#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c44 s HIS 6 N 0.00 3.20 0.62 5.64 5.04 -1.26 -4.85 115.29 123.68 2c44 s HIS 6 Ca 0.00 0.68 -0.17 0.00 -1.54 0.00 0.00 55.06 54.03 2c44 s HIS 6 Cb 0.00 -3.12 -0.02 0.00 0.04 0.00 0.00 32.58 29.48 2c44 s HIS 6 CO 0.00 -0.53 1.14 -0.51 -2.34 0.00 0.00 174.74 172.50 2c44 s LEU 7 N 2.79 3.53 0.35 8.88 1.43 -1.26 -4.99 118.68 129.41 2c44 s LEU 7 Ca 0.29 2.15 -0.26 0.00 -1.03 0.00 0.00 54.13 55.28 2c44 s LEU 7 Cb -0.14 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.41 2c44 s LEU 7 CO 0.12 -1.59 1.04 -2.16 0.23 0.00 0.00 176.35 174.00 2c44 s PRO 8 N -3.72 4.38 0.05 1.29 0.04 -1.26 -4.94 135.00 130.84 2c44 s PRO 8 Ca 0.71 1.55 -0.33 0.00 0.04 0.00 0.00 61.00 62.97 2c44 s PRO 8 Cb -0.24 -2.77 -0.12 0.00 0.04 0.00 0.00 34.50 31.41 2c44 s PRO 8 CO 0.36 0.04 1.79 0.39 0.04 0.00 0.00 177.00 179.62 2c44 n GLU 9 N 0.41 2.39 -0.73 4.56 4.71 -1.26 -4.84 120.64 125.88 2c44 n GLU 9 Ca 0.03 0.87 -0.08 0.00 -0.01 0.00 0.00 57.16 57.97 2c44 n GLU 9 Cb 0.48 -2.71 -0.02 0.00 -1.01 0.00 0.00 31.44 28.18 2c44 n GLU 9 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2c44 n PRO 10 N 5.45 1.44 -3.58 3.49 -0.04 -1.26 -4.79 135.00 135.71 2c44 n PRO 10 Ca 0.19 -0.70 -0.07 0.00 -0.04 0.00 0.00 63.50 62.89 2c44 n PRO 10 Cb 0.32 -1.37 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 2c44 n PRO 10 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2c44 s PHE 11 N -0.46 -0.29 -0.08 0.54 -0.12 -1.26 -4.98 117.98 111.33 2c44 s PHE 11 Ca 0.21 0.09 -0.01 0.00 -0.05 0.00 0.00 56.93 57.17 2c44 s PHE 11 Cb 0.13 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 43.06 2c44 s PHE 11 CO -0.01 -0.65 -0.00 1.03 -0.05 0.00 0.00 175.22 175.54 2c44 s ARG 12 N -3.20 2.95 0.02 1.99 0.52 -1.26 -5.08 118.95 114.89 2c44 s ARG 12 Ca 0.07 -0.43 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 2c44 s ARG 12 Cb -0.01 -2.77 -0.05 0.00 0.52 0.00 0.00 34.95 32.64 2c44 s ARG 12 CO -0.06 0.70 1.26 0.42 0.02 0.00 0.00 175.30 177.63 2c44 s ILE 13 N -0.89 3.99 -0.13 1.52 1.01 -1.26 -4.93 121.20 120.50 2c44 s ILE 13 Ca 0.14 1.38 0.04 0.00 0.00 0.00 0.00 60.65 62.21 2c44 s ILE 13 Cb -0.11 -3.89 -0.11 0.00 0.01 0.00 0.00 42.46 38.36 2c44 s ILE 13 CO 0.03 0.05 -0.07 0.54 0.00 0.00 0.00 174.94 175.49 2c44 n ARG 14 N 4.64 0.98 -4.11 2.79 3.00 -1.26 -5.02 116.66 117.67 2c44 n ARG 14 Ca 0.11 0.05 -0.17 0.00 -0.01 0.00 0.00 57.85 57.83 2c44 n ARG 14 Cb 0.45 -1.28 -0.15 0.00 0.00 0.00 0.00 32.46 31.48 2c44 n ARG 14 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2c44 s VAL 15 N -2.28 0.38 0.15 1.55 1.01 -1.26 -5.16 120.40 114.80 2c44 s VAL 15 Ca -0.14 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.79 2c44 s VAL 15 Cb 0.04 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2c44 s VAL 15 CO 0.37 0.15 -0.18 0.27 0.00 0.00 0.00 175.10 175.71 2c44 s ILE 16 N 0.40 1.73 -0.23 2.22 -4.36 -1.26 -5.12 121.20 114.57 2c44 s ILE 16 Ca -0.04 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 58.50 2c44 s ILE 16 Cb -0.08 -1.78 0.05 0.00 1.25 0.00 0.00 42.46 41.90 2c44 s ILE 16 CO -0.00 -0.32 -0.13 -0.70 0.24 0.00 0.00 174.94 174.03 2c44 s GLU 17 N -2.74 2.34 0.55 0.37 2.12 -1.26 -5.12 118.70 114.96 2c44 s GLU 17 Ca 0.14 -1.15 -0.22 0.00 0.36 0.00 0.00 54.97 54.11 2c44 s GLU 17 Cb -0.06 -2.74 -0.05 0.00 0.26 0.00 0.00 34.13 31.55 2c44 s GLU 17 CO 0.06 -0.47 1.36 -2.14 -0.54 0.00 0.00 175.26 173.53 2c44 s PRO 18 N 1.20 3.14 0.12 4.30 0.02 -1.26 -5.04 135.00 137.49 2c44 s PRO 18 Ca -0.05 2.24 0.05 0.00 0.02 0.00 0.00 61.00 63.27 2c44 s PRO 18 Cb -0.18 -2.26 -0.04 0.00 0.02 0.00 0.00 34.50 32.04 2c44 s PRO 18 CO -0.07 -1.19 -0.12 0.14 -0.33 0.00 0.00 177.00 175.42 2c44 s VAL 19 N -1.30 1.23 0.23 3.83 -7.23 -1.26 -5.16 120.40 110.74 2c44 s VAL 19 Ca 0.71 -1.78 0.07 0.00 -1.81 0.00 0.00 61.98 59.17 2c44 s VAL 19 Cb -0.41 -1.