -0.88 1.79 0.44 0.98 0.00 0.00 173.24 176.18 2c4h h ASP 259 N 2.24 0.37 -0.50 7.02 3.45 -1.94 0.75 116.42 127.82 2c4h h ASP 259 Ca -0.32 0.02 0.08 0.00 0.43 0.00 0.00 57.03 57.24 2c4h h ASP 259 Cb 1.27 -0.05 -0.07 0.00 -0.56 0.00 0.00 39.33 39.92 2c4h h ASP 259 CO 0.38 0.26 0.10 -0.08 -1.57 0.00 0.00 179.24 178.34 2c4h h GLU 260 N 0.49 0.23 -0.47 3.56 4.81 -1.97 0.20 114.58 121.43 2c4h h GLU 260 Ca 0.20 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 2c4h h GLU 260 Cb 0.09 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2c4h h GLU 260 CO -0.13 0.15 -0.21 0.93 -0.73 0.00 0.00 179.01 179.02 2c4h h GLU 261 N 0.24 0.96 0.12 1.92 5.08 -1.72 -0.59 114.58 120.58 2c4h h GLU 261 Ca 0.25 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2c4h h GLU 261 Cb 0.33 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2c4h h GLU 261 CO -0.32 1.07 -0.06 1.25 -1.00 0.00 0.00 179.01 179.95 2c4h h LEU 262 N 0.83 -0.13 -0.59 1.33 5.85 -0.09 -1.81 115.31 120.69 2c4h h LEU 262 Ca 0.11 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2c4h h LEU 262 Cb 0.78 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 2c4h h LEU 262 CO 0.06 -0.01 0.36 0.40 -0.34 0.00 0.00 178.44 178.92 2c4h h ILE 263 N -0.25 1.17 -0.53 4.05 2.04 -0.60 -0.74 117.51 122.66 2c4h h ILE 263 Ca -0.02 -0.37 0.05 0.00 1.00 0.00 0.00 64.86 65.53 2c4h h ILE 263 Cb 0.20 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.58 2c4h h ILE 263 CO 0.03 0.17 0.26 -0.74 0.00 0.00 0.00 178.15 177.87 2c4h h HIS 264 N 0.80 0.47 -0.12 1.37 2.76 -0.99 -0.05 115.15 119.38 2c4h h HIS 264 Ca 0.21 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.40 2c4h h HIS 264 Cb -0.03 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 28.79 2c4h h HIS 264 CO -0.02 0.22 0.05 0.00 -1.30 0.00 0.00 177.93 176.87 2c4h h LEU 266 N 0.03 0.00 -0.60 0.00 3.38 -0.72 -1.82 115.31 115.58 2c4h h LEU 266 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2c4h h LEU 266 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2c4h h LEU 266 CO -0.00 0.06 0.00 0.03 0.09 0.00 0.00 178.44 178.62 2c4h h ARG 267 N 0.00 0.00 0.00 1.13 3.08 -0.78 -3.10 114.38 114.72 2c4h h ARG 267 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2c4h h ARG 267 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2c4h h ARG 267 CO 0.01 0.00 -0.46 0.93 -1.07 0.00 0.00 179.97 179.37 2c4h h GLU 268 N 0.00 0.00 -7.09 0.04 5.08 -1.13 -3.47 114.58 108.02 2c4h h GLU 268 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2c4h h GLU 268 Cb 0.77 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.05 2c4h h GLU 268 CO 0.00 0.00 0.39 0.15 -1.00 0.00 0.00 179.01 178.55 2c4h s LYS 269 N -3.26 3.73 0.48 2.33 -0.14 -1.17 -5.04 119.74 116.67 2c4h s LYS 269 Ca 0.04 1.36 -0.20 0.00 -1.36 0.00 0.00 55.97 55.80 2c4h s LYS 269 Cb 0.08 -2.08 -0.08 0.00 -1.68 0.00 0.00 37.83 34.06 2c4h s LYS 269 CO 0.72 -0.49 1.05 0.15 -0.76 0.00 0.00 175.35 176.02 2c4h s LYS 270 N -3.32 3.80 0.21 1.68 1.02 -1.26 -4.95 119.74 116.92 2c4h s LYS 270 Ca 0.67 1.39 -0.14 0.00 0.02 0.00 0.00 55.97 57.91 2c4h s LYS 270 Cb -0.17 -2.12 0.24 0.00 -0.52 0.00 0.00 37.83 35.26 2c4h s LYS 270 CO 0.22 -0.44 1.61 -1.35 -0.92 0.00 0.00 175.35 174.47 2c4h h PRO 271 N 1.60 -0.03 0.00 -1.68 0.11 -1.96 -0.68 132.00 129.36 2c4h h PRO 271 Ca -0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2c4h h PRO 271 Cb 1.22 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2c4h h PRO 271 CO 0.59 -0.02 -0.03 0.37 -0.21 0.00 0.00 178.00 178.69 2c4h h GLN 272 N -0.04 0.00 -0.44 1.05 5.75 -1.98 -1.95 115.11 117.49 2c4h h GLN 272 Ca 0.31 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.75 2c4h h GLN 272 Cb 0.51 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.04 2c4h h GLN 272 CO -0.70 0.03 0.05 0.93 -2.65 0.00 0.00 178.83 176.50 2c4h h GLU 273 N 0.00 0.74 -0.40 1.69 5.08 -1.49 0.12 114.58 120.33 2c4h h GLU 273 Ca -0.00 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 2c4h h GLU 273 Cb 0.09 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2c4h h GLU 273 CO 0.00 0.78 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.69 2c4h h LEU 274 N 0.60 0.73 -1.00 1.33 4.07 -1.35 -3.03 115.31 116.66 2c4h h LEU 274 Ca 0.13 -0.33 -0.06 0.00 0.08 0.00 0.00 57.88 57.70 2c4h h LEU 274 Cb 0.42 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.93 2c4h h LEU 274 CO 0.01 0.89 0.09 0.40 -1.08 0.00 0.00 178.44 178.76 2c4h h ILE 275 N 0.55 1.23 -0.75 1.22 2.04 -1.23 -1.65 117.51 118.92 2c4h h ILE 275 Ca 0.11 -0.87 0.06 0.00 1.00 0.00 0.00 64.86 65.17 2c4h h ILE 275 Cb 0.54 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.30 2c4h h ILE 275 CO 0.03 0.32 0.49 0.44 0.00 0.00 0.00 178.15 179.43 2c4h h ASP 276 N 0.78 0.70 -0.13 1.72 3.32 -0.63 -2.92 116.42 119.26 2c4h h ASP 276 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2c4h h ASP 276 Cb 0.34 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2c4h h ASP 276 CO 0.00 0.45 0.00 1.33 -1.72 0.00 0.00 179.24 179.31 2c4h n VAL 277 N -4.48 0.26 -0.34 -1.35 0.24 -1.14 -4.71 118.33 106.81 2c4h n VAL 277 Ca 0.11 -0.63 0.19 0.00 -2.04 0.00 0.00 64.34 61.97 2c4h n VAL 277 Cb 0.22 1.09 0.40 0.00 -1.47 0.00 0.00 33.84 34.08 2c4h n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2c4h h GLU 278 N 2.69 0.50 -0.00 7.34 4.81 -1.10 -1.13 114.58 127.69 2c4h h GLU 278 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2c4h h GLU 278 Cb 0.64 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.90 2c4h h GLU 278 CO 0.00 0.33 -0.03 0.91 -0.73 0.00 0.00 179.01 179.49 2c4h n TRP 279 N -4.93 0.00 1.38 0.92 7.02 -1.26 -3.68 117.44 116.88 2c4h n TRP 279 Ca 0.28 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.90 2c4h n TRP 279 Cb 0.80 -0.12 0.62 0.00 -2.42 0.00 0.00 31.31 30.19 2c4h n TRP 279 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2c4h n ASN 280 N -0.96 0.39 -0.56 -0.99 3.02 -0.43 -3.83 115.26 111.91 2c4h n ASN 280 Ca 0.19 -0.46 0.13 0.00 -0.03 0.00 0.00 54.58 54.40 2c4h n ASN 280 Cb 0.20 -0.10 0.26 0.00 -0.61 0.00 0.00 39.78 39.53 2c4h n ASN 280 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2c4h n VAL 281 N -1.04 0.00 -2.02 2.41 0.24 -1.24 -4.94 118.33 111.75 2c4h n VAL 281 Ca 0.14 -0.29 -0.41 0.00 -2.04 0.00 0.00 64.34 61.74 2c4h n VAL 281 Cb 0.28 0.91 -0.02 0.00 -1.47 0.00 0.00 33.84 33.54 2c4h n VAL 281 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2c4h s LEU 282 N -2.22 4.39 0.35 1.34 1.43 -1.25 -4.81 118.68 117.91 2c4h s LEU 282 Ca 0.28 2.77 0.17 0.00 -1.03 0.00 0.00 54.13 56.32 2c4h s LEU 282 Cb 0.20 -3.65 0.58 0.00 0.03 0.00 0.00 46.19 43.35 2c4h s LEU 282 CO 0.42 -0.65 1.69 1.55 0.23 0.00 0.00 176.35 179.59 2c4h h PRO 283 N 3.65 0.00 -5.19 1.29 0.13 -1.96 -3.46 132.00 126.46 2c4h h PRO 283 Ca -0.49 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.24 2c4h h PRO 283 Cb 1.23 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 2c4h h PRO 283 CO 0.68 0.43 -0.67 -0.06 -0.23 0.00 0.00 178.00 178.15 2c4h s PHE 284 N -3.57 1.61 -0.34 1.56 0.08 -1.26 -5.09 117.98 110.98 2c4h s PHE 284 Ca -0.00 -0.84 -0.29 0.00 0.12 0.00 0.00 56.93 55.92 2c4h s PHE 284 Cb 0.11 -0.91 0.01 0.00 -0.57 0.00 0.00 43.02 41.66 2c4h s PHE 284 CO 0.71 0.06 1.15 0.34 -0.10 0.00 0.00 175.22 177.37 2c4h s ASP 285 N -3.32 6.81 0.31 1.36 2.15 -1.26 -4.95 116.67 117.77 2c4h s ASP 285 Ca 0.27 1.01 -0.17 0.00 0.43 0.00 0.00 52.55 54.08 2c4h s ASP 285 Cb 0.05 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 40.15 2c4h s ASP 285 CO 0.08 -0.99 0.69 -0.94 -0.17 0.00 0.00 175.17 173.84 2c4h s SER 286 N 2.09 -0.10 0.13 -0.34 1.04 -1.26 -4.57 113.70 110.69 2c4h s SER 286 Ca 0.49 -0.85 0.07 0.00 0.48 0.00 0.00 55.95 56.14 2c4h s SER 286 Cb -0.13 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 2c4h s SER 286 CO 0.20 -1.41 -0.17 0.27 0.98 0.00 0.00 173.24 173.11 2c4h s ILE 287 N -3.44 1.59 -1.28 -1.02 -4.36 -1.00 -4.73 121.20 106.95 2c4h s ILE 287 Ca 0.15 -1.75 -0.03 0.00 -0.26 0.00 0.00 60.65 58.77 2c4h s ILE 287 Cb -0.05 -1.64 0.00 0.00 1.25 0.00 0.00 42.46 42.03 2c4h s ILE 287 CO 0.09 -0.30 0.35 0.33 0.24 0.00 0.00 174.94 175.65 2c4h n PHE 288 N 0.57 -1.35 -4.39 1.37 -0.00 -1.26 -4.80 117.46 107.61 2c4h n PHE 288 Ca -0.16 0.30 -0.22 0.00 -0.00 0.00 0.00 57.45 57.38 2c4h n PHE 288 Cb 0.56 -3.67 -0.16 0.00 -0.00 0.00 0.00 39.48 36.21 2c4h n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2c4h s ARG 289 N -5.28 1.25 0.05 -4.13 1.81 -1.26 -4.66 118.95 106.72 2c4h s ARG 289 Ca 0.18 -0.27 0.09 0.00 -1.72 0.00 0.00 55.73 54.00 2c4h s ARG 289 Cb -0.08 -1.10 -0.03 0.00 -0.45 0.00 0.00 34.95 33.29 2c4h s ARG 289 CO 0.22 -0.01 -0.25 -0.06 -0.68 0.00 0.00 175.30 174.52 2c4h s PHE 290 N 0.71 2.18 0.05 -0.53 0.08 -1.26 -5.06 117.98 114.15 2c4h s PHE 290 Ca -0.12 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.23 2c4h s PHE 290 Cb -0.15 -1.29 -0.18 0.00 -0.57 0.00 0.00 43.02 40.84 2c4h s PHE 290 CO 0.02 0.14 1.50 0.77 -0.10 0.00 0.00 175.22 177.55 2c4h h SER 291 N 4.72 -0.59 -3.55 1.36 0.02 -1.90 -3.41 113.55 110.20 2c4h h SER 291 Ca -0.46 -0.03 -0.70 0.00 -0.84 0.00 0.00 61.79 59.77 2c4h h SER 291 Cb 1.15 0.15 -0.32 0.00 0.14 0.00 0.00 62.40 63.52 2c4h h SER 291 CO 0.43 -0.34 -0.56 -0.36 -1.14 0.00 0.00 176.83 174.86 2c4h s PHE 292 N -5.61 3.42 0.32 3.45 0.08 -1.26 -5.01 117.98 113.36 2c4h s PHE 292 Ca -0.16 -1.97 0.03 0.00 0.12 0.00 0.00 56.93 54.95 2c4h s PHE 292 Cb 0.03 -2.84 -0.05 0.00 -0.57 0.00 0.00 43.02 39.59 2c4h s PHE 292 CO 0.59 -0.88 0.09 0.14 -0.10 0.00 0.00 175.22 175.06 2c4h s VAL 293 N 1.27 0.83 0.54 -0.44 -7.23 -1.26 -4.47 120.40 109.64 2c4h s VAL 293 Ca 0.03 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 58.01 2c4h s VAL 293 Cb -0.22 -2.66 -0.10 0.00 0.56 0.00 0.00 36.38 33.97 2c4h s VAL 293 CO -0.01 0.00 0.50 -2.65 -0.31 0.00 0.00 175.10 172.62 2c4h n PRO 294 N -0.64 0.51 -5.29 4.82 -0.02 -1.23 -4.66 135.00 128.50 2c4h n PRO 294 Ca -0.02 0.20 -0.31 0.00 -2.02 0.00 0.00 63.50 61.35 2c4h n PRO 294 Cb 0.66 -1.64 -0.16 0.00 -0.02 0.00 0.00 33.50 32.34 2c4h n PRO 294 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2c4h s VAL 295 N -1.70 2.03 -1.05 -1.45 0.11 -1.26 -1.49 120.40 115.60 2c4h s VAL 295 Ca 0.67 -1.09 -0.22 0.00 -2.93 0.00 0.00 61.98 58.41 2c4h s VAL 295 Cb -0.47 -1.70 0.05 0.00 -1.53 0.00 0.00 36.38 32.74 2c4h s VAL 295 CO 0.56 0.57 1.48 -0.63 -3.33 0.00 0.00 175.10 173.74 2c4h s ILE 296 N -0.49 3.96 -0.58 7.04 -1.09 -0.52 -4.78 121.20 124.74 2c4h s ILE 296 Ca 0.06 -0.91 0.22 0.00 -2.23 0.00 0.00 60.65 57.79 2c4h s ILE 296 Cb -0.11 -5.07 -0.18 0.00 -1.58 0.00 0.00 42.46 35.53 2c4h s ILE 296 CO 0.00 -1.94 0.90 -0.90 -1.23 0.00 0.00 174.94 171.78 2c4h n ASP 297 N 8.77 0.58 0.00 3.58 3.85 -1.26 -4.17 116.55 127.91 2c4h n ASP 297 Ca 0.35 -0.33 0.00 0.00 -0.71 0.00 0.00 54.79 54.10 2c4h n ASP 297 Cb 0.50 1.05 0.00 0.00 -1.35 0.00 0.00 41.12 41.32 2c4h n ASP 297 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2c4h n GLY 298 N 1.37 0.72 0.14 6.12 0.00 0.09 -4.91 105.19 108.73 2c4h n GLY 298 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2c4h n GLY 298 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c4h n GLU 299 N -2.00 0.00 -0.35 1.61 1.02 -1.26 -4.38 120.64 115.28 2c4h n GLU 299 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 2c4h n GLU 299 Cb 0.00 -0.09 0.10 0.00 -0.02 0.00 0.00 31.44 31.42 2c4h n GLU 299 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2c4h h PHE 300 N 0.00 1.17 -3.78 -0.32 3.04 -1.91 -3.35 116.94 111.79 2c4h h PHE 300 Ca 0.00 0.03 -0.68 0.00 3.98 0.00 0.00 57.97 61.30 2c4h h PHE 300 Cb 0.00 -0.40 -0.36 0.00 2.56 0.00 0.00 35.95 37.76 2c4h h PHE 300 CO 0.00 0.74 -0.73 -0.06 -2.02 0.00 0.00 178.31 176.24 2c4h s PHE 301 N -6.13 3.37 0.14 0.41 0.08 -1.26 -4.31 117.98 110.29 2c4h s PHE 301 Ca -0.13 -2.28 -0.19 0.00 0.12 0.00 0.00 56.93 54.46 2c4h s PHE 301 Cb 0.17 -2.25 0.02 0.00 -0.57 0.00 0.00 43.02 40.38 2c4h s PHE 301 CO 0.81 -0.87 1.70 -1.35 -0.10 0.00 0.00 175.22 175.41 2c4h h PRO 302 N 7.85 0.04 0.00 0.24 0.11 -1.76 0.29 132.00 138.77 2c4h h PRO 302 Ca -0.17 -0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.60 2c4h h PRO 302 Cb 1.05 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 2c4h h PRO 302 CO 0.51 0.03 -0.30 0.25 -0.21 0.00 0.00 178.00 178.29 2c4h n THR 303 N -5.19 0.00 -1.58 -1.15 -2.24 -1.26 -4.44 114.28 98.42 2c4h n THR 303 Ca -0.01 -1.53 -0.37 0.00 -2.27 0.00 0.00 64.05 59.88 2c4h n THR 303 Cb 0.15 0.61 0.06 0.00 -2.10 0.00 0.00 70.33 69.05 2c4h n THR 303 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2c4h n SER 304 N -1.85 0.89 -0.28 3.42 3.41 -1.26 -4.80 113.62 113.15 2c4h n SER 304 Ca -0.01 0.77 -0.03 0.00 -0.26 0.00 0.00 58.87 59.34 2c4h n SER 304 Cb 0.39 -1.42 0.09 0.00 -0.26 0.00 0.00 64.21 63.01 2c4h n SER 304 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2c4h h LEU 305 N 0.30 0.83 -0.74 1.04 4.07 -1.99 -2.06 115.31 116.76 2c4h h LEU 305 Ca -0.49 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.43 2c4h h LEU 305 Cb 1.36 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 42.87 2c4h h LEU 305 CO 0.50 0.58 0.33 -0.08 -1.08 0.00 0.00 178.44 178.69 2c4h h GLU 306 N 0.98 1.08 -0.10 1.13 4.57 -1.99 -0.67 114.58 119.58 2c4h h GLU 306 Ca 0.30 -0.18 -0.12 0.00 -1.18 0.00 0.00 59.36 58.19 2c4h h GLU 306 Cb -0.02 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.37 2c4h h GLU 306 CO -0.10 0.86 -0.47 0.66 -1.18 0.00 0.00 179.01 178.78 2c4h h SER 307 N 1.05 0.26 -0.45 1.04 4.64 -1.85 -0.39 113.55 117.84 2c4h h SER 307 Ca 0.25 -0.12 -0.08 0.00 -0.47 0.00 0.00 61.79 61.37 2c4h h SER 307 Cb 0.16 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2c4h h SER 307 CO -0.03 0.69 -0.05 0.24 -0.87 0.00 0.00 176.83 176.82 2c4h h MET 308 N 0.19 0.83 -0.59 4.77 2.86 -1.02 -1.85 114.93 120.13 2c4h h MET 308 Ca 0.01 -0.29 -0.10 0.00 -2.06 0.00 0.00 59.70 57.26 2c4h h MET 308 Cb 0.91 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 2c4h h MET 308 CO 0.07 0.91 -0.03 -0.07 1.06 0.00 0.00 176.91 178.85 2c4h h LEU 309 N 0.67 1.05 -0.63 1.22 3.38 -0.86 0.12 115.31 120.27 2c4h h LEU 309 Ca 0.12 -0.31 -0.12 0.00 0.09 0.00 0.00 57.88 57.66 2c4h h LEU 309 Cb 0.57 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2c4h h LEU 309 CO 0.03 1.11 -0.20 0.78 0.09 0.00 0.00 178.44 180.26 2c4h h ASN 310 N 0.96 0.88 0.17 -0.43 2.35 -0.96 -3.11 115.58 115.44 2c4h h ASN 310 Ca 0.16 -0.32 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2c4h h ASN 310 Cb 0.59 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2c4h h ASN 310 CO 0.04 1.06 -0.12 -1.54 -1.65 0.00 0.00 177.43 175.22 2c4h n SER 311 N -4.12 0.95 -0.38 5.81 3.41 -0.71 -4.92 113.62 113.65 2c4h n SER 311 Ca 0.00 -1.00 -0.04 0.00 -0.26 0.00 0.00 58.87 57.57 2c4h n SER 311 Cb 0.43 0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.40 2c4h n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c4h n GLY 312 N 1.25 0.54 3.10 5.00 0.00 -0.81 -4.93 105.19 109.33 2c4h n GLY 312 Ca 0.16 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 2c4h n GLY 312 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2c4h n ASN 313 N 1.27 4.53 -3.59 1.61 2.85 0.37 -4.84 115.26 117.46 2c4h n ASN 313 Ca -0.05 -2.92 -0.08 0.00 -0.11 0.00 0.00 54.58 51.43 2c4h n ASN 313 Cb 0.27 -1.65 -0.02 0.00 1.24 0.00 0.00 39.78 39.62 2c4h n ASN 313 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 2c4h s PHE 314 N 2.93 -0.32 0.20 1.20 -0.12 -1.26 -4.73 117.98 115.88 2c4h s PHE 314 Ca 0.48 0.08 -0.32 0.00 -0.05 0.00 0.00 56.93 57.12 2c4h s PHE 314 Cb 0.08 0.59 -0.11 0.00 -0.63 0.00 0.00 43.02 42.95 2c4h s PHE 314 CO -0.01 -0.77 1.66 0.21 -0.05 0.00 0.00 175.22 176.26 2c4h s LYS 315 N -3.40 4.15 -0.35 1.99 2.20 -0.16 -4.96 119.74 119.20 2c4h s LYS 315 Ca 0.07 2.53 -0.14 0.00 -0.36 0.00 0.00 55.97 58.06 2c4h s LYS 315 Cb -0.02 -3.10 -0.01 0.00 -1.51 0.00 0.00 37.83 33.20 2c4h s LYS 315 CO -0.05 -0.70 0.29 0.15 -0.36 0.00 0.00 175.35 174.68 2c4h s LYS 316 N 1.05 3.42 0.00 4.03 3.01 -1.26 -4.96 119.74 125.03 2c4h s LYS 316 Ca 0.72 -0.64 0.00 0.00 -1.01 0.00 0.00 55.97 55.05 2c4h s LYS 316 Cb -0.48 -3.84 0.00 0.00 -1.01 0.00 0.00 37.83 32.50 2c4h s LYS 316 CO 0.33 -0.53 0.00 -2.37 0.51 0.00 0.00 175.35 173.29 2c4h n THR 317 N 5.17 0.00 -3.88 2.17 5.66 -1.26 -4.82 114.28 117.32 2c4h n THR 317 Ca -0.11 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.56 2c4h n THR 317 Cb 0.49 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.22 2c4h n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2c4h s GLN 318 N 0.58 3.46 0.03 1.09 1.11 -1.26 -1.33 119.66 123.34 2c4h s GLN 318 Ca 0.00 -0.30 0.02 0.00 0.01 0.00 0.00 55.36 55.08 2c4h s GLN 318 Cb 0.00 -3.08 -0.02 0.00 -1.01 0.00 0.00 33.01 28.91 2c4h s GLN 318 CO 0.00 0.65 -0.07 0.96 0.01 0.00 0.00 175.29 176.85 2c4h s ILE 319 N -1.37 0.47 -0.08 1.08 -4.36 -0.17 -2.92 121.20 113.86 2c4h s ILE 319 Ca 0.29 -0.83 0.01 0.00 -0.26 0.00 0.00 60.65 59.86 2c4h s ILE 319 Cb -0.13 -0.51 0.02 0.00 1.25 0.00 0.00 42.46 43.09 2c4h s ILE 319 CO 0.20 -0.26 -0.11 -0.22 0.24 0.00 0.00 174.94 174.79 2c4h s LEU 320 N -1.18 1.53 0.20 0.37 0.20 -0.68 -1.35 118.68 117.77 2c4h s LEU 320 Ca -0.07 -0.31 -0.15 0.00 0.69 0.00 0.00 54.13 54.29 2c4h s LEU 320 Cb -0.08 -0.86 0.01 0.00 -0.43 0.00 0.00 46.19 44.84 2c4h s LEU 320 CO 0.00 -0.01 0.46 -1.48 -0.29 0.00 0.00 176.35 175.03 2c4h s LEU 321 N 0.98 0.34 0.00 -0.68 2.34 0.08 -1.15 118.68 120.60 2c4h s LEU 321 Ca -0.08 -0.65 -0.17 0.00 0.06 0.00 0.00 54.13 53.29 2c4h s LEU 321 Cb -0.15 1.85 0.05 0.00 -0.56 0.00 0.00 46.19 47.39 2c4h s LEU 321 CO -0.00 -1.03 0.75 0.61 -1.06 0.00 0.00 176.35 175.62 2c4h n GLY 322 N -0.31 0.42 3.18 -3.48 0.00 -0.91 -1.27 105.19 102.81 2c4h n GLY 322 Ca -0.08 -0.97 -0.11 0.00 0.00 0.00 0.00 46.02 44.86 2c4h n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2c4h s VAL 323 N -2.09 0.08 0.21 1.61 -7.23 -1.06 -0.53 120.40 111.39 2c4h s VAL 323 Ca 0.18 -1.96 0.04 0.00 -1.81 0.00 0.00 61.98 58.43 2c4h s VAL 323 Cb -0.01 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.63 2c4h s VAL 323 CO -0.00 -0.24 0.31 0.20 -0.31 0.00 0.00 175.10 175.06 2c4h s ASN 324 N -3.11 6.21 0.25 4.85 0.02 -1.26 -0.65 114.94 121.25 2c4h s ASN 324 Ca 0.31 0.06 -0.05 0.00 -1.02 0.00 0.00 52.86 52.16 2c4h s ASN 324 Cb 0.07 -1.81 0.28 0.00 0.02 0.00 0.00 41.25 39.81 2c4h s ASN 324 CO 0.07 -0.02 1.87 0.50 0.02 0.00 0.00 177.10 179.54 2c4h h LYS 325 N 1.59 1.17 -2.15 -0.60 3.64 -1.50 -3.34 116.57 115.39 2c4h h LYS 325 Ca -0.50 -0.14 -0.58 0.00 -1.27 0.00 0.00 60.65 58.16 2c4h h LYS 325 Cb 1.22 -0.23 -0.41 0.00 -0.41 0.00 0.00 32.23 32.40 2c4h h LYS 325 CO 0.64 0.86 -0.77 -0.25 -2.27 0.00 0.00 179.45 177.66 2c4h n ASP 326 N -4.34 2.83 -0.07 4.20 8.00 -0.89 -4.93 116.55 121.35 2c4h n ASP 326 Ca 0.09 -3.28 0.03 0.00 0.71 0.00 0.00 54.79 52.34 2c4h n ASP 326 Cb 0.10 -0.64 0.36 0.00 -0.02 0.00 0.00 41.12 40.92 2c4h n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2c4h h GLU 327 N 3.83 0.68 -0.00 -1.24 4.39 -1.75 -3.25 114.58 117.24 2c4h h GLU 327 Ca 0.15 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2c4h h GLU 327 Cb 0.71 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2c4h h GLU 327 CO 0.72 0.46 -0.34 0.41 -1.16 0.00 0.00 179.01 179.10 2c4h n GLY 328 N -1.43 -1.27 0.37 -3.84 0.00 -1.26 -4.31 105.19 93.45 2c4h n GLY 328 Ca 0.05 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.84 