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 2c44 s VAL 19 CO 0.48 -0.51 0.15 -0.75 -0.31 0.00 0.00 175.10 174.15 2c44 s LYS 20 N -2.93 2.81 0.39 4.82 2.20 -1.26 -5.12 119.74 120.65 2c44 s LYS 20 Ca 0.10 -1.06 0.08 0.00 -0.36 0.00 0.00 55.97 54.72 2c44 s LYS 20 Cb -0.03 -2.52 -0.03 0.00 -1.51 0.00 0.00 37.83 33.74 2c44 s LYS 20 CO 0.02 0.42 0.30 1.03 -0.36 0.00 0.00 175.35 176.76 2c44 s ARG 21 N -3.61 2.52 0.25 4.03 1.81 -1.26 -4.32 118.95 118.37 2c44 s ARG 21 Ca 0.32 -1.52 -0.01 0.00 -1.72 0.00 0.00 55.73 52.80 2c44 s ARG 21 Cb -0.08 -2.32 -0.03 0.00 -0.45 0.00 0.00 34.95 32.06 2c44 s ARG 21 CO 0.24 -0.07 0.24 0.95 -0.68 0.00 0.00 175.30 175.97 2c44 s THR 22 N -2.44 0.00 0.19 0.02 -4.23 -1.26 -5.07 115.64 102.85 2c44 s THR 22 Ca 0.44 -1.89 0.03 0.00 -1.18 0.00 0.00 61.69 59.09 2c44 s THR 22 Cb -0.03 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 2c44 s THR 22 CO 0.26 0.00 0.33 0.42 -0.54 0.00 0.00 174.62 175.09 2c44 s THR 23 N -3.88 5.28 0.18 3.99 -4.23 -1.26 -5.00 115.64 110.72 2c44 s THR 23 Ca 0.37 -0.75 -0.13 0.00 -1.18 0.00 0.00 61.69 60.00 2c44 s THR 23 Cb 0.04 -3.79 0.09 0.00 1.34 0.00 0.00 72.50 70.18 2c44 s THR 23 CO 0.16 -0.20 1.78 -0.09 -0.54 0.00 0.00 174.62 175.73 2c44 h ARG 24 N 1.73 0.47 -0.59 3.99 9.65 -1.95 -1.40 114.38 126.29 2c44 h ARG 24 Ca -0.50 -0.03 0.08 0.00 -1.10 0.00 0.00 59.98 58.43 2c44 h ARG 24 Cb 1.21 -0.11 -0.06 0.00 -1.39 0.00 0.00 29.97 29.62 2c44 h ARG 24 CO 0.66 0.31 0.24 0.00 2.80 0.00 0.00 179.97 183.98 2c44 h ALA 25 N 1.29 0.76 -0.35 2.80 0.00 -1.95 -0.27 119.26 121.54 2c44 h ALA 25 Ca 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2c44 h ALA 25 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2c44 h ALA 25 CO -0.18 -0.15 0.19 -0.92 0.00 0.00 0.00 179.25 178.19 2c44 h TYR 26 N 0.45 0.49 -0.80 0.00 5.03 -1.76 -2.37 116.97 118.02 2c44 h TYR 26 Ca 0.29 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.57 2c44 h TYR 26 Cb 0.31 -0.16 -0.04 0.00 1.55 0.00 0.00 36.73 38.40 2c44 h TYR 26 CO -0.15 0.39 0.44 0.00 -1.32 0.00 0.00 178.16 177.53 2c44 h ARG 27 N 0.45 1.11 -0.54 1.82 3.08 -0.65 0.05 114.38 119.70 2c44 h ARG 27 Ca 0.12 -0.13 0.09 0.00 0.07 0.00 0.00 59.98 60.13 2c44 h ARG 27 Cb 0.07 -0.22 -0.07 0.00 0.08 0.00 0.00 29.97 29.83 2c44 h ARG 27 CO -0.02 0.82 0.16 1.49 -1.07 0.00 0.00 179.97 181.35 2c44 h GLU 28 N 1.11 0.31 -0.10 0.04 4.57 -0.80 0.32 114.58 120.04 2c44 h GLU 28 Ca 0.28 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.41 2c44 h GLU 28 Cb 0.03 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.55 2c44 h GLU 28 CO -0.05 0.21 -0.05 0.93 -1.18 0.00 0.00 179.01 178.87 2c44 h GLU 29 N 0.32 0.20 -0.48 1.92 3.07 -0.99 -3.18 114.58 115.45 2c44 h GLU 29 Ca 0.27 -0.09 0.04 0.00 -0.50 0.00 0.00 59.36 59.08 2c44 h GLU 29 Cb 0.34 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.21 2c44 h GLU 29 CO -0.31 0.57 0.25 0.00 -1.40 0.00 0.00 179.01 178.13 2c44 h ALA 30 N 0.63 0.61 0.00 3.43 0.00 -0.22 -1.31 119.26 122.40 2c44 h ALA 30 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 30 Cb 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2c44 h ALA 30 CO 0.02 -0.09 -0.12 0.97 0.00 0.00 0.00 179.25 180.03 2c44 h ILE 31 N 0.50 0.96 0.01 0.00 6.09 -0.46 -0.72 117.51 123.89 2c44 h ILE 31 Ca 0.21 -0.43 -0.10 0.00 -1.37 0.00 0.00 64.86 63.17 2c44 h ILE 31 Cb 0.10 1.24 0.01 0.00 0.47 0.00 0.00 36.82 38.63 2c44 h ILE 31 CO -0.13 0.12 -0.38 0.40 -3.07 0.00 0.00 178.15 175.08 2c44 h ILE 32 N 0.00 1.52 0.00 2.19 2.04 -1.37 -1.24 117.51 120.65 2c44 h ILE 32 Ca -0.00 -2.04 -0.00 0.00 1.00 0.00 0.00 64.86 63.81 2c44 h ILE 32 Cb 0.23 2.77 -0.00 0.00 -0.74 0.00 0.00 36.82 39.08 2c44 h ILE 32 CO 0.02 0.57 -0.00 0.11 0.00 0.00 0.00 178.15 178.84 2c44 h LYS 33 N -0.39 0.00 -0.22 2.37 1.57 -0.86 -0.42 116.57 118.62 2c44 h LYS 33 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2c44 h LYS 33 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2c44 h LYS 33 CO 0.08 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.83 2c44 n SER 34 N -4.22 1.03 -2.78 0.86 3.41 -0.31 -4.88 113.62 106.73 2c44 n SER 34 Ca -0.03 -2.01 -0.21 0.00 -0.26 0.00 0.00 58.87 56.36 2c44 n SER 34 Cb 0.09 -0.14 0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2c44 n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c44 n GLY 35 N 0.75 -0.44 2.51 5.00 0.00 -0.17 -2.10 105.19 110.75 2c44 n GLY 35 Ca 0.06 0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 2c44 n GLY 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c44 n MET 36 N -3.75 -2.22 -3.79 1.61 0.00 -0.48 0.51 117.12 109.00 2c44 n MET 36 Ca -0.12 0.92 -0.30 0.00 0.00 0.00 0.00 57.70 58.20 2c44 n MET 36 Cb 0.62 -5.60 -0.15 0.00 0.00 0.00 0.00 33.22 28.09 2c44 n MET 36 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2c44 s ASN 37 N -2.14 3.83 0.52 7.83 3.84 -0.89 -4.76 114.94 123.17 2c44 s ASN 37 Ca 0.05 -1.43 0.33 0.00 0.21 0.00 0.00 52.86 52.02 2c44 s ASN 37 Cb -0.02 -0.93 1.48 0.00 -0.55 0.00 0.00 41.25 41.23 2c44 s ASN 37 CO 0.06 -0.36 1.82 -0.65 -2.79 0.00 0.00 177.10 175.18 2c44 h PRO 38 N 8.06 0.05 -0.13 0.43 0.11 -1.88 0.18 132.00 138.82 2c44 h PRO 38 Ca -0.14 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.00 2c44 h PRO 38 Cb 1.05 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2c44 h PRO 38 CO 0.44 0.04 0.17 0.74 -0.21 0.00 0.00 178.00 179.17 2c44 h PHE 39 N 0.06 0.00 -0.19 0.65 -1.00 -1.89 -0.68 116.94 113.87 2c44 h PHE 39 Ca 0.54 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.32 2c44 h PHE 39 Cb 2.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.61 2c44 h PHE 39 CO -0.00 0.00 0.00 1.28 -1.61 0.00 0.00 178.31 177.98 2c44 n LEU 40 N -3.65 2.58 -4.82 1.54 4.77 0.62 -4.94 117.00 113.09 2c44 n LEU 40 Ca 0.00 -1.02 -0.33 0.00 -0.03 0.00 0.00 56.01 54.64 2c44 n LEU 40 Cb 0.28 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.19 2c44 n LEU 40 CO 0.25 0.51 0.67 -0.76 -1.33 0.00 0.00 177.39 176.73 2c44 s LEU 41 N -1.70 3.82 0.32 2.23 1.43 -0.27 -4.85 118.68 119.67 2c44 s LEU 41 Ca 0.34 1.68 -0.26 0.00 -1.03 0.00 0.00 54.13 54.86 2c44 s LEU 41 Cb 0.20 -4.53 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 2c44 s LEU 41 CO 0.30 -0.50 0.97 -1.81 0.23 0.00 0.00 176.35 175.54 2c44 s ASP 42 N -2.45 7.28 0.22 2.29 1.01 -1.26 -4.96 116.67 118.80 2c44 s ASP 42 Ca 0.62 1.90 -0.08 0.00 0.71 0.00 0.00 52.55 55.69 2c44 s ASP 42 Cb -0.10 -2.59 0.31 0.00 1.01 0.00 0.00 42.92 41.55 2c44 s ASP 42 CO 0.20 -0.11 1.74 -1.28 0.21 0.00 0.00 175.17 175.93 2c44 h SER 43 N 3.20 0.22 0.29 0.27 0.87 -1.96 -0.59 113.55 115.85 2c44 h SER 43 Ca -0.47 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 2c44 h SER 43 Cb 1.20 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2c44 h SER 43 CO 0.65 0.12 0.00 -0.62 -0.53 0.00 0.00 176.83 176.45 2c44 n GLU 44 N -5.00 0.00 -0.37 2.24 1.02 -1.26 -1.09 120.64 116.18 2c44 n GLU 44 Ca 0.10 0.35 0.10 0.00 -0.02 0.00 0.00 57.16 57.69 2c44 n GLU 44 Cb 0.30 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.51 2c44 n GLU 44 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2c44 n ASP 45 N -1.50 3.57 -4.15 1.62 8.00 -0.23 -4.75 116.55 119.12 2c44 n ASP 45 Ca 0.02 -2.09 -0.31 0.00 0.71 0.00 0.00 54.79 53.12 2c44 n ASP 45 Cb 0.10 -0.45 -0.17 0.00 -0.02 0.00 0.00 41.12 40.58 2c44 n ASP 45 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2c44 s VAL 46 N -1.30 1.87 -0.12 2.53 1.01 -0.25 -4.95 120.40 119.20 2c44 s VAL 46 Ca 0.43 -0.88 -0.13 0.00 0.00 0.00 0.00 61.98 61.39 2c44 s VAL 46 Cb 0.24 -1.66 -0.12 0.00 0.00 0.00 0.00 36.38 34.84 2c44 s VAL 46 CO 0.27 0.52 0.37 0.15 0.00 0.00 0.00 175.10 176.40 2c44 h PHE 47 N 7.16 -0.01 -3.78 5.22 -0.00 -1.41 -3.44 116.94 120.69 2c44 h PHE 47 Ca -0.28 -0.00 -0.66 0.00 -0.00 0.00 0.00 57.97 57.03 2c44 h PHE 47 Cb 1.20 0.00 -0.38 0.00 -0.00 0.00 0.00 35.95 36.77 2c44 h PHE 47 CO 0.47 0.44 -0.78 0.42 -0.00 0.00 0.00 178.31 178.87 2c44 s ILE 48 N -1.91 2.10 -0.74 1.41 1.01 -1.18 -4.93 121.20 116.96 2c44 s ILE 48 Ca -0.09 -1.78 -0.20 0.00 0.00 0.00 0.00 60.65 58.58 2c44 s ILE 48 Cb -0.01 -2.32 0.10 0.00 0.01 0.00 0.00 42.46 40.23 2c44 s ILE 48 CO 0.32 -0.21 0.97 -0.62 0.00 0.00 0.00 174.94 175.40 2c44 s ASP 49 N 1.09 6.34 -0.29 3.58 3.68 -1.26 -1.93 116.67 127.88 2c44 s ASP 49 Ca -0.03 -1.47 0.12 0.00 2.13 0.00 0.00 52.55 53.30 2c44 s ASP 49 Cb -0.20 -2.39 0.77 0.00 -1.45 0.00 0.00 42.92 39.65 2c44 s ASP 49 CO -0.06 -1.24 1.77 0.18 0.13 0.00 0.00 175.17 175.95 2c44 n LEU 50 N 7.00 5.88 -0.27 -1.34 4.77 0.11 -4.57 117.00 128.57 2c44 n LEU 50 Ca 0.05 -3.12 0.02 0.00 -0.03 0.00 0.00 56.01 52.93 2c44 n LEU 50 Cb 0.46 -0.72 0.15 0.00 -2.33 0.00 0.00 43.42 40.99 2c44 n LEU 50 CO 0.58 0.75 1.11 0.25 -1.33 0.00 0.00 177.39 178.75 2c44 h LEU 51 N 3.10 0.60 -7.02 2.23 5.85 -1.58 -2.52 115.31 115.97 2c44 h LEU 51 Ca 0.16 0.05 0.15 0.00 0.84 0.00 0.00 57.88 59.08 2c44 h LEU 51 Cb 2.18 -0.06 -0.16 0.00 0.37 0.00 0.00 40.66 42.99 2c44 h LEU 51 CO 0.63 0.34 0.57 0.28 -0.34 0.00 