2c4h n GLY 328 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c4h h SER 329 N 0.08 0.88 -0.81 1.61 4.64 -1.81 -2.23 113.55 115.90 2c4h h SER 329 Ca 0.00 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 2c4h h SER 329 Cb 0.49 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.38 2c4h h SER 329 CO 0.00 0.52 0.48 0.15 -0.87 0.00 0.00 176.83 177.11 2c4h h PHE 330 N 0.97 1.08 0.00 4.77 3.57 -1.84 -1.64 116.94 123.85 2c4h h PHE 330 Ca 0.43 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.84 2c4h h PHE 330 Cb 0.35 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2c4h h PHE 330 CO -0.00 0.73 -0.36 0.74 -2.23 0.00 0.00 178.31 177.18 2c4h h PHE 331 N 1.12 0.00 0.11 0.41 -1.00 -1.70 -2.66 116.94 113.22 2c4h h PHE 331 Ca 0.29 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 60.79 2c4h h PHE 331 Cb -0.03 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.55 2c4h h PHE 331 CO -0.00 0.36 -1.20 -0.07 -1.61 0.00 0.00 178.31 175.79 2c4h h LEU 332 N 0.00 0.73 -0.56 1.54 3.38 -1.16 -2.95 115.31 116.29 2c4h h LEU 332 Ca -0.00 -0.68 0.02 0.00 0.09 0.00 0.00 57.88 57.30 2c4h h LEU 332 Cb 0.97 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2c4h h LEU 332 CO 0.05 1.50 0.35 0.25 0.09 0.00 0.00 178.44 180.68 2c4h h LEU 333 N 0.23 0.59 -0.69 1.67 5.85 -1.22 0.90 115.31 122.64 2c4h h LEU 333 Ca -0.16 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2c4h h LEU 333 Cb 1.88 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.78 2c4h h LEU 333 CO 0.22 0.42 -0.04 1.88 -0.34 0.00 0.00 178.44 180.58 2c4h h TYR 334 N 0.71 0.00 0.00 1.25 -1.99 -1.53 -3.41 116.97 111.99 2c4h h TYR 334 Ca 0.22 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.95 2c4h h TYR 334 Cb -0.01 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2c4h h TYR 334 CO -0.05 0.04 0.00 0.41 -0.00 0.00 0.00 178.16 178.56 2c4h n GLY 335 N 0.59 0.46 3.75 3.88 0.00 -1.11 -5.09 105.19 107.68 2c4h n GLY 335 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2c4h n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4h s ALA 336 N 0.00 3.40 0.30 4.61 0.00 0.29 -5.03 121.76 125.34 2c4h s ALA 336 Ca 0.00 0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.92 2c4h s ALA 336 Cb 0.00 -2.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.07 2c4h s ALA 336 CO 0.00 0.11 1.32 -1.25 0.00 0.00 0.00 175.76 175.94 2c4h s PRO 337 N -0.22 4.36 0.00 0.00 0.04 -1.26 -3.03 135.00 134.88 2c4h s PRO 337 Ca 0.37 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.61 2c4h s PRO 337 Cb -0.20 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.24 2c4h s PRO 337 CO 0.22 -0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.46 2c4h n GLY 338 N 1.17 2.85 3.85 0.56 0.00 -1.26 -4.84 105.19 107.52 2c4h n GLY 338 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2c4h n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c4h s PHE 339 N -2.78 3.66 0.03 1.61 0.40 -1.17 -4.58 117.98 115.15 2c4h s PHE 339 Ca 0.00 0.78 -0.17 0.00 -0.60 0.00 0.00 56.93 56.94 2c4h s PHE 339 Cb 0.00 -2.16 0.03 0.00 0.51 0.00 0.00 43.02 41.41 2c4h s PHE 339 CO 0.00 0.65 0.39 -1.54 0.70 0.00 0.00 175.22 175.42 2c4h s SER 340 N -0.94 -0.25 0.27 1.36 1.04 -1.26 -4.89 113.70 109.01 2c4h s SER 340 Ca 0.20 -0.00 0.04 0.00 0.48 0.00 0.00 55.95 56.66 2c4h s SER 340 Cb -0.15 0.40 0.36 0.00 0.10 0.00 0.00 66.02 66.73 2c4h s SER 340 CO 0.09 -0.63 1.65 0.50 0.98 0.00 0.00 173.24 175.84 2c4h h LYS 341 N 3.16 0.36 -0.64 4.02 3.64 -1.98 -3.29 116.57 121.83 2c4h h LYS 341 Ca -0.31 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2c4h h LYS 341 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2c4h h LYS 341 CO 0.43 0.72 0.00 -0.25 -2.27 0.00 0.00 179.45 178.08 2c4h n ASP 342 N -4.02 4.27 -4.15 4.20 10.43 -1.26 -4.56 116.55 121.46 2c4h n ASP 342 Ca -0.02 -2.40 -0.25 0.00 2.57 0.00 0.00 54.79 54.69 2c4h n ASP 342 Cb 0.50 -0.55 -0.08 0.00 1.84 0.00 0.00 41.12 42.83 2c4h n ASP 342 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2c4h s SER 343 N -0.84 2.77 0.00 -2.24 1.04 -1.24 -5.02 113.70 108.18 2c4h s SER 343 Ca 0.45 -1.65 0.30 0.00 0.48 0.00 0.00 55.95 55.53 2c4h s SER 343 Cb 0.29 0.47 1.48 0.00 0.10 0.00 0.00 66.02 68.36 2c4h s SER 343 CO 0.21 -0.91 1.99 -0.62 0.98 0.00 0.00 173.24 174.90 2c4h n GLU 344 N -0.90 1.23 -3.85 4.02 1.02 -1.26 -4.84 120.64 116.06 2c4h n GLU 344 Ca -0.06 -0.41 -0.24 0.00 -0.02 0.00 0.00 57.16 56.43 2c4h n GLU 344 Cb 0.65 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 2c4h n GLU 344 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2c4h n SER 345 N -0.53 -0.88 -4.69 1.62 7.64 -1.26 -4.87 113.62 110.66 2c4h n SER 345 Ca 0.21 -0.95 -0.42 0.00 1.01 0.00 0.00 58.87 58.72 2c4h n SER 345 Cb 0.23 -3.40 -0.03 0.00 -1.01 0.00 0.00 64.21 60.00 2c4h n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2c4h s LYS 346 N -6.33 4.33 -0.16 1.43 1.02 -1.26 -4.72 119.74 114.05 2c4h s LYS 346 Ca 0.03 1.76 -0.13 0.00 0.02 0.00 0.00 55.97 57.64 2c4h s LYS 346 Cb -0.01 -3.56 -0.05 0.00 -0.52 0.00 0.00 37.83 33.69 2c4h s LYS 346 CO 0.86 -0.48 0.28 0.42 -0.92 0.00 0.00 175.35 175.50 2c4h s ILE 347 N 2.27 5.31 0.71 2.17 -1.09 -0.52 -4.93 121.20 125.12 2c4h s ILE 347 Ca 0.58 0.51 -0.11 0.00 -2.23 0.00 0.00 60.65 59.40 2c4h s ILE 347 Cb -0.27 -3.61 0.02 0.00 -1.58 0.00 0.00 42.46 37.02 2c4h s ILE 347 CO 0.23 0.41 1.07 -0.94 -1.23 0.00 0.00 174.94 174.48 2c4h s SER 348 N 0.35 5.33 0.26 3.58 1.04 -1.26 -3.96 113.70 119.04 2c4h s SER 348 Ca 0.16 1.39 -0.02 0.00 0.48 0.00 0.00 55.95 57.96 2c4h s SER 348 Cb -0.13 -2.25 0.43 0.00 0.10 0.00 0.00 66.02 64.17 2c4h s SER 348 CO 0.04 -1.45 1.86 -0.09 0.98 0.00 0.00 173.24 174.58 2c4h h ARG 349 N -0.72 1.03 0.25 4.02 9.65 -1.89 -0.97 114.38 125.75 2c4h h ARG 349 Ca -0.45 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.37 2c4h h ARG 349 Cb 1.23 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 2c4h h ARG 349 CO 0.60 0.68 -0.19 1.49 2.80 0.00 0.00 179.97 185.36 2c4h h GLU 350 N 1.06 -0.42 0.00 0.20 4.57 -1.96 -1.78 114.58 116.25 2c4h h GLU 350 Ca 0.44 0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.61 2c4h h GLU 350 Cb 0.26 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2c4h h GLU 350 CO -0.20 -0.28 -0.16 -0.44 -1.18 0.00 0.00 179.01 176.74 2c4h h ASP 351 N -0.44 0.00 -0.38 1.04 3.45 -1.79 -1.91 116.42 116.38 2c4h h ASP 351 Ca -0.02 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.40 2c4h h ASP 351 Cb 0.39 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.14 2c4h h ASP 351 CO -0.01 0.16 0.08 0.15 -1.57 0.00 0.00 179.24 178.06 2c4h h PHE 352 N 0.00 0.66 -0.70 4.55 3.57 -0.72 0.73 116.94 125.03 2c4h h PHE 352 Ca -0.00 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.35 2c4h h PHE 352 Cb 0.31 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 2c4h h PHE 352 CO 0.00 0.65 0.20 0.52 -2.23 0.00 0.00 178.31 177.44 2c4h h MET 353 N 0.48 1.09 -0.58 1.11 2.86 -0.64 -0.69 114.93 118.56 2c4h h MET 353 Ca 0.12 -0.24 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 2c4h h MET 353 Cb 0.33 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.81 2c4h h MET 353 CO 0.00 0.95 0.11 0.77 1.06 0.00 0.00 176.91 179.80 2c4h h SER 354 N 1.05 0.91 -0.72 1.22 0.02 -1.13 -2.67 113.55 112.22 2c4h h SER 354 Ca 0.23 -0.25 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2c4h h SER 354 Cb 0.32 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 2c4h h SER 354 CO -0.00 0.93 0.43 1.23 -1.14 0.00 0.00 176.83 178.28 2c4h h GLY 355 N 0.85 1.05 1.00 -3.77 0.00 -0.22 -1.49 103.07 100.49 2c4h h GLY 355 Ca 0.18 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 2c4h h GLY 355 CO 0.01 0.43 0.39 -2.08 0.00 0.00 0.00 176.54 175.28 2c4h h VAL 356 N 0.99 1.18 -0.71 4.60 2.07 -1.01 -0.53 116.25 122.85 2c4h h VAL 356 Ca 0.26 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2c4h h VAL 356 Cb -0.03 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 2c4h h VAL 356 CO -0.05 0.19 0.36 0.50 0.02 0.00 0.00 177.57 178.59 2c4h h LYS 357 N 0.87 1.01 -0.12 1.57 1.63 -1.12 -1.15 116.57 119.25 2c4h h LYS 357 Ca 0.23 -0.14 -0.10 0.00 -0.85 0.00 0.00 60.65 59.79 2c4h h LYS 357 Cb -0.03 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.40 2c4h h LYS 357 CO -0.04 0.78 -0.36 -0.07 -3.45 0.00 0.00 179.45 176.31 2c4h h LEU 358 N 0.98 0.26 -0.13 5.20 3.38 -0.88 -3.20 115.31 120.93 2c4h h LEU 358 Ca 0.24 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.98 2c4h h LEU 358 Cb 0.09 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2c4h h LEU 358 CO -0.03 0.61 -0.63 0.28 0.09 0.00 0.00 178.44 178.75 2c4h h SER 359 N 0.22 0.00 -2.12 -0.43 0.02 -0.55 -2.65 113.55 108.03 2c4h h SER 359 Ca 0.02 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.41 2c4h h SER 359 Cb 0.74 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.88 2c4h h SER 359 CO 0.06 0.63 -0.86 0.52 -1.14 0.00 0.00 176.83 176.04 2c4h n VAL 360 N -3.31 1.22 0.07 2.27 0.31 -0.49 -4.94 118.33 113.47 2c4h n VAL 360 Ca 0.01 -4.86 0.14 0.00 -0.01 0.00 0.00 64.34 59.62 2c4h n VAL 360 Cb 0.77 -1.56 0.63 0.00 -0.91 0.00 0.00 33.84 32.76 2c4h n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2c4h h PRO 361 N 3.64 0.10 -0.08 5.55 0.13 -1.73 -2.24 132.00 137.36 2c4h h PRO 361 Ca 0.13 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2c4h h PRO 361 Cb 0.74 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2c4h h PRO 361 CO 0.67 0.06 0.00 0.72 -0.23 0.00 0.00 178.00 179.22 2c4h n HIS 362 N -4.46 0.11 -3.75 1.56 8.25 -1.26 -4.89 115.22 110.79 2c4h n HIS 362 Ca 0.05 -0.05 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 2c4h n HIS 362 Cb 0.36 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.42 2c4h n HIS 362 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2c4h s ALA 363 N -1.89 3.83 0.90 -1.41 0.00 -0.85 -5.09 121.76 117.25 2c4h s ALA 363 Ca 0.24 -0.54 -0.10 0.00 0.00 0.00 0.00 51.96 51.55 2c4h s ALA 363 Cb 0.12 -2.09 0.20 0.00 0.00 0.00 0.00 23.12 21.34 2c4h s ALA 363 CO 0.18 0.62 1.23 0.54 0.00 0.00 0.00 175.76 178.33 2c4h s ASN 364 N -1.45 3.34 0.25 0.00 2.20 -1.26 -4.77 114.94 113.26 2c4h s ASN 364 Ca 0.24 -0.10 -0.03 0.00 -0.94 0.00 0.00 52.86 52.03 2c4h s ASN 364 Cb -0.13 0.03 0.46 0.00 -2.00 0.00 0.00 41.25 39.60 2c4h s ASN 364 CO 0.13 -2.56 1.78 0.44 -2.94 0.00 0.00 177.10 173.95 2c4h h ASP 365 N -1.32 0.58 -0.72 3.54 5.19 -1.99 -0.87 116.42 120.82 2c4h h ASP 365 Ca -0.40 0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.02 2c4h h ASP 365 Cb 1.23 -0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.68 2c4h h ASP 365 CO 0.34 0.29 0.21 0.25 -3.12 0.00 0.00 179.24 177.21 2c4h h LEU 366 N 0.68 1.06 -0.76 1.55 5.85 -1.99 -0.70 115.31 121.01 2c4h h LEU 366 Ca 0.42 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2c4h h LEU 366 Cb 0.51 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2c4h h LEU 366 CO -0.31 0.99 0.35 1.23 -0.34 0.00 0.00 178.44 180.37 2c4h h GLY 367 N 1.07 1.18 1.18 3.75 0.00 -1.61 -0.07 103.07 108.57 2c4h h GLY 367 Ca 0.23 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.87 2c4h h GLY 367 CO -0.00 0.57 -0.02 1.41 0.00 0.00 0.00 176.54 178.49 2c4h h LEU 368 N 1.08 0.96 -0.84 3.11 3.38 -0.83 -1.04 115.31 121.12 2c4h h LEU 368 Ca 0.26 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2c4h h LEU 368 Cb 0.14 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2c4h h LEU 368 CO -0.03 1.03 0.26 0.44 0.09 0.00 0.00 178.44 180.22 2c4h h ASP 369 N 0.89 1.04 -0.01 -0.43 3.32 -0.65 0.12 116.42 120.69 2c4h h ASP 369 Ca 0.16 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 2c4h h ASP 369 Cb 0.55 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2c4h h ASP 369 CO 0.03 0.94 0.01 0.00 -1.72 0.00 0.00 179.24 178.50 2c4h h ALA 370 N 1.20 0.02 -0.36 3.45 0.00 -0.55 0.14 119.26 123.15 2c4h h ALA 370 Ca 0.24 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2c4h h ALA 370 Cb 0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2c4h h ALA 370 CO -0.01 -0.44 0.19 0.28 0.00 0.00 0.00 179.25 179.26 2c4h h VAL 371 N -0.06 1.15 -0.36 0.00 2.07 -0.92 -1.44 116.25 116.68 2c4h h VAL 371 Ca 0.00 -0.40 0.04 0.00 0.82 0.00 0.00 66.70 67.16 2c4h h VAL 371 Cb 0.08 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2c4h h VAL 371 CO -0.00 0.16 0.14 0.74 0.02 0.00 0.00 177.57 178.63 2c4h h THR 372 N 0.45 0.92 -0.86 2.57 2.02 -0.57 -1.62 112.91 115.83 2c4h h THR 372 Ca 0.13 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 2c4h h THR 372 Cb 0.08 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 2c4h h THR 372 CO -0.02 0.06 0.49 0.25 0.37 0.00 0.00 175.52 176.66 2c4h h LEU 373 N 0.31 1.05 -1.10 2.58 5.85 -0.53 -2.03 115.31 121.44 2c4h h LEU 373 Ca 0.16 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 2c4h h LEU 373 Cb 0.12 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2c4h h LEU 373 CO -0.15 0.83 -0.25 -0.61 -0.34 0.00 0.00 178.44 177.92 2c4h h GLN 374 N 1.19 0.32 -0.27 1.25 5.75 -0.72 -3.25 115.11 119.38 2c4h h GLN 374 Ca 0.30 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2c4h h GLN 374 Cb 0.00 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2c4h h GLN 374 CO -0.05 0.56 0.00 0.66 -2.65 0.00 0.00 178.83 177.35 2c4h n TYR 375 N -4.14 0.91 -5.02 3.99 4.02 -0.66 -4.99 117.16 111.27 2c4h n TYR 375 Ca -0.01 -0.84 -0.32 0.00 -0.01 0.00 0.00 57.90 56.72 2c4h n TYR 375 Cb 0.38 -0.29 -0.14 0.00 -0.02 0.00 0.00 39.34 39.26 2c4h n TYR 375 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2c4h s THR 376 N -2.67 2.71 -0.62 -0.72 2.01 -0.78 -4.77 115.64 110.79 2c4h s THR 376 Ca 0.41 -0.85 -0.18 0.00 0.31 0.00 0.00 61.69 61.38 2c4h s THR 376 Cb 0.32 -2.04 0.12 0.00 0.01 0.00 0.00 72.50 70.91 2c4h s THR 376 CO 0.09 0.58 0.70 -0.62 -0.69 0.00 0.00 174.62 174.68 2c4h s ASP 377 N -0.49 6.25 0.00 3.53 3.68 -1.26 -4.91 116.67 123.46 2c4h s ASP 377 Ca 0.06 -1.62 0.12 0.00 2.13 0.00 0.00 52.55 53.25 2c4h s ASP 377 Cb -0.12 -2.28 0.61 0.00 -1.45 0.00 0.00 42.92 39.68 2c4h s ASP 377 CO 0.01 -1.03 1.32 0.79 0.13 0.00 0.00 175.17 176.39 2c4h n TRP 378 N 5.99 0.00 0.67 -5.34 7.02 -1.26 -1.54 117.44 122.97 2c4h n TRP 378 Ca -0.07 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.53 2c4h n TRP 378 Cb 0.43 -0.32 0.23 0.00 -2.42 0.00 0.00 31.31 29.23 2c4h n TRP 378 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2c4h n MET 379 N -1.32 0.23 -2.73 -0.99 2.81 -1.26 -4.46 117.12 109.40 2c4h n MET 379 Ca 0.05 0.08 -0.09 0.00 -1.81 0.00 0.00 57.70 55.94 2c4h n MET 379 Cb 0.11 -1.66 0.09 0.00 -0.71 0.00 0.00 33.22 31.05 2c4h n MET 379 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2c4h n ASP 380 N -1.99 -2.31 0.00 7.83 2.03 -0.61 -5.00 116.55 116.49 2c4h n ASP 380 Ca 0.04 -3.60 0.09 0.00 0.52 0.00 0.00 54.79 51.84 2c4h n ASP 380 Cb 0.42 1.86 0.56 0.00 -0.72 0.00 0.00 41.12 43.24 2c4h n ASP 380 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2c4h n ASP 381 N 0.29 0.00 -0.69 1.67 3.85 -0.59 -2.70 116.55 118.37 2c4h n ASP 381 Ca 0.05 -1.27 0.08 0.00 -0.71 0.00 0.00 54.79 52.94 2c4h n ASP 381 Cb 0.71 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.59 2c4h n ASP 381 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2c4h n ASN 382 N -0.82 2.57 -4.58 -1.12 3.02 -1.26 -4.56 115.26 108.51 2c4h n ASN 382 Ca 0.14 -1.74 -0.41 0.00 -0.03 0.00 0.00 54.58 52.53 2c4h n ASN 382 Cb 0.06 -0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 2c4h n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2c4h s ASN 383 N -1.19 5.79 0.41 6.41 3.04 -1.10 -4.84 114.94 123.45 2c4h s ASN 383 Ca 0.22 0.83 0.12 0.00 0.04 0.00 0.00 52.86 54.07 2c4h s ASN 383 Cb 0.14 -2.53 0.96 0.00 -1.54 0.00 0.00 41.25 38.27 2c4h s ASN 383 CO 0.20 -1.88 1.93 1.23 -3.04 0.00 0.00 177.10 175.54 2c4h h GLY 384 N 14.26 0.80 0.79 1.21 0.00 -1.92 -0.58 103.07 117.63 2c4h h GLY 384 Ca -0.30 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 46.74 2c4h h GLY 384 CO 1.11 0.10 -0.20 -2.22 0.00 0.00 0.00 176.54 175.34 2c4h h ILE 385 N 0.52 1.34 -0.64 2.60 2.04 -1.89 -0.84 117.51 120.64 2c4h h ILE 385 Ca 0.35 -1.38 -0.08 0.00 1.00 0.00 0.00 64.86 64.75 2c4h h ILE 385 Cb 0.65 1.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 2c4h h ILE 385 CO -0.12 0.41 0.11 0.11 0.00 0.00 0.00 178.15 178.66 2c4h h LYS 386 N 0.07 1.06 -0.45 2.37 1.57 -1.81 -0.15 116.57 119.23 2c4h h LYS 386 Ca 0.02 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 2c4h h LYS 386 Cb 0.75 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2c4h h LYS 386 CO 0.05 0.98 0.26 -0.91 -0.57 0.00 0.00 179.45 179.26 2c4h h ASN 387 N 0.98 0.55 0.08 0.86 -0.26 -1.10 0.28 115.58 116.96 2c4h h ASN 387 Ca 0.19 -0.07 -0.00 0.00 -0.56 0.00 0.00 56.30 55.86 2c4h h ASN 387 Cb 0.43 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.56 2c4h h ASN 387 CO 0.01 0.46 -0.04 -0.09 -1.06 0.00 0.00 177.43 176.71 2c4h h ARG 388 N 0.59 -0.11 -0.75 0.81 1.12 -0.94 -1.58 114.38 113.52 2c4h h ARG 388 Ca 0.16 0.01 -0.06 0.00 -1.11 0.00 0.00 59.98 58.98 2c4h h ARG 388 Cb 0.03 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 29.98 2c4h h ARG 388 CO -0.03 0.04 0.24 -0.44 -3.11 0.00 0.00 179.97 176.67 2c4h h ASP 389 N -0.23 1.09 -0.59 -3.80 3.45 -0.89 -0.83 116.42 114.61 2c4h h ASP 389 Ca -0.01 -0.21 0.01 0.00 0.43 0.00 0.00 57.03 57.25 2c4h h ASP 389 Cb 0.19 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.65 2c4h h ASP 389 CO 0.02 1.00 0.39 1.23 -1.57 0.00 0.00 179.24 180.31 2c4h h GLY 390 N 1.11 0.83 1.22 2.75 0.00 -0.35 0.42 103.07 109.04 2c4h h GLY 390 Ca 0.24 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 2c4h h GLY 390 CO -0.01 0.30 0.04 1.41 0.00 0.00 0.00 176.54 178.28 2c4h h LEU 391 N 0.80 0.92 -0.62 3.11 3.38 -0.96 -0.81 115.31 121.13 2c4h h LEU 391 Ca 0.22 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2c4h h LEU 391 Cb -0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 2c4h h LEU 391 CO -0.05 0.95 0.37 -0.78 0.09 0.00 0.00 178.44 179.03 2c4h h ASP 392 N 0.89 0.75 -0.40 -0.43 -0.00 -0.48 -1.92 116.42 114.83 2c4h h ASP 392 Ca 0.17 -0.06 -0.05 0.00 -0.00 0.00 0.00 57.03 57.09 2c4h h ASP 392 Cb 0.47 -0.19 -0.02 0.00 -0.00 0.00 0.00 39.33 39.59 2c4h h ASP 392 CO 0.02 0.59 0.07 0.44 -0.00 0.00 0.00 179.24 180.36 2c4h h ASP 393 N 0.84 0.63 -0.43 2.28 3.45 -0.59 -2.17 116.42 120.42 2c4h h ASP 393 Ca 0.22 -0.26 0.07 0.00 0.43 0.00 0.00 57.03 57.49 2c4h h ASP 393 Cb -0.02 -0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 38.53 2c4h h ASP 393 CO -0.04 0.72 0.10 0.40 -1.57 0.00 0.00 179.24 178.85 2c4h h ILE 394 N 0.50 0.78 -0.36 0.35 2.04 -0.80 0.34 117.51 120.37 2c4h h ILE 394 Ca 0.12 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 2c4h h ILE 394 Cb 0.36 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2c4h h ILE 394 CO 0.01 0.04 0.10 0.58 0.00 0.00 0.00 178.15 178.88 2c4h h VAL 395 N 0.23 1.22 -0.26 1.67 2.07 -1.27 -1.34 116.25 118.58 2c4h h VAL 395 Ca 0.21 -0.74 -0.11 0.00 0.82 0.00 0.00 66.70 66.88 2c4h h VAL 395 Cb 0.25 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2c4h h VAL 395 CO -0.27 0.25 -0.27 1.23 0.02 0.00 0.00 177.57 178.53 2c4h h GLY 396 N 0.44 0.69 0.86 2.17 0.00 -1.05 -1.86 103.07 104.32 2c4h h GLY 396 Ca 0.12 -0.72 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 2c4h h GLY 396 CO -0.00 0.65 -0.04 -0.55 0.00 0.00 0.00 176.54 176.60 2c4h h ASP 397 N 0.35 -0.09 -0.58 0.19 3.45 -0.31 0.86 116.42 120.29 