0.00 178.44 179.92 2c44 s THR 52 N -6.04 0.00 -2.64 1.05 -1.32 -1.26 -4.41 115.64 101.01 2c44 s THR 52 Ca -0.12 -0.02 0.24 0.00 -1.21 0.00 0.00 61.69 60.57 2c44 s THR 52 Cb 0.19 -1.04 0.36 0.00 -1.51 0.00 0.00 72.50 70.49 2c44 s THR 52 CO 0.77 0.00 1.37 -0.90 -2.21 0.00 0.00 174.62 173.66 2c44 n ASP 53 N -0.22 3.20 -4.57 8.08 5.75 -1.26 -4.49 116.55 123.03 2c44 n ASP 53 Ca -0.07 -1.97 -0.42 0.00 -0.01 0.00 0.00 54.79 52.32 2c44 n ASP 53 Cb 0.61 -0.16 -0.03 0.00 -1.03 0.00 0.00 41.12 40.52 2c44 n ASP 53 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2c44 s SER 54 N -1.67 6.37 -0.37 -1.12 0.15 -1.26 -3.79 113.70 112.00 2c44 s SER 54 Ca 0.35 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.94 2c44 s SER 54 Cb 0.22 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2c44 s SER 54 CO 0.31 -1.57 0.00 0.61 1.20 0.00 0.00 173.24 173.79 2c44 n GLY 55 N 5.15 0.61 0.23 9.45 0.00 0.85 -4.88 105.19 116.60 2c44 n GLY 55 Ca 0.07 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.82 2c44 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c44 n THR 56 N -2.70 0.00 -2.09 2.61 -2.24 -1.25 -4.52 114.28 104.09 2c44 n THR 56 Ca -0.03 -0.40 -0.28 0.00 -2.27 0.00 0.00 64.05 61.07 2c44 n THR 56 Cb 0.21 1.12 0.18 0.00 -2.10 0.00 0.00 70.33 69.75 2c44 n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c44 n GLY 57 N 0.90 -0.95 3.92 3.38 0.00 -1.26 -4.81 105.19 106.36 2c44 n GLY 57 Ca 0.04 -1.79 -0.26 0.00 0.00 0.00 0.00 46.02 44.01 2c44 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c44 s ALA 58 N -3.77 3.20 0.34 4.61 0.00 -0.08 -4.86 121.76 121.20 2c44 s ALA 58 Ca 0.72 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.93 2c44 s ALA 58 Cb -0.02 -2.62 -0.07 0.00 0.00 0.00 0.00 23.12 20.41 2c44 s ALA 58 CO 0.50 -1.10 -0.01 0.14 0.00 0.00 0.00 175.76 175.29 2c44 s VAL 59 N -3.15 1.71 0.39 0.00 -7.23 -1.26 -4.85 120.40 106.00 2c44 s VAL 59 Ca 0.58 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 2c44 s VAL 59 Cb -0.11 -2.76 -0.00 0.00 0.56 0.00 0.00 36.38 34.07 2c44 s VAL 59 CO 0.45 -0.10 0.56 0.42 -0.31 0.00 0.00 175.10 176.12 2c44 s THR 60 N -2.94 3.88 0.20 5.32 -4.23 -1.26 -4.94 115.64 111.67 2c44 s THR 60 Ca 0.34 -0.83 -0.11 0.00 -1.18 0.00 0.00 61.69 59.91 2c44 s THR 60 Cb 0.07 -3.37 0.12 0.00 1.34 0.00 0.00 72.50 70.66 2c44 s THR 60 CO 0.16 -0.19 1.76 1.56 -0.54 0.00 0.00 174.62 177.37 2c44 h GLN 61 N 0.67 0.43 -1.01 3.99 4.20 -2.00 -0.78 115.11 120.62 2c44 h GLN 61 Ca -0.45 -0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.33 2c44 h GLN 61 Cb 1.26 -0.10 -0.08 0.00 0.30 0.00 0.00 27.48 28.86 2c44 h GLN 61 CO 0.53 0.29 0.64 0.77 -0.67 0.00 0.00 178.83 180.39 2c44 h SER 62 N 0.45 0.98 -0.15 1.46 0.02 -1.98 0.30 113.55 114.62 2c44 h SER 62 Ca 0.27 0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2c44 h SER 62 Cb 0.28 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 2c44 h SER 62 CO -0.25 0.56 -0.07 0.24 -1.14 0.00 0.00 176.83 176.18 2c44 h MET 63 N 1.07 0.32 -0.48 3.45 2.86 -1.60 0.50 114.93 121.05 2c44 h MET 63 Ca 0.47 -0.14 -0.03 0.00 -2.06 0.00 0.00 59.70 57.94 2c44 h MET 63 Cb 0.36 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2c44 h MET 63 CO -0.23 0.64 0.16 0.37 1.06 0.00 0.00 176.91 178.91 2c44 h GLN 64 N -0.01 0.70 -0.50 1.72 4.15 -0.52 -1.74 115.11 118.92 2c44 h GLN 64 Ca 0.03 -0.11 -0.11 0.00 0.77 0.00 0.00 58.65 59.24 2c44 h GLN 64 Cb 0.54 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 2c44 h GLN 64 CO 0.02 0.61 -0.10 0.00 -1.93 0.00 0.00 178.83 177.43 2c44 h ALA 65 N 1.49 0.68 -0.70 3.38 0.00 -0.22 -2.88 119.26 121.01 2c44 h ALA 65 Ca 0.16 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2c44 h ALA 65 Cb 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2c44 h ALA 65 CO -0.01 0.58 0.39 0.00 0.00 0.00 0.00 179.25 180.21 2c44 h ALA 66 N 0.90 1.37 -0.01 0.00 0.00 -0.26 -1.03 119.26 120.23 2c44 h ALA 66 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c44 h ALA 66 Cb 0.65 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2c44 h ALA 66 CO 0.05 0.52 0.07 1.98 0.00 0.00 0.00 179.25 181.87 2c44 h MET 67 N 0.97 0.00 -0.00 0.00 -1.53 -1.11 -1.94 114.93 111.32 2c44 h MET 67 Ca 0.25 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.51 2c44 h MET 67 Cb 