2c4h h ASP 397 Ca 0.04 -0.13 -0.09 0.00 0.43 0.00 0.00 57.03 57.29 2c4h h ASP 397 Cb 0.84 0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.61 2c4h h ASP 397 CO 0.07 0.08 0.03 -0.74 -1.57 0.00 0.00 179.24 177.11 2c4h h HIS 398 N -0.24 1.09 0.00 4.55 2.76 -1.31 -0.37 115.15 121.63 2c4h h HIS 398 Ca -0.01 -0.18 -0.12 0.00 -2.20 0.00 0.00 60.37 57.87 2c4h h HIS 398 Cb 0.21 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 2c4h h HIS 398 CO -0.03 0.97 -1.54 0.09 -1.30 0.00 0.00 177.93 176.12 2c4h n ASN 399 N -4.25 0.60 0.06 3.26 3.02 -0.70 -4.54 115.26 112.71 2c4h n ASN 399 Ca 0.03 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 2c4h n ASN 399 Cb 0.32 0.68 0.00 0.00 -0.61 0.00 0.00 39.78 40.17 2c4h n ASN 399 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2c4h n VAL 400 N -2.70 0.61 0.32 2.41 0.31 0.17 -4.71 118.33 114.73 2c4h n VAL 400 Ca -0.09 0.20 -0.17 0.00 -0.01 0.00 0.00 64.34 64.28 2c4h n VAL 400 Cb 0.75 -1.08 -0.09 0.00 -0.91 0.00 0.00 33.84 32.52 2c4h n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2c4h h ILE 401 N 0.00 0.41 -0.59 2.52 2.04 -1.27 -1.78 117.51 118.85 2c4h h ILE 401 Ca 0.00 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2c4h h ILE 401 Cb 0.00 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2c4h h ILE 401 CO 0.00 0.01 0.10 0.00 0.00 0.00 0.00 178.15 178.26 2c4h h PRO 403 N 0.89 0.98 -0.48 0.00 0.11 -1.72 -0.55 132.00 131.23 2c4h h PRO 403 Ca 0.18 -0.20 -0.13 0.00 0.11 0.00 0.00 66.00 65.96 2c4h h PRO 403 Cb 0.38 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 2c4h h PRO 403 CO 0.01 0.85 -0.22 1.25 -0.21 0.00 0.00 178.00 179.67 2c4h h LEU 404 N 0.94 1.03 -1.18 2.35 6.46 -0.64 -1.40 115.31 122.86 2c4h h LEU 404 Ca 0.21 -0.39 -0.07 0.00 -0.12 0.00 0.00 57.88 57.51 2c4h h LEU 404 Cb 0.29 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 2c4h h LEU 404 CO -0.01 1.20 -0.14 0.24 -0.62 0.00 0.00 178.44 179.11 2c4h h MET 405 N 0.86 0.39 -0.25 1.25 2.86 -0.35 0.15 114.93 119.84 2c4h h MET 405 Ca 0.11 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 2c4h h MET 405 Cb 0.81 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 2c4h h MET 405 CO 0.07 0.54 0.02 1.25 1.06 0.00 0.00 176.91 179.84 2c4h h HIS 406 N 0.37 0.46 -0.27 -0.22 -0.00 -0.82 -0.87 115.15 113.79 2c4h h HIS 406 Ca 0.07 -0.07 -0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2c4h h HIS 406 Cb 0.47 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.75 2c4h h HIS 406 CO 0.01 0.57 0.17 0.35 -0.00 0.00 0.00 177.93 179.03 2c4h h PHE 407 N 0.21 0.36 -0.75 5.26 3.57 -0.69 -1.31 116.94 123.59 2c4h h PHE 407 Ca 0.07 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 2c4h h PHE 407 Cb 0.37 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 2c4h h PHE 407 CO 0.03 0.26 0.28 -0.24 -2.23 0.00 0.00 178.31 176.41 2c4h h VAL 408 N 0.35 1.25 -0.53 1.41 3.04 -0.64 0.26 116.25 121.40 2c4h h VAL 408 Ca 0.10 -0.82 -0.05 0.00 -1.01 0.00 0.00 66.70 64.92 2c4h h VAL 408 Cb 0.00 0.37 -0.02 0.00 -2.01 0.00 0.00 31.29 29.63 2c4h h VAL 408 CO -0.02 0.33 0.14 0.78 -1.01 0.00 0.00 177.57 177.79 2c4h h ASN 409 N 1.10 0.79 -0.21 3.17 2.35 -0.87 -1.87 115.58 120.03 2c4h h ASN 409 Ca 0.25 -0.22 -0.15 0.00 -0.55 0.00 0.00 56.30 55.62 2c4h h ASN 409 Cb 0.23 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.39 2c4h h ASN 409 CO -0.02 0.81 -0.47 0.11 -1.65 0.00 0.00 177.43 176.21 2c4h h LYS 410 N 0.74 0.69 -0.48 0.81 1.79 -0.89 -3.30 116.57 115.92 2c4h h LYS 410 Ca 0.17 -0.46 -0.04 0.00 -2.18 0.00 0.00 60.65 58.13 2c4h h LYS 410 Cb 0.32 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 2c4h h LYS 410 CO -0.00 1.08 0.14 -0.92 -1.08 0.00 0.00 179.45 178.67 2c4h h TYR 411 N 0.40 0.80 -0.00 -1.35 3.20 -0.44 -2.95 116.97 116.62 2c4h h TYR 411 Ca 0.00 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.78 2c4h h TYR 411 Cb 1.08 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.12 2c4h h TYR 411 CO 0.09 0.71 0.01 1.15 -1.64 0.00 0.00 178.16 178.47 2c4h h THR 412 N 0.65 0.16 -0.73 1.81 2.02 -1.41 0.33 112.91 115.74 2c4h h THR 412 Ca 0.15 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.30 2c4h h THR 412 Cb 0.30 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2c4h h THR 412 CO -0.00 0.00 0.30 0.11 0.37 0.00 0.00 175.52 176.30 2c4h h LYS 413 N 0.00 1.07 0.00 6.66 1.79 -1.60 -3.29 116.57 121.20 2c4h h LYS 413 Ca 0.00 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2c4h h LYS 413 Cb 0.02 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 30.49 2c4h h LYS 413 CO -0.00 0.86 -1.16 1.19 -1.08 0.00 0.00 179.45 179.26 2c4h n PHE 414 N -4.30 0.00 -0.44 -1.35 3.72 -0.75 -5.06 117.46 109.27 2c4h n PHE 414 Ca 0.07 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.17 2c4h n PHE 414 Cb 0.17 -0.15 0.28 0.00 -0.94 0.00 0.00 39.48 38.83 2c4h n PHE 414 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2c4h s GLY 415 N -2.72 1.46 -0.13 1.37 0.00 0.11 -4.86 107.32 102.56 2c4h s GLY 415 Ca -0.02 -0.54 0.15 0.00 0.00 0.00 0.00 44.72 44.31 2c4h s GLY 415 CO 0.36 0.35 1.33 -2.01 0.00 0.00 0.00 173.10 173.14 2c4h n ASN 416 N -5.36 3.38 0.00 1.64 4.05 -0.44 -4.90 115.26 113.62 2c4h n ASN 416 Ca 0.08 -2.78 0.00 0.00 0.45 0.00 0.00 54.58 52.33 2c4h n ASN 416 Cb 0.58 -0.44 0.00 0.00 1.23 0.00 0.00 39.78 41.15 2c4h n ASN 416 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2c4h n GLY 417 N -0.45 3.26 3.19 8.20 0.00 -1.25 -4.66 105.19 113.49 2c4h n GLY 417 Ca 0.18 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 2c4h n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4h s THR 418 N 0.00 1.84 -0.17 2.61 2.01 -1.26 -0.99 115.64 119.67 2c4h s THR 418 Ca 0.00 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.09 2c4h s THR 418 Cb 0.00 -1.59 0.03 0.00 0.01 0.00 0.00 72.50 70.95 2c4h s THR 418 CO 0.00 0.51 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.01 2c4h s TYR 419 N 0.20 2.26 -0.06 4.92 2.02 -0.46 0.54 117.35 126.78 2c4h s TYR 419 Ca -0.12 -1.38 0.03 0.00 -0.37 0.00 0.00 57.07 55.23 2c4h s TYR 419 Cb -0.16 -1.61 -0.03 0.00 -0.40 0.00 0.00 41.96 39.77 2c4h s TYR 419 CO 0.06 -0.70 -0.13 -1.17 -1.57 0.00 0.00 175.55 172.04 2c4h s LEU 420 N 1.45 2.83 0.15 -1.29 2.96 -1.26 -0.74 118.68 122.79 2c4h s LEU 420 Ca 0.02 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 2c4h s LEU 420 Cb -0.14 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2c4h s LEU 420 CO -0.10 0.34 -0.08 -0.72 -1.32 0.00 0.00 176.35 174.47 2c4h s TYR 421 N -0.69 1.26 -0.25 5.38 -0.85 -0.40 -2.30 117.35 119.50 2c4h s TYR 421 Ca 0.10 -0.81 -0.01 0.00 -0.52 0.00 0.00 57.07 55.83 2c4h s TYR 421 Cb -0.11 -0.66 0.08 0.00 0.38 0.00 0.00 41.96 41.64 2c4h s TYR 421 CO 0.01 0.03 0.05 0.12 -1.52 0.00 0.00 175.55 174.23 2c4h s PHE 422 N -3.39 1.51 -0.45 -3.49 5.36 -0.15 -2.56 117.98 114.81 2c4h s PHE 422 Ca 0.18 -1.35 -0.25 0.00 -0.96 0.00 0.00 56.93 54.55 2c4h s PHE 422 Cb 0.03 -1.39 0.03 0.00 -0.34 0.00 0.00 43.02 41.35 2c4h s PHE 422 CO 0.01 -0.75 0.89 0.12 -1.46 0.00 0.00 175.22 174.04 2c4h s PHE 423 N 1.69 2.95 -0.23 10.12 5.36 0.17 -0.75 117.98 137.30 2c4h s PHE 423 Ca 0.03 0.37 0.15 0.00 -0.96 0.00 0.00 56.93 56.51 2c4h s PHE 423 Cb -0.17 -3.87 0.46 0.00 -0.34 0.00 0.00 43.02 39.10 2c4h s PHE 423 CO -0.15 -1.05 1.17 0.27 -1.46 0.00 0.00 175.22 174.00 2c4h n ASN 424 N 7.03 2.88 -4.25 6.13 6.94 -1.14 -1.84 115.26 131.02 2c4h n ASN 424 Ca 0.05 -3.09 -0.35 0.00 -0.02 0.00 0.00 54.58 51.18 2c4h n ASN 424 Cb 0.48 -0.41 -0.14 0.00 -2.36 0.00 0.00 39.78 37.35 2c4h n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2c4h s HIS 425 N -3.12 2.99 -0.14 -2.53 2.46 -1.25 -4.96 115.29 108.74 2c4h s HIS 425 Ca 0.40 -1.24 -0.25 0.00 0.47 0.00 0.00 55.06 54.43 2c4h s HIS 425 Cb 0.38 -2.08 -0.02 0.00 -0.13 0.00 0.00 32.58 30.73 2c4h s HIS 425 CO -0.03 -0.64 0.82 0.50 -2.47 0.00 0.00 174.74 172.92 2c4h s ARG 426 N 1.40 4.34 0.20 2.88 3.52 -1.26 -4.93 118.95 125.10 2c4h s ARG 426 Ca 0.03 1.03 -0.33 0.00 -0.13 0.00 0.00 55.73 56.34 2c4h s ARG 426 Cb -0.15 -3.55 -0.14 0.00 -1.56 0.00 0.00 34.95 29.56 2c4h s ARG 426 CO -0.04 -0.25 1.51 0.00 -0.81 0.00 0.00 175.30 175.71 2c4h n ALA 427 N 4.92 1.32 0.28 6.12 0.00 -1.26 -4.87 120.51 127.02 2c4h n ALA 427 Ca 0.04 0.43 0.13 0.00 0.00 0.00 0.00 53.44 54.04 2c4h n ALA 427 Cb 0.49 -2.33 0.82 0.00 0.00 0.00 0.00 19.45 18.44 2c4h n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c4h h SER 428 N 5.17 0.00 -0.60 0.00 4.64 -1.94 -2.41 113.55 118.40 2c4h h SER 428 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2c4h h SER 428 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2c4h h SER 428 CO 0.83 0.03 0.00 -0.46 -0.87 0.00 0.00 176.83 176.36 2c4h n ASN 429 N -3.93 4.60 -4.70 4.97 0.23 -1.26 -4.99 115.26 110.18 2c4h n ASN 429 Ca -0.03 -2.46 -0.43 0.00 -0.53 0.00 0.00 54.58 51.14 2c4h n ASN 429 Cb 0.12 -0.55 -0.03 0.00 -2.08 0.00 0.00 39.78 37.24 2c4h n ASN 429 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2c4h n LEU 430 N 0.97 3.96 0.04 -4.53 4.77 -0.91 -4.88 117.00 116.41 2c4h n LEU 430 Ca 0.25 1.03 0.13 0.00 -0.03 0.00 0.00 56.01 57.38 2c4h n LEU 430 Cb 0.86 -1.55 0.37 0.00 -2.33 0.00 0.00 43.42 40.77 2c4h n LEU 430 CO 0.22 0.15 0.67 1.33 -1.33 0.00 0.00 177.39 178.43 2c4h n VAL 431 N 4.29 0.21 -2.43 4.08 0.24 -1.26 -4.86 118.33 118.60 2c4h n VAL 431 Ca 0.17 -0.13 -0.33 0.00 -2.04 0.00 0.00 64.34 62.01 2c4h n VAL 431 Cb 0.35 -0.24 -0.03 0.00 -1.47 0.00 0.00 33.84 32.46 2c4h n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2c4h s TRP 432 N -3.06 3.23 0.82 6.34 0.52 -1.26 -4.97 118.94 120.56 2c4h s TRP 432 Ca 0.11 1.53 -0.14 0.00 0.02 0.00 0.00 56.10 57.62 2c4h s TRP 432 Cb 0.16 -2.91 0.06 0.00 -1.15 0.00 0.00 