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.06 2c44 h MET 67 CO -0.04 0.00 -0.27 -1.33 0.14 0.00 0.00 176.91 175.41 2c44 n MET 68 N -3.14 0.10 -2.51 0.39 2.81 -0.39 -4.28 117.12 110.10 2c44 n MET 68 Ca -0.03 -0.04 -0.20 0.00 -1.81 0.00 0.00 57.70 55.62 2c44 n MET 68 Cb 0.14 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.16 2c44 n MET 68 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2c44 n ARG 69 N -1.41 2.68 -3.31 0.03 1.85 -0.73 -5.08 116.66 110.70 2c44 n ARG 69 Ca 0.07 -4.05 -0.32 0.00 -1.00 0.00 0.00 57.85 52.55 2c44 n ARG 69 Cb 0.33 -1.92 -0.06 0.00 -1.05 0.00 0.00 32.46 29.76 2c44 n ARG 69 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2c44 s GLY 70 N -3.44 2.32 -0.48 2.89 0.00 -1.26 -4.89 107.32 102.46 2c44 s GLY 70 Ca 0.41 -0.14 -0.17 0.00 0.00 0.00 0.00 44.72 44.82 2c44 s GLY 70 CO -0.09 0.04 0.46 -0.35 0.00 0.00 0.00 173.10 173.16 2c44 s ASP 71 N -2.27 6.17 0.00 1.64 2.15 -1.26 -4.67 116.67 118.42 2c44 s ASP 71 Ca 0.49 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 52.26 2c44 s ASP 71 Cb -0.11 -2.21 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 2c44 s ASP 71 CO 0.20 -0.72 0.52 -0.62 -0.17 0.00 0.00 175.17 174.38 2c44 n GLU 72 N 5.48 0.91 -1.67 4.34 -0.58 -1.26 -4.27 120.64 123.58 2c44 n GLU 72 Ca -0.11 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.24 2c44 n GLU 72 Cb 0.44 -1.38 0.03 0.00 -0.57 0.00 0.00 31.44 29.96 2c44 n GLU 72 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2c44 n ALA 73 N -0.04 0.86 0.12 0.62 0.00 -1.26 -4.89 120.51 115.92 2c44 n ALA 73 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 53.44 53.55 2c44 n ALA 73 Cb 0.19 -2.22 0.08 0.00 0.00 0.00 0.00 19.45 17.51 2c44 n ALA 73 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2c44 h TYR 74 N 1.29 0.00 -3.88 0.00 3.20 -1.99 -3.42 116.97 112.18 2c44 h TYR 74 Ca -0.48 0.00 -0.29 0.00 3.14 0.00 0.00 58.73 61.10 2c44 h TYR 74 Cb 1.33 0.00 -0.27 0.00 1.54 0.00 0.00 36.73 39.33 2c44 h TYR 74 CO 0.43 0.72 -0.74 -1.12 -1.64 0.00 0.00 178.16 175.81 2c44 s SER 75 N -6.74 0.48 -1.71 -2.11 0.01 -1.26 -4.75 113.70 97.61 2c44 s SER 75 Ca -0.00 -0.15 -0.00 0.00 1.31 0.00 0.00 55.95 57.11 2c44 s SER 75 Cb 0.11 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.31 2c44 s SER 75 CO 0.77 -0.00 0.06 0.61 0.41 0.00 0.00 173.24 175.09 2c44 n GLY 76 N 2.73 -0.47 3.74 3.44 0.00 -1.26 -4.94 105.19 108.44 2c44 n GLY 76 Ca -0.14 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2c44 n GLY 76 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2c44 n SER 77 N -1.93 3.41 0.28 1.61 2.88 -1.26 -4.86 113.62 113.74 2c44 n SER 77 Ca -0.23 1.22 0.16 0.00 -1.33 0.00 0.00 58.87 58.69 2c44 n SER 77 Cb 0.68 -1.57 0.75 0.00 -0.75 0.00 0.00 64.21 63.32 2c44 n SER 77 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2c44 h ARG 78 N 2.89 0.00 -0.07 -1.46 0.11 -1.92 -1.29 114.38 112.64 2c44 h ARG 78 Ca -0.49 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.48 2c44 h ARG 78 Cb 1.26 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 2c44 h ARG 78 CO 0.64 0.07 -0.46 0.77 0.10 0.00 0.00 179.97 181.10 2c44 h SER 79 N 0.00 0.19 -0.21 0.08 0.02 -1.89 -1.27 113.55 110.47 2c44 h SER 79 Ca -0.00 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 2c44 h SER 79 Cb 0.42 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2c44 h SER 79 CO 0.01 0.62 0.05 0.22 -1.14 0.00 0.00 176.83 176.59 2c44 h TYR 80 N 0.15 0.35 -0.14 3.45 3.20 -1.47 -1.96 116.97 120.55 2c44 h TYR 80 Ca 0.01 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 2c44 h TYR 80 Cb 0.87 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 2c44 h TYR 80 CO 0.01 0.45 -0.07 1.88 -1.64 0.00 0.00 178.16 178.79 2c44 h TYR 81 N 0.16 0.21 -0.35 -3.82 0.05 -1.34 0.11 116.97 111.98 2c44 h TYR 81 Ca 0.07 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 2c44 h TYR 81 Cb 0.28 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 2c44 h TYR 81 CO 0.01 0.29 0.09 0.00 -1.05 0.00 0.00 178.16 177.50 2c44 h ALA 82 N 1.73 0.46 -0.25 3.88 0.00 -0.89 0.48 119.26 124.68 2c44 h ALA 82 Ca 0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2c44 h ALA 82 Cb 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2c44 h ALA 82 CO 0.01 0.13 0.07 1.25 0.00 0.00 0.00 179.25 180.71 2c44 h LEU 83 N 