33.47 29.63 2c4h s TRP 432 CO 0.63 -0.58 0.94 -0.35 0.02 0.00 0.00 176.95 177.61 2c4h n PRO 433 N -1.38 0.09 -0.04 4.98 -0.04 -1.26 -4.92 135.00 132.43 2c4h n PRO 433 Ca 0.08 0.10 -0.01 0.00 -0.04 0.00 0.00 63.50 63.62 2c4h n PRO 433 Cb 0.53 -2.22 0.26 0.00 -0.04 0.00 0.00 33.50 32.04 2c4h n PRO 433 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2c4h h GLU 434 N -0.97 0.61 -0.03 0.54 4.57 -1.94 -2.84 114.58 114.53 2c4h h GLU 434 Ca -0.45 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 57.60 2c4h h GLU 434 Cb 1.30 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2c4h h GLU 434 CO 0.43 0.61 0.07 0.11 -1.18 0.00 0.00 179.01 179.05 2c4h h TRP 435 N 0.59 0.00 0.00 0.92 5.08 -1.91 -1.06 115.95 119.57 2c4h h TRP 435 Ca 0.13 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.10 2c4h h TRP 435 Cb 0.33 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.49 2c4h h TRP 435 CO 0.01 0.00 0.00 -1.33 -1.28 0.00 0.00 178.44 175.84 2c4h n MET 436 N -3.43 0.19 0.00 0.12 2.81 -1.07 -4.98 117.12 110.76 2c4h n MET 436 Ca -0.02 0.28 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 2c4h n MET 436 Cb 0.15 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.88 2c4h n MET 436 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c4h n GLY 437 N 0.67 2.96 3.51 3.03 0.00 -0.40 -3.96 105.19 110.99 2c4h n GLY 437 Ca 0.04 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 2c4h n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c4h s VAL 438 N 0.00 4.44 0.64 1.61 1.01 -1.26 -4.88 120.40 121.95 2c4h s VAL 438 Ca 0.00 -1.68 -0.18 0.00 0.00 0.00 0.00 61.98 60.11 2c4h s VAL 438 Cb 0.00 -4.98 -0.01 0.00 0.00 0.00 0.00 36.38 31.38 2c4h s VAL 438 CO 0.00 -1.77 1.30 -0.38 0.00 0.00 0.00 175.10 174.25 2c4h n ILE 439 N 5.88 4.87 -1.67 2.22 5.41 -1.25 -2.10 119.36 132.72 2c4h n ILE 439 Ca 0.35 -0.50 -0.49 0.00 1.00 0.00 0.00 62.75 63.11 2c4h n ILE 439 Cb 0.47 -1.52 -0.05 0.00 -0.71 0.00 0.00 39.64 37.84 2c4h n ILE 439 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2c4h n HIS 440 N -1.83 2.17 -0.41 1.39 -0.00 -1.24 -1.49 115.22 113.81 2c4h n HIS 440 Ca 0.15 0.24 0.00 0.00 -0.00 0.00 0.00 57.72 58.12 2c4h n HIS 440 Cb 0.48 -2.55 0.00 0.00 -0.00 0.00 0.00 29.99 27.91 2c4h n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2c4h n GLY 441 N 3.74 1.24 1.33 1.57 0.00 -1.26 -4.92 105.19 106.89 2c4h n GLY 441 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 2c4h n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2c4h n TYR 442 N -2.00 1.25 -0.01 1.61 4.02 -0.56 -3.06 117.16 118.41 2c4h n TYR 442 Ca 0.00 -0.44 0.09 0.00 -0.01 0.00 0.00 57.90 57.54 2c4h n TYR 442 Cb 0.00 -0.33 -0.16 0.00 -0.02 0.00 0.00 39.34 38.83 2c4h n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2c4h n GLU 443 N 0.44 0.64 -0.02 -0.72 0.00 -1.26 -4.49 120.64 115.23 2c4h n GLU 443 Ca 0.17 -0.18 -0.09 0.00 0.00 0.00 0.00 57.16 57.07 2c4h n GLU 443 Cb 0.81 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.72 2c4h n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2c4h h ILE 444 N 0.00 0.71 -0.51 3.84 2.04 -1.94 -1.27 117.51 120.37 2c4h h ILE 444 Ca -0.03 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.98 2c4h h ILE 444 Cb 1.03 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2c4h h ILE 444 CO 0.00 0.00 0.41 1.05 0.00 0.00 0.00 178.15 179.61 2c4h h GLU 445 N -0.08 0.00 0.15 2.37 4.11 -1.78 0.79 114.58 120.13 2c4h h GLU 445 Ca 0.10 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.23 2c4h h GLU 445 Cb 0.23 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.50 2c4h h GLU 445 CO -0.22 0.00 -1.28 0.74 0.07 0.00 0.00 179.01 178.32 2c4h h PHE 446 N 0.00 0.83 -0.36 2.06 -1.00 -1.53 -1.12 116.94 115.83 2c4h h PHE 446 Ca 0.24 -0.56 -0.08 0.00 2.81 0.00 0.00 57.97 60.39 2c4h h PHE 446 Cb 1.06 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 40.55 2c4h h PHE 446 CO 0.00 1.42 -0.11 0.28 -1.61 0.00 0.00 178.31 178.29 2c4h h VAL 447 N 0.18 1.24 -0.43 -0.55 2.07 -0.15 -2.75 116.25 115.87 2c4h h VAL 447 Ca -0.18 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2c4h h VAL 447 Cb 1.97 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 2c4h h VAL 447 CO 0.23 0.36 0.00 0.49 0.02 0.00 0.00 177.57 178.67 2c4h n PHE 448 N -4.19 0.60 -1.69 1.57 3.01 -0.10 -4.62 117.46 112.04 2c4h n PHE 448 Ca 0.01 -0.30 -0.14 0.00 1.01 0.00 0.00 57.45 58.03 2c4h n PHE 448 Cb 0.33 -0.01 -0.04 0.00 -0.01 0.00 0.00 39.48 39.75 2c4h n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c4h n GLY 449 N 1.16 0.96 0.29 1.37 0.00 -1.04 -4.29 105.19 103.64 2c4h n GLY 449 Ca 0.15 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.90 2c4h n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2c4h h LEU 450 N 0.00 0.30 -0.05 0.99 4.07 -1.48 -1.85 115.31 117.30 2c4h h LEU 450 Ca -0.31 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.64 2c4h h LEU 450 Cb 1.04 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.71 2c4h h LEU 450 CO 0.43 0.23 0.00 -2.65 -1.08 0.00 0.00 178.44 175.36 2c4h n PRO 451 N -4.49 0.01 0.00 1.13 -0.02 -1.26 -0.84 135.00 129.53 2c4h n PRO 451 Ca 0.01 0.47 0.14 0.00 -2.02 0.00 0.00 63.50 62.09 2c4h n PRO 451 Cb 0.08 -1.52 0.56 0.00 -0.02 0.00 0.00 33.50 32.60 2c4h n PRO 451 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2c4h n LEU 452 N -1.53 0.10 -4.46 2.45 4.32 -0.69 -4.48 117.00 112.71 2c4h n LEU 452 Ca 0.00 0.39 -0.44 0.00 -0.02 0.00 0.00 56.01 55.95 2c4h n LEU 452 Cb 0.03 -0.44 -0.07 0.00 -1.62 0.00 0.00 43.42 41.32 2c4h n LEU 452 CO 0.02 0.02 0.28 -0.69 -1.22 0.00 0.00 177.39 175.81 2c4h s VAL 453 N -2.98 4.93 0.21 4.08 1.01 -0.02 -4.97 120.40 122.66 2c4h s VAL 453 Ca 0.14 -0.43 -0.14 0.00 0.00 0.00 0.00 61.98 61.54 2c4h s VAL 453 Cb 0.19 -4.23 0.24 0.00 0.00 0.00 0.00 36.38 32.57 2c4h s VAL 453 CO 0.56 -0.70 1.61 0.11 0.00 0.00 0.00 175.10 176.68 2c4h h LYS 454 N 8.92 -0.03 0.00 2.72 1.79 -1.85 -1.16 116.57 126.95 2c4h h LYS 454 Ca -0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2c4h h LYS 454 Cb 1.10 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2c4h h LYS 454 CO 0.92 -0.02 0.00 -0.85 -1.08 0.00 0.00 179.45 178.42 2c4h n GLU 455 N -5.45 0.01 0.03 3.15 0.00 -1.26 -1.21 120.64 115.91 2c4h n GLU 455 Ca 0.08 0.41 0.12 0.00 0.00 0.00 0.00 57.16 57.77 2c4h n GLU 455 Cb 0.35 -1.50 0.26 0.00 0.00 0.00 0.00 31.44 30.55 2c4h n GLU 455 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2c4h n LEU 456 N -1.44 0.54 -2.87 -1.84 4.32 -0.44 -5.00 117.00 110.27 2c4h n LEU 456 Ca 0.00 0.18 -0.13 0.00 -0.02 0.00 0.00 56.01 56.04 2c4h n LEU 456 Cb 0.02 -0.25 0.07 0.00 -1.62 0.00 0.00 43.42 41.63 2c4h n LEU 456 CO 0.01 0.02 0.07 0.59 -1.22 0.00 0.00 177.39 176.86 2c4h n ASN 457 N -1.79 -2.99 -4.92 -1.43 3.02 -0.35 -4.99 115.26 101.80 2c4h n ASN 457 Ca 0.05 -0.50 -0.23 0.00 -0.03 0.00 0.00 54.58 53.87 2c4h n ASN 457 Cb 0.38 -4.10 -0.03 0.00 -0.61 0.00 0.00 39.78 35.42 2c4h n ASN 457 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2c4h s TYR 458 N -3.28 3.37 0.81 3.10 2.02 -1.26 -4.57 117.35 117.53 2c4h s TYR 458 Ca 0.10 -0.01 -0.11 0.00 -0.37 0.00 0.00 57.07 56.68 2c4h s TYR 458 Cb -0.01 -1.56 0.08 0.00 -0.40 0.00 0.00 41.96 40.07 2c4h s TYR 458 CO 0.57 0.48 1.10 0.95 -1.57 0.00 0.00 175.55 177.07 2c4h s THR 459 N -1.94 3.03 0.30 -0.71 -4.23 -1.26 -4.87 115.64 105.96 2c4h s THR 459 Ca 0.34 0.33 -0.01 0.00 -1.18 0.00 0.00 61.69 61.17 2c4h s THR 459 Cb -0.09 -3.05 0.25 0.00 1.34 0.00 0.00 72.50 70.94 2c4h s THR 459 CO 0.28 -0.44 1.96 0.00 -0.54 0.00 0.00 174.62 175.88 2c4h h ALA 460 N -1.13 1.40 -0.03 3.99 0.00 -1.98 -1.67 119.26 119.84 2c4h h ALA 460 Ca -0.47 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 2c4h h ALA 460 Cb 1.27 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2c4h h ALA 460 CO 0.59 0.53 -0.49 0.93 0.00 0.00 0.00 179.25 180.80 2c4h h GLU 461 N 1.04 0.08 0.00 0.00 5.08 -1.98 -1.96 114.58 116.83 2c4h h GLU 461 Ca 0.27 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.50 2c4h h GLU 461 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2c4h h GLU 461 CO -0.05 0.56 -0.41 0.93 -1.00 0.00 0.00 179.01 179.03 2c4h h GLU 462 N 0.06 0.00 -0.27 2.33 5.08 -1.69 -1.43 114.58 118.66 2c4h h GLU 462 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2c4h h GLU 462 Cb 0.90 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 2c4h h GLU 462 CO 0.07 0.41 -0.54 1.49 -1.00 0.00 0.00 179.01 179.44 2c4h h GLU 463 N 0.00 0.81 -0.42 2.33 4.81 -0.74 -1.49 114.58 119.87 2c4h h GLU 463 Ca -0.00 -0.51 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 2c4h h GLU 463 Cb 0.86 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 2c4h h GLU 463 CO 0.05 1.14 -0.02 0.00 -0.73 0.00 0.00 179.01 179.45 2c4h h ALA 464 N 0.76 1.17 -0.25 2.92 0.00 -0.91 -1.60 119.26 121.35 2c4h h ALA 464 Ca 0.02 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2c4h h ALA 464 Cb 1.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2c4h h ALA 464 CO 0.12 0.54 -0.07 1.25 0.00 0.00 0.00 179.25 181.09 2c4h h LEU 465 N 0.65 0.49 -0.18 0.00 5.85 -1.07 -1.34 115.31 119.71 2c4h h LEU 465 Ca 0.13 -0.37 0.02 0.00 0.84 0.00 0.00 57.88 58.50 2c4h h LEU 465 Cb 0.44 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2c4h h LEU 465 CO 0.02 0.74 0.06 -1.28 -0.34 0.00 0.00 178.44 177.65 2c4h h SER 466 N 0.22 0.07 -0.98 1.25 0.87 -1.06 0.20 113.55 114.12 2c4h h SER 466 Ca 0.06 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2c4h h SER 466 Cb 0.53 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.46 2c4h h SER 466 CO 0.03 0.07 0.63 0.03 -0.53 0.00 0.00 176.83 177.05 2c4h h ARG 467 N 0.15 1.31 -0.51 2.24 3.08 -1.24 0.17 114.38 119.57 2c4h h ARG 467 Ca 0.08 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 2c4h h ARG 467 Cb 0.05 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2c4h h ARG 467 CO -0.08 0.89 -0.11 -0.09 -1.07 0.00 0.00 179.97 179.50 2c4h h ARG 468 N 1.34 0.98 -0.09 0.04 2.43 -0.65 -1.53 114.38 116.91 2c4h h ARG 468 Ca 0.36 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2c4h h ARG 468 Cb -0.12 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2c4h h ARG 468 CO -0.07 1.05 -0.02 0.82 -1.51 0.00 0.00 179.97 180.23 2c4h h ILE 469 N 0.85 1.29 -0.71 1.20 2.04 -0.13 -1.74 117.51 120.31 2c4h h ILE 469 Ca 0.13 -0.94 0.05 0.00 1.00 0.00 0.00 64.86 65.11 2c4h h ILE 469 Cb 0.68 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 2c4h h ILE 469 CO 0.05 0.26 0.47 0.24 0.00 0.00 0.00 178.15 179.17 2c4h h MET 470 N -0.16 0.76 -0.13 2.37 2.86 -0.64 -0.27 114.93 119.72 2c4h h MET 470 Ca 0.02 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.42 2c4h h MET 470 Cb 0.42 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2c4h h MET 470 CO 0.01 0.50 -0.71 1.25 1.06 0.00 0.00 176.91 179.02 2c4h h HIS 471 N 0.78 0.76 0.16 -0.22 -0.00 -1.19 -0.98 115.15 114.47 2c4h h HIS 471 Ca 0.30 -0.32 -0.01 0.00 -0.00 0.00 0.00 60.37 60.34 2c4h h HIS 471 Cb 0.19 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.47 2c4h h HIS 471 CO -0.00 1.10 -0.08 1.88 -0.00 0.00 0.00 177.93 180.83 2c4h h TYR 472 N 0.40 -0.21 0.28 5.26 0.05 -0.37 0.90 116.97 123.28 2c4h h TYR 472 Ca -0.03 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 2c4h h TYR 472 Cb 1.30 0.07 -0.02 0.00 1.01 0.00 0.00 36.73 39.09 2c4h h TYR 472 CO 0.06 -0.04 -0.29 -1.49 -1.05 0.00 0.00 178.16 175.34 2c4h h TRP 473 N -0.32 -0.78 -0.71 4.88 -0.00 -1.08 -0.06 115.95 117.89 2c4h h TRP 473 Ca -0.02 0.01 -0.06 0.00 -0.00 0.00 0.00 58.89 58.81 2c4h h TRP 473 Cb 0.25 0.31 -0.03 0.00 -0.00 0.00 0.00 29.16 29.69 2c4h h TRP 473 CO -0.04 -0.42 0.19 0.00 -0.00 0.00 0.00 178.44 178.17 2c4h h ALA 474 N -0.02 0.99 -0.20 1.49 0.00 -1.18 0.81 119.26 121.16 2c4h h ALA 474 Ca -0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2c4h h ALA 474 Cb 0.56 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2c4h h ALA 474 CO -0.07 0.66 -0.24 1.15 0.00 0.00 0.00 179.25 180.75 2c4h h THR 475 N 1.06 1.25 -0.18 0.00 2.02 -0.70 -0.92 112.91 115.44 2c4h h THR 475 Ca 0.22 -1.17 -0.10 0.00 0.77 0.00 0.00 66.41 66.14 2c4h h THR 475 Cb 0.35 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 2c4h h THR 475 CO -0.00 0.36 -0.28 0.15 0.37 0.00 0.00 175.52 176.12 2c4h h PHE 476 N 0.33 0.63 -0.75 3.16 3.57 -0.49 -0.97 116.94 122.41 2c4h h PHE 476 Ca 0.05 -0.21 0.04 0.00 3.53 0.00 0.00 57.97 61.37 2c4h h PHE 476 Cb 0.60 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2c4h h PHE 476 CO 0.01 0.92 0.50 0.00 -2.23 0.00 0.00 178.31 177.51 2c4h h ALA 477 N 0.60 1.56 0.16 2.41 0.00 -0.53 0.89 119.26 124.35 2c4h h ALA 477 Ca 0.02 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 2c4h h ALA 477 Cb 0.86 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 18.42 2c4h h ALA 477 CO 0.06 0.36 -1.30 -0.22 0.00 0.00 0.00 179.25 178.15 2c4h h LYS 478 N 0.91 0.50 0.00 0.00 3.64 -1.09 -3.41 116.57 117.11 2c4h h LYS 478 Ca 0.30 -0.75 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2c4h h LYS 478 Cb 0.07 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2c4h h LYS 478 CO -0.09 1.34 -0.03 0.25 -2.27 0.00 0.00 179.45 178.65 2c4h n THR 479 N -3.70 0.00 -0.80 1.00 -2.24 -0.38 -5.00 114.28 103.16 2c4h n THR 479 Ca -0.13 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2c4h n THR 479 Cb 1.02 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 70.23 2c4h n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c4h n GLY 480 N 0.94 0.55 3.22 3.38 0.00 0.31 -5.02 105.19 108.57 2c4h n GLY 480 Ca 0.00 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 2c4h n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2c4h s ASN 481 N -2.44 -0.24 0.47 1.61 3.04 -1.24 -4.93 114.94 111.21 2c4h s ASN 481 Ca 0.00 0.89 0.31 0.00 0.04 0.00 0.00 52.86 54.10 2c4h s ASN 481 Cb 0.00 1.05 1.32 0.00 -1.54 0.00 0.00 41.25 42.09 2c4h s ASN 481 CO 0.00 -0.22 1.92 1.55 -3.04 0.00 0.00 177.10 177.31 2c4h h PRO 482 N 7.86 0.00 -6.42 0.43 0.13 -1.80 -3.18 132.00 129.02 2c4h h PRO 482 Ca -0.22 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.37 2c4h h PRO 482 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 2c4h h PRO 482 CO 0.18 0.00 0.28 -0.80 -0.23 0.00 0.00 178.00 177.43 2c4h s ASN 483 N -5.18 7.35 -0.01 1.44 0.01 -1.26 -4.46 114.94 112.82 2c4h s ASN 483 Ca 0.02 1.62 -0.30 0.00 -0.71 0.00 0.00 52.86 53.48 2c4h s ASN 483 Cb 0.09 -2.53 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 2c4h s ASN 483 CO 0.48 -0.07 1.32 -0.70 -1.51 0.00 0.00 177.10 176.62 2c4h s GLU 484 N 0.20 4.31 0.23 -0.60 2.56 -1.26 -4.94 118.70 119.19 2c4h s GLU 484 Ca 0.44 1.86 -0.32 0.00 0.00 0.00 0.00 54.97 56.95 2c4h s GLU 484 Cb -0.22 -3.55 -0.12 0.00 2.00 0.00 0.00 34.13 32.25 2c4h s GLU 484 CO 0.26 -0.51 1.68 -0.35 -0.56 0.00 0.00 175.26 175.79 2c4h n PRO 485 N 5.21 2.72 -3.63 4.30 -0.04 -1.26 -2.93 135.00 139.37 2c4h n PRO 485 Ca 0.12 0.98 -0.24 0.00 -0.04 0.00 0.00 63.50 64.32 2c4h n PRO 485 Cb 0.45 -2.80 0.04 0.00 -0.04 0.00 0.00 33.50 31.14 2c4h n PRO 485 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2c4h n HIS 486 N 3.50 -1.99 -4.36 0.54 8.25 -1.26 -5.01 115.22 114.88 2c4h n HIS 486 Ca 0.14 0.70 -0.24 0.00 -0.26 0.00 0.00 57.72 58.06 2c4h n HIS 486 Cb 0.35 -3.97 -0.08 0.00 1.12 0.00 0.00 29.99 27.40 2c4h n HIS 486 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2c4h s SER 487 N -3.87 4.14 0.00 0.41 0.15 -1.15 -5.03 113.70 108.35 2c4h s SER 487 Ca 0.25 -0.87 0.19 0.00 0.70 0.00 0.00 55.95 56.22 2c4h s SER 487 Cb -0.07 -0.58 0.61 0.00 -1.71 0.00 0.00 66.02 64.26 2c4h s SER 487 CO 0.82 -0.05 1.46 0.00 1.20 0.00 0.00 173.24 176.67 2c4h n GLN 488 N -0.82 1.86 -1.70 5.44 3.00 -1.26 -4.94 117.38 118.96 2c4h n GLN 488 Ca -0.05 -1.31 -0.30 0.00 -0.01 0.00 0.00 57.00 55.33 2c4h n GLN 488 Cb 0.60 -1.38 0.06 0.00 0.00 0.00 0.00 30.24 29.52 2c4h n GLN 488 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2c4h s GLU 489 N -1.67 2.57 0.30 -1.09 0.41 -1.26 -5.01 118.70 112.95 2c4h s GLU 489 Ca 0.31 0.62 -0.29 0.00 -0.41 0.00 0.00 54.97 55.20 2c4h s GLU 489 Cb 0.17 -1.98 -0.10 0.00 -1.78 0.00 0.00 34.13 30.44 2c4h s GLU 489 CO 0.25 -1.27 1.28 -1.12 -0.49 0.00 0.00 175.26 173.91 2c4h s SER 490 N -4.08 6.86 -0.08 -0.19 0.01 -1.26 -4.98 113.70 109.98 2c4h s SER 490 Ca 0.59 2.58 -0.21 0.00 1.31 0.00 0.00 55.95 60.22 2c4h s SER 490 Cb -0.13 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.42 2c4h s SER 490 CO 0.53 -0.48 0.60 -0.54 0.41 0.00 0.00 173.24 173.76 2c4h s LYS 491 N -1.38 4.39 -0.58 12.44 -0.14 -1.26 -5.02 119.74 128.20 2c4h s LYS 491 Ca 0.50 0.69 -0.25 0.00 -1.36 0.00 0.00 55.97 55.55 2c4h s LYS 491 Cb -0.38 -3.43 0.04 0.00 -1.68 0.00 0.00 37.83 32.37 2c4h s LYS 491 CO 0.48 0.13 1.03 -0.46 -0.76 0.00 0.00 175.35 175.77 2c4h s TRP 492 N 0.64 2.71 0.57 3.18 -0.11 -1.26 -5.01 118.94 119.65 2c4h s TRP 492 Ca 0.32 0.08 -0.19 0.00 1.22 0.00 0.00 56.10 57.53 2c4h s TRP 492 Cb -0.17 -4.24 -0.05 0.00 -1.50 0.00 0.00 33.47 27.52 2c4h s TRP 492 CO 0.15 -1.47 1.16 -1.25 -4.62 0.00 0.00 176.95 170.91 2c4h s PRO 493 N 4.34 3.17 0.57 5.86 0.04 -1.26 -4.87 135.00 142.85 2c4h s PRO 493 Ca 0.34 1.68 -0.19 0.00 0.04 0.00 0.00 61.00 62.86 2c4h s PRO 493 Cb -0.11 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 2c4h s PRO 493 CO 0.20 -1.01 1.17 -0.51 0.04 0.00 0.00 177.00 176.89 2c4h s LEU 494 N -3.97 3.71 -0.23 -3.56 1.43 -1.26 -4.72 118.68 110.08 2c4h s LEU 494 Ca 0.74 2.29 -0.18 0.00 -1.03 0.00 0.00 54.13 55.95 2c4h s LEU 494 Cb -0.26 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.35 2c4h s LEU 494 CO 0.30 -1.40 0.53 0.12 0.23 0.00 0.00 176.35 176.13 2c4h s PHE 495 N -1.67 3.32 0.24 0.29 2.19 0.19 -4.45 117.98 118.08 2c4h s PHE 495 Ca 0.75 0.73 0.11 0.00 0.33 0.00 0.00 56.93 58.85 2c4h s PHE 495 Cb -0.27 -2.71 -0.05 0.00 -1.31 0.00 0.00 43.02 38.68 2c4h s PHE 495 CO 0.30 -0.19 -0.17 0.95 1.83 0.00 0.00 175.22 177.94 2c4h s THR 496 N 1.99 2.70 0.29 0.12 -4.23 -1.26 -4.37 115.64 110.88 2c4h s THR 496 Ca 0.23 -2.11 -0.02 0.00 -1.18 0.00 0.00 61.69 58.61 2c4h s THR 496 Cb -0.15 -2.38 0.27 0.00 1.34 0.00 0.00 72.50 71.57 2c4h s THR 496 CO 0.09 -0.27 1.95 0.74 -0.54 0.00 0.00 174.62 176.58 2c4h h THR 497 N 2.54 1.18 0.32 3.99 2.02 -1.95 0.38 112.91 121.39 2c4h h THR 497 Ca -0.43 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 2c4h h THR 497 Cb 1.24 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2c4h h THR 497 CO 0.56 0.21 -0.16 0.50 0.37 0.00 0.00 175.52 177.00 2c4h h LYS 498 N 1.14 -0.42 0.00 6.66 3.64 -2.02 -3.38 116.57 122.19 2c4h h LYS 498 Ca 0.34 0.03 -0.23 0.00 -1.27 0.00 0.00 60.65 59.52 2c4h h LYS 498 Cb -0.04 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 2c4h h LYS 498 CO -0.09 -0.09 -1.68 0.39 -2.27 0.00 0.00 179.45 175.71 2c4h n GLU 499 N -5.11 0.64 -3.89 1.90 -0.58 -1.21 -5.01 120.64 107.38 2c4h n GLU 499 Ca -0.09 0.20 -0.24 0.00 -0.42 0.00 0.00 57.16 56.60 2c4h n GLU 499 Cb 0.27 -1.75 -0.01 0.00 -0.57 0.00 0.00 31.44 29.38 2c4h n GLU 499 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2c4h n GLN 500 N -2.89 -3.66 -2.91 3.49 6.02 0.13 -4.41 117.38 113.14 2c4h n GLN 500 Ca -0.15 0.45 -0.32 0.00 -0.01 0.00 0.00 57.00 56.97 2c4h n GLN 500 Cb 0.94 -4.68 -0.06 0.00 1.02 0.00 0.00 30.24 27.47 2c4h n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2c4h s LYS 501 N -6.42 4.07 0.22 -1.09 1.02 -1.26 -1.61 119.74 114.67 2c4h s LYS 501 Ca 0.00 0.86 -0.14 0.00 0.02 0.00 