0.42 0.37 -1.04 0.00 5.85 -0.59 -2.20 115.31 118.11 2c44 h LEU 83 Ca 0.11 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.70 2c44 h LEU 83 Cb 0.29 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 2c44 h LEU 83 CO 0.00 0.48 0.64 0.00 -0.34 0.00 0.00 178.44 179.22 2c44 h ALA 84 N 0.90 1.45 -0.33 1.25 0.00 -0.61 -1.22 119.26 120.71 2c44 h ALA 84 Ca 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2c44 h ALA 84 Cb 0.25 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2c44 h ALA 84 CO -0.00 0.38 0.11 1.05 0.00 0.00 0.00 179.25 180.78 2c44 h GLU 85 N 1.11 0.51 -0.73 0.00 -0.00 -0.59 -0.50 114.58 114.37 2c44 h GLU 85 Ca 0.44 -0.11 0.03 0.00 -0.00 0.00 0.00 59.36 59.73 2c44 h GLU 85 Cb 0.25 -0.07 -0.05 0.00 -0.00 0.00 0.00 28.75 28.88 2c44 h GLU 85 CO -0.19 0.54 0.46 0.77 -0.00 0.00 0.00 179.01 180.59 2c44 h SER 86 N 0.38 0.75 -0.48 3.06 0.02 -0.74 0.56 113.55 117.10 2c44 h SER 86 Ca 0.11 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2c44 h SER 86 Cb 0.24 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2c44 h SER 86 CO -0.00 0.52 0.20 0.58 -1.14 0.00 0.00 176.83 176.98 2c44 h VAL 87 N 0.89 1.21 -0.48 2.27 2.07 -0.94 0.19 116.25 121.46 2c44 h VAL 87 Ca 0.30 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2c44 h VAL 87 Cb 0.03 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2c44 h VAL 87 CO -0.12 0.24 0.22 0.11 0.02 0.00 0.00 177.57 178.05 2c44 h LYS 88 N 0.64 0.69 -0.20 1.57 6.56 -0.40 -0.46 116.57 124.97 2c44 h LYS 88 Ca 0.16 -0.11 -0.17 0.00 -1.06 0.00 0.00 60.65 59.48 2c44 h LYS 88 Cb 0.18 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.71 2c44 h LYS 88 CO -0.01 0.59 -0.56 -2.95 -2.06 0.00 0.00 179.45 174.46 2c44 h ASN 89 N 0.63 0.67 0.00 0.86 -0.00 -0.73 -0.67 115.58 116.34 2c44 h ASN 89 Ca 0.16 -0.36 -0.07 0.00 -0.00 0.00 0.00 56.30 56.03 2c44 h ASN 89 Cb 0.13 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.25 2c44 h ASN 89 CO -0.02 1.09 -0.39 0.40 -0.00 0.00 0.00 177.43 178.51 2c44 h ILE 90 N 0.46 1.42 0.00 6.14 2.04 -0.89 -3.40 117.51 123.28 2c44 h ILE 90 Ca 0.01 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.65 2c44 h ILE 90 Cb 1.11 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 40.03 2c44 h ILE 90 CO 0.11 0.48 -1.49 0.49 0.00 0.00 0.00 178.15 177.74 2c44 n PHE 91 N -4.56 0.09 -1.09 1.37 3.72 -0.21 -3.96 117.46 112.82 2c44 n PHE 91 Ca -0.16 0.03 -0.03 0.00 -0.05 0.00 0.00 57.45 57.23 2c44 n PHE 91 Cb 0.52 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.68 2c44 n PHE 91 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c44 n GLY 92 N 1.35 0.62 3.76 1.37 0.00 -0.26 -4.83 105.19 107.20 2c44 n GLY 92 Ca -0.00 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 2c44 n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c44 s TYR 93 N -2.11 3.53 -0.29 1.61 1.51 -1.24 -4.90 117.35 115.47 2c44 s TYR 93 Ca 0.00 0.71 0.22 0.00 -1.01 0.00 0.00 57.07 56.99 2c44 s TYR 93 Cb 0.00 -2.34 0.09 0.00 -0.11 0.00 0.00 41.96 39.61 2c44 s TYR 93 CO 0.00 0.34 1.21 1.96 -1.11 0.00 0.00 175.55 177.95 2c44 h GLN 94 N 6.19 0.00 -5.20 -0.62 4.20 -1.26 -3.25 115.11 115.18 2c44 h GLN 94 Ca -0.44 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 57.61 2c44 h GLN 94 Cb 1.18 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 28.67 2c44 h GLN 94 CO 0.72 0.04 -0.79 0.71 -0.67 0.00 0.00 178.83 178.83 2c44 s TYR 95 N -3.28 2.80 -0.03 2.96 2.02 -0.81 -5.01 117.35 116.00 2c44 s TYR 95 Ca 0.02 -0.97 0.04 0.00 -0.37 0.00 0.00 57.07 55.79 2c44 s TYR 95 Cb 0.08 -1.89 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 2c44 s TYR 95 CO 0.75 -0.44 -0.16 0.99 -1.57 0.00 0.00 175.55 175.13 2c44 s THR 96 N 0.78 1.27 -0.14 -0.71 2.01 -1.26 -1.09 115.64 116.50 2c44 s THR 96 Ca -0.06 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2c44 s THR 96 Cb -0.15 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.32 2c44 s THR 96 CO 0.01 0.37 0.01 -0.63 -0.69 0.00 0.00 174.62 173.68 2c44 s ILE 97 N -0.16 0.52 0.41 1.82 1.01 -0.19 -5.00 121.20 119.62 2c44 s ILE 97 Ca 0.01 -0.26 -0.22 0.00 0.00 0.00 0.00 60.65 60.19 2c44 s ILE 97 Cb -0.08 -0.83 -0.11 0.00 0.01 0.00 0.00 42.46 41.45 2c44 s ILE 97 CO 0.01 0.04 0.96 -2.16 0.00 0.00 0.00 174.94 173.78 2c44 s PRO 98 N 1.89 4.27 0.10 2.79 0.04 -1.26 -1.15 135.00 141.67 2c44 s PRO 98 Ca 0.02 1.18 0.02 0.00 0.04 0.00 0.00 61.00 62.26 2c44 s PRO 98 Cb -0.15 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 2c44 s PRO 98 CO -0.07 -0.00 -0.07 0.95 0.04 0.00 0.00 177.00 177.85 2c44 s THR 99 N -2.06 0.74 0.41 1.26 -4.23 -0.88 -3.71 115.64 107.17 2c44 s THR 99 Ca 0.60 -1.83 0.14 0.00 -1.18 0.00 0.00 61.69 59.42 2c44 s THR 99 Cb -0.11 -1.56 0.14 0.00 1.34 0.00 0.00 72.50 72.31 2c44 s THR 99 CO 0.16 -0.79 1.92 1.12 -0.54 0.00 0.00 174.62 176.48 2c44 h HIS 100 N 3.16 0.00 -2.05 3.99 2.07 -1.53 0.67 115.15 121.47 2c44 h HIS 100 Ca -0.36 0.00 0.09 0.00 -2.85 0.00 0.00 60.37 57.26 2c44 h HIS 100 Cb 1.17 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.14 2c44 h HIS 100 CO 0.60 0.27 0.33 0.00 -3.07 0.00 0.00 177.93 176.06 2c44 n GLN 101 N -4.20 0.32 -0.06 5.12 10.64 -1.26 -0.60 117.38 127.33 2c44 n GLN 101 Ca -0.02 -0.74 -0.04 0.00 -1.83 0.00 0.00 57.00 54.37 2c44 n GLN 101 Cb 0.32 1.01 -0.03 0.00 -0.86 0.00 0.00 30.24 30.68 2c44 n GLN 101 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 2c44 h GLY 102 N 1.03 -1.74 2.00 2.61 0.00 -1.77 -0.60 103.07 104.60 2c44 h GLY 102 Ca -0.14 0.85 0.00 0.00 0.00 0.00 0.00 47.33 48.04 2c44 h GLY 102 CO 0.19 -0.57 0.00 -0.96 0.00 0.00 0.00 176.54 175.20 2c44 n ARG 103 N -3.59 0.04 -0.02 4.80 1.85 -1.26 -0.69 116.66 117.79 2c44 n ARG 103 Ca -0.01 0.52 -0.16 0.00 -1.00 0.00 0.00 57.85 57.20 2c44 n ARG 103 Cb 0.10 -1.63 -0.05 0.00 -1.05 0.00 0.00 32.46 29.83 2c44 n ARG 103 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2c44 h GLY 104 N 0.18 0.83 1.51 2.89 0.00 -1.52 -2.54 103.07 104.42 2c44 h GLY 104 Ca 0.00 -1.15 -0.24 0.00 0.00 0.00 0.00 47.33 45.93 2c44 h GLY 104 CO 0.00 1.03 -1.03 0.00 0.00 0.00 0.00 176.54 176.53 2c44 h ALA 105 N 0.62 0.27 -0.34 3.60 0.00 -0.71 -3.32 119.26 119.37 2c44 h ALA 105 Ca -0.04 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 2c44 h ALA 105 Cb 1.38 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 2c44 h ALA 105 CO 0.15 0.82 0.16 0.93 0.00 0.00 0.00 179.25 181.32 2c44 h GLU 106 N 0.22 0.50 0.00 0.00 5.08 -1.44 -1.61 114.58 117.33 2c44 h GLU 106 Ca -0.10 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2c44 h GLU 106 Cb 1.69 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2c44 h GLU 106 CO 0.18 0.46 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 2c44 n GLN 107 N -4.73 0.09 -0.07 2.33 10.64 -0.96 -2.23 117.38 122.46 2c44 n GLN 107 Ca -0.01 0.22 -0.10 0.00 -1.83 0.00 0.00 57.00 55.28 2c44 n GLN 107 Cb 0.11 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 27.96 2c44 n GLN 107 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 2c44 n ILE 108 N -1.28 1.39 -0.05 -0.39 5.41 -0.78 -4.55 119.36 119.11 2c44 n ILE 108 Ca 0.03 0.11 -0.03 0.00 1.00 0.00 0.00 62.75 63.86 2c44 n ILE 108 Cb 0.05 -2.10 0.21 0.00 -0.71 0.00 0.00 39.64 37.08 2c44 n ILE 108 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 2c44 h TYR 109 N -0.77 0.70 0.21 1.39 -0.00 -1.31 -2.75 116.97 114.44 2c44 h TYR 109 Ca -0.10 -0.10 0.00 0.00 -0.00 0.00 0.00 58.73 58.53 2c44 h TYR 109 Cb 0.91 -0.19 -0.01 0.00 -0.00 0.00 0.00 36.73 37.43 2c44 h TYR 109 CO -0.28 0.70 -0.18 0.82 -0.00 0.00 0.00 178.16 179.21 2c44 h ILE 110 N 0.61 0.61 -0.48 -0.90 2.04 -1.69 0.34 117.51 118.04 2c44 h ILE 110 Ca 0.12 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2c44 h ILE 110 Cb 0.46 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2c44 h ILE 110 CO 0.02 0.00 0.29 -0.65 0.00 0.00 0.00 178.15 177.82 2c44 h PRO 111 N -0.41 0.65 0.02 2.37 0.11 -1.79 -1.65 132.00 131.31 2c44 h PRO 111 Ca -0.01 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.06 2c44 h PRO 111 Cb 0.37 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 2c44 h PRO 111 CO -0.03 0.47 -0.10 0.28 -0.21 0.00 0.00 178.00 178.41 2c44 h VAL 112 N 0.64 0.76 -0.70 3.15 2.07 -1.18 -1.60 116.25 119.38 2c44 h VAL 112 Ca 0.17 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.65 2c44 h VAL 112 Cb -0.02 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 2c44 h VAL 112 CO -0.03 0.00 0.26 -0.07 0.02 0.00 0.00 177.57 177.75 2c44 h LEU 113 N -0.18 0.97 0.20 2.57 3.38 -0.22 -1.69 115.31 120.33 2c44 h LEU 113 Ca 0.03 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2c44 