0.00 55.97 56.71 2c4h s LYS 501 Cb -0.00 -2.30 0.00 0.00 -0.52 0.00 0.00 37.83 35.02 2c4h s LYS 501 CO 0.87 0.02 0.46 -0.59 -0.92 0.00 0.00 175.35 175.19 2c4h s PHE 502 N -2.16 0.23 0.17 3.18 -0.71 -0.18 -4.23 117.98 114.27 2c4h s PHE 502 Ca 0.57 -0.59 0.09 0.00 -1.04 0.00 0.00 56.93 55.96 2c4h s PHE 502 Cb -0.10 0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 41.88 2c4h s PHE 502 CO 0.18 -0.93 -0.18 0.96 -1.34 0.00 0.00 175.22 173.91 2c4h s ILE 503 N -3.97 1.83 0.24 -4.49 -4.36 -0.97 -0.84 121.20 108.64 2c4h s ILE 503 Ca 0.18 -1.94 -0.12 0.00 -0.26 0.00 0.00 60.65 58.51 2c4h s ILE 503 Cb -0.00 -1.86 -0.08 0.00 1.25 0.00 0.00 42.46 41.77 2c4h s ILE 503 CO 0.04 -0.33 0.60 -1.81 0.24 0.00 0.00 174.94 173.68 2c4h s ASP 504 N -2.70 6.70 -0.33 4.36 1.01 -1.20 -0.98 116.67 123.54 2c4h s ASP 504 Ca 0.16 1.04 0.01 0.00 0.71 0.00 0.00 52.55 54.47 2c4h s ASP 504 Cb -0.06 -2.27 0.08 0.00 1.01 0.00 0.00 42.92 41.68 2c4h s ASP 504 CO 0.07 -0.08 0.03 -0.76 0.21 0.00 0.00 175.17 174.64 2c4h s LEU 505 N -2.71 4.37 0.00 1.23 1.43 0.07 -4.63 118.68 118.44 2c4h s LEU 505 Ca 0.47 -1.77 -0.06 0.00 -1.03 0.00 0.00 54.13 51.74 2c4h s LEU 505 Cb -0.12 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.46 2c4h s LEU 505 CO 0.20 -0.34 0.39 -0.46 0.23 0.00 0.00 176.35 176.37 2c4h n ASN 506 N 4.44 -1.14 0.00 2.29 2.04 -1.26 -2.86 115.26 118.77 2c4h n ASN 506 Ca -0.05 -1.94 0.11 0.00 -0.44 0.00 0.00 54.58 52.26 2c4h n ASN 506 Cb 0.42 1.94 0.51 0.00 -2.53 0.00 0.00 39.78 40.12 2c4h n ASN 506 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 2c4h n THR 507 N -0.31 0.41 -2.21 5.53 -2.24 -1.26 -4.82 114.28 109.37 2c4h n THR 507 Ca -0.03 0.10 -0.26 0.00 -2.27 0.00 0.00 64.05 61.59 2c4h n THR 507 Cb 0.33 -0.72 0.07 0.00 -2.10 0.00 0.00 70.33 67.90 2c4h n THR 507 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2c4h s GLU 508 N -2.83 2.23 0.21 -0.78 2.02 -1.26 -5.01 118.70 113.28 2c4h s GLU 508 Ca 0.15 -0.25 -0.31 0.00 0.02 0.00 0.00 54.97 54.58 2c4h s GLU 508 Cb 0.15 -2.18 -0.10 0.00 0.10 0.00 0.00 34.13 32.10 2c4h s GLU 508 CO 0.38 -1.21 1.56 -2.14 0.02 0.00 0.00 175.26 173.87 2c4h s PRO 509 N -5.23 4.20 -0.00 0.39 0.02 -1.26 -4.87 135.00 128.25 2c4h s PRO 509 Ca 0.60 2.41 -0.37 0.00 0.02 0.00 0.00 61.00 63.66 2c4h s PRO 509 Cb -0.11 -3.11 -0.16 0.00 0.02 0.00 0.00 34.50 31.14 2c4h s PRO 509 CO 0.45 -0.58 1.52 -0.12 -0.33 0.00 0.00 177.00 177.93 2c4h n MET 510 N 3.33 1.39 -4.65 5.54 1.56 -1.26 -4.98 117.12 118.04 2c4h n MET 510 Ca 0.12 0.50 -0.26 0.00 -0.27 0.00 0.00 57.70 57.79 2c4h n MET 510 Cb 0.38 -2.19 -0.14 0.00 2.15 0.00 0.00 33.22 33.42 2c4h n MET 510 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2c4h s LYS 511 N 1.56 1.41 -0.09 2.12 1.02 -1.26 -5.06 119.74 119.44 2c4h s LYS 511 Ca 0.88 -0.95 -0.09 0.00 0.02 0.00 0.00 55.97 55.82 2c4h s LYS 511 Cb -0.92 -1.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 2c4h s LYS 511 CO 0.50 0.39 0.22 0.08 -0.92 0.00 0.00 175.35 175.62 2c4h s VAL 512 N -0.81 5.37 0.30 3.17 1.01 -1.26 -3.21 120.40 124.96 2c4h s VAL 512 Ca 0.08 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.47 2c4h s VAL 512 Cb -0.09 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 2c4h s VAL 512 CO 0.02 0.60 0.12 -1.00 0.00 0.00 0.00 175.10 174.84 2c4h s HIS 513 N -1.02 1.64 0.09 5.22 3.76 -0.02 -4.99 115.29 119.97 2c4h s HIS 513 Ca 0.17 -1.23 0.03 0.00 -0.15 0.00 0.00 55.06 53.88 2c4h s HIS 513 Cb -0.13 -0.96 -0.04 0.00 1.11 0.00 0.00 32.58 32.56 2c4h s HIS 513 CO 0.07 -0.35 -0.09 -0.65 -0.85 0.00 0.00 174.74 172.87 2c4h s GLN 514 N -3.91 0.78 -0.89 1.40 -0.21 -1.26 -1.01 119.66 114.56 2c4h s GLN 514 Ca 0.35 -1.13 -0.06 0.00 0.02 0.00 0.00 55.36 54.55 2c4h s GLN 514 Cb 0.06 -0.40 -0.00 0.00 1.00 0.00 0.00 33.01 33.67 2c4h s GLN 514 CO 0.15 0.05 0.69 0.54 -2.12 0.00 0.00 175.29 174.60 2c4h n ARG 515 N 0.58 -1.37 -1.67 2.91 1.74 -0.64 -4.84 116.66 113.38 2c4h n ARG 515 Ca -0.16 0.92 -0.45 0.00 -0.77 0.00 0.00 57.85 57.39 2c4h n ARG 515 Cb 0.58 -3.98 -0.04 0.00 -1.02 0.00 0.00 32.46 28.01 2c4h n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2c4h n LEU 516 N -2.78 3.83 -2.36 0.55 7.94 -1.26 -2.44 117.00 120.47 2c4h n LEU 516 Ca -0.15 0.94 -0.13 0.00 -1.11 0.00 0.00 56.01 55.56 2c4h n LEU 516 Cb 0.60 -1.45 -0.01 0.00 0.53 0.00 0.00 43.42 43.09 2c4h n LEU 516 CO 0.61 0.08 -0.17 -1.14 -1.11 0.00 0.00 177.39 175.66 2c4h n ARG 517 N 7.04 -2.10 -0.27 1.96 3.00 -1.26 -4.86 116.66 120.16 2c4h n ARG 517 Ca 0.21 0.66 0.03 0.00 -0.00 0.00 0.00 57.85 58.75 2c4h n ARG 517 Cb 0.35 -5.24 0.25 0.00 0.00 0.00 0.00 32.46 27.82 2c4h n ARG 517 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 2c4h h VAL 518 N 0.00 1.11 0.27 5.15 3.04 -1.85 -0.40 116.25 123.58 2c4h h VAL 518 Ca -0.31 -0.35 -0.01 0.00 -1.01 0.00 0.00 66.70 65.01 2c4h h VAL 518 Cb 1.21 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2c4h h VAL 518 CO 0.38 0.19 -0.13 -0.61 -1.01 0.00 0.00 177.57 176.38 2c4h h GLN 519 N 1.02 -0.35 -0.15 4.17 5.75 -1.89 -1.87 115.11 121.79 2c4h h GLN 519 Ca 0.34 0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.74 2c4h h GLN 519 Cb 0.08 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2c4h h GLN 519 CO -0.11 -0.17 -0.44 0.52 -2.65 0.00 0.00 178.83 175.98 2c4h h MET 520 N -0.45 0.35 0.00 1.69 2.86 -1.93 -3.11 114.93 114.34 2c4h h MET 520 Ca -0.04 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.38 2c4h h MET 520 Cb 0.34 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2c4h h MET 520 CO 0.06 0.73 -0.17 0.00 1.06 0.00 0.00 176.91 178.60 2c4h h VAL 522 N 0.00 1.29 0.20 0.00 2.07 -1.27 0.27 116.25 118.82 2c4h h VAL 522 Ca -0.00 -1.50 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 2c4h h VAL 522 Cb 0.80 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 2c4h h VAL 522 CO 0.02 0.47 -0.09 0.15 0.02 0.00 0.00 177.57 178.14 2c4h h PHE 523 N 0.43 -0.24 -0.41 1.57 3.57 -1.41 -0.64 116.94 119.82 2c4h h PHE 523 Ca 0.04 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.39 2c4h h PHE 523 Cb 0.84 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2c4h h PHE 523 CO 0.03 0.05 -0.31 -1.49 -2.23 0.00 0.00 178.31 174.36 2c4h h TRP 524 N -0.53 1.09 0.00 0.41 4.06 -1.22 0.13 115.95 119.89 2c4h h TRP 524 Ca -0.03 -0.30 -0.17 0.00 2.06 0.00 0.00 58.89 60.45 2c4h h TRP 524 Cb 0.40 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 28.29 2c4h h TRP 524 CO 0.01 1.12 -1.28 -0.91 -3.56 0.00 0.00 178.44 173.82 2c4h h ASN 525 N 0.75 0.00 0.00 -3.49 -0.26 -0.53 -3.39 115.58 108.65 2c4h h ASN 525 Ca 0.08 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.77 2c4h h ASN 525 Cb 0.89 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.15 2c4h h ASN 525 CO 0.08 0.61 -0.68 0.00 -1.06 0.00 0.00 177.43 176.38 2c4h n GLN 526 N -2.96 0.15 0.24 0.81 6.02 -0.33 -4.79 117.38 116.51 2c4h n GLN 526 Ca -0.08 0.06 -0.12 0.00 -0.01 0.00 0.00 57.00 56.85 2c4h n GLN 526 Cb 0.84 -0.76 -0.06 0.00 1.02 0.00 0.00 30.24 31.28 2c4h n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2c4h h PHE 527 N -0.27 -0.62 -0.78 1.08 3.57 -1.20 -3.20 116.94 115.52 2c4h h PHE 527 Ca -0.07 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.54 2c4h h PHE 527 Cb 0.59 0.20 -0.09 0.00 2.79 0.00 0.00 35.95 39.45 2c4h h PHE 527 CO -0.08 -0.33 0.37 1.25 -2.23 0.00 0.00 178.31 177.29 2c4h h LEU 528 N -1.11 0.44 -0.97 0.59 5.85 -0.98 -0.68 115.31 118.44 2c4h h LEU 528 Ca -0.07 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2c4h h LEU 528 Cb 0.56 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 2c4h h LEU 528 CO 0.11 0.21 0.52 -0.65 -0.34 0.00 0.00 178.44 178.29 2c4h h PRO 529 N 0.57 1.24 -0.45 5.25 0.11 -1.76 -0.13 132.00 136.82 2c4h h PRO 529 Ca 0.41 -0.13 -0.04 0.00 0.11 0.00 0.00 66.00 66.35 2c4h h PRO 529 Cb 0.54 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 2c4h h PRO 529 CO -0.34 0.88 0.12 0.87 -0.21 0.00 0.00 178.00 179.32 2c4h h LYS 530 N 1.25 0.72 0.15 1.05 1.57 -1.29 -1.85 116.57 118.16 2c4h h LYS 530 Ca 0.32 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2c4h h LYS 530 Cb -0.02 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.20 2c4h h LYS 530 CO -0.06 0.71 -0.07 1.25 -0.57 0.00 0.00 179.45 180.71 2c4h h LEU 531 N 0.60 -0.17 -1.94 2.94 6.46 -0.65 0.44 115.31 123.00 2c4h h LEU 531 Ca 0.14 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 2c4h h LEU 531 Cb 0.31 0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2c4h h LEU 531 CO 0.00 -0.12 -0.11 -0.07 -0.62 0.00 0.00 178.44 177.52 2c4h h LEU 532 N -0.20 0.00 0.07 2.25 3.38 -0.99 -1.16 115.31 118.67 2c4h h LEU 532 Ca -0.02 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.76 2c4h h LEU 532 Cb 0.15 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.92 2c4h h LEU 532 CO 0.03 0.11 -0.80 -1.13 0.09 0.00 0.00 178.44 176.74 2c4h h ASN 533 N 0.00 0.57 0.72 -0.43 -0.73 -0.87 -2.79 115.58 112.06 2c4h h ASN 533 Ca -0.00 -0.84 -0.05 0.00 1.87 0.00 0.00 56.30 57.28 2c4h h ASN 533 Cb 0.23 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.63 2c4h h ASN 533 CO 0.01 1.36 -0.23 0.00 -0.37 0.00 0.00 177.43 178.20 2c4h h ALA 534 N 0.23 1.10 -0.47 1.57 0.00 -0.57 -3.02 119.26 118.10 2c4h h ALA 534 Ca -0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2c4h h ALA 534 Cb 1.55 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2c4h h ALA 534 CO 0.15 0.29 0.00 0.25 0.00 0.00 0.00 179.25 179.94 2c4h n THR 535 N -3.51 1.78 0.00 0.00 -2.24 -0.47 -5.09 114.28 104.75 2c4h n THR 535 Ca -0.01 -1.34 0.00 0.00 -2.27 0.00 0.00 64.05 60.43 2c4h n THR 535 Cb 0.39 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 2c4h n THR 535 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50