h LEU 113 Cb 0.22 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2c44 h LEU 113 CO -0.08 0.88 -0.10 0.40 0.09 0.00 0.00 178.44 179.63 2c44 h ILE 114 N 1.03 0.86 -0.80 1.22 2.04 -1.05 -2.51 117.51 118.29 2c44 h ILE 114 Ca 0.24 -0.25 0.10 0.00 1.00 0.00 0.00 64.86 65.94 2c44 h ILE 114 Cb 0.22 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 2c44 h ILE 114 CO -0.02 0.06 0.52 0.11 0.00 0.00 0.00 178.15 178.82 2c44 h LYS 115 N -0.39 0.71 0.57 2.37 1.57 -1.15 -1.92 116.57 118.33 2c44 h LYS 115 Ca -0.03 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2c44 h LYS 115 Cb 0.30 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2c44 h LYS 115 CO 0.04 0.47 -0.37 -0.22 -0.57 0.00 0.00 179.45 178.81 2c44 h LYS 116 N 0.73 -0.86 0.00 3.15 3.64 -0.90 0.11 116.57 122.43 2c44 h LYS 116 Ca 0.37 0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.77 2c44 h LYS 116 Cb 0.45 0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2c44 h LYS 116 CO -0.14 -0.58 -0.16 -0.09 -2.27 0.00 0.00 179.45 176.21 2c44 h ARG 117 N -0.90 0.00 -0.08 1.90 2.43 -1.22 0.29 114.38 116.81 2c44 h ARG 117 Ca -0.07 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2c44 h ARG 117 Cb 0.73 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2c44 h ARG 117 CO 0.06 0.16 -0.02 1.49 -1.51 0.00 0.00 179.97 180.15 2c44 h GLU 118 N 0.00 0.15 0.00 0.20 4.81 -0.87 0.21 114.58 119.07 2c44 h GLU 118 Ca -0.00 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.04 2c44 h GLU 118 Cb 0.38 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2c44 h GLU 118 CO 0.02 0.46 -0.64 1.96 -0.73 0.00 0.00 179.01 180.08 2c44 h GLN 119 N -0.18 0.00 0.03 1.92 4.20 -0.52 -2.82 115.11 117.74 2c44 h GLN 119 Ca 0.02 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.46 2c44 h GLN 119 Cb 0.41 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 2c44 h GLN 119 CO 0.01 0.64 -1.45 -0.85 -0.67 0.00 0.00 178.83 176.51 2c44 n GLU 120 N -3.54 0.61 -0.06 1.46 0.28 0.97 -4.65 120.64 115.71 2c44 n GLU 120 Ca -0.00 0.50 0.03 0.00 -0.16 0.00 0.00 57.16 57.53 2c44 n GLU 120 Cb 0.69 -1.73 0.06 0.00 1.43 0.00 0.00 31.44 31.89 2c44 n GLU 120 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2c44 n LYS 121 N -4.22 2.58 -3.11 3.44 5.02 0.69 -5.00 118.16 117.56 2c44 n LYS 121 Ca -0.33 -1.88 -0.15 0.00 -2.02 0.00 0.00 58.31 53.94 2c44 n LYS 121 Cb 0.77 -1.19 0.05 0.00 -0.02 0.00 0.00 35.03 34.64 2c44 n LYS 121 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c44 n GLY 122 N -0.61 0.00 3.69 0.72 0.00 -0.88 -4.89 105.19 103.23 2c44 n GLY 122 Ca 0.06 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2c44 n GLY 122 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2c44 n LEU 123 N -3.19 4.62 -4.17 0.99 0.00 -0.89 -4.92 117.00 109.44 2c44 n LEU 123 Ca -0.01 0.95 -0.39 0.00 0.00 0.00 0.00 56.01 56.56 2c44 n LEU 123 Cb 0.54 -1.50 -0.09 0.00 0.00 0.00 0.00 43.42 42.38 2c44 n LEU 123 CO 0.39 -1.03 0.01 -0.62 0.00 0.00 0.00 177.39 176.14 2c44 s ASP 124 N -0.96 5.59 0.45 1.96 3.68 -1.26 -4.68 116.67 121.45 2c44 s ASP 124 Ca 0.71 -2.29 0.30 0.00 2.13 0.00 0.00 52.55 53.40 2c44 s ASP 124 Cb -0.44 -1.95 1.40 0.00 -1.45 0.00 0.00 42.92 40.48 2c44 s ASP 124 CO 0.50 -0.56 1.65 0.03 0.13 0.00 0.00 175.17 176.92 2c44 h ARG 125 N 7.89 0.12 0.00 4.34 3.08 -1.94 1.07 114.38 128.94 2c44 h ARG 125 Ca -0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2c44 h ARG 125 Cb 1.03 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2c44 h ARG 125 CO 0.77 0.08 0.00 -1.13 -1.07 0.00 0.00 179.97 178.62 2c44 n SER 126 N -4.61 0.28 0.00 7.04 3.41 -1.26 -3.41 113.62 115.08 2c44 n SER 126 Ca 0.35 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.51 2c44 n SER 126 Cb 1.38 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 2c44 n SER 126 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2c44 n LYS 127 N -1.79 1.41 -2.41 4.33 4.01 0.35 -5.09 118.16 118.98 2c44 n LYS 127 Ca 0.04 -0.97 -0.40 0.00 -0.51 0.00 0.00 58.31 56.48 2c44 n LYS 127 Cb 0.27 -0.77 -0.04 0.00 -0.51 0.00 0.00 35.03 33.98 2c44 n LYS 127 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2c44 s MET 128 N -0.49 4.46 -0.01 1.97 0.00 -0.23 -4.93 119.30 120.06 2c44 s MET 128 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 55.69 57.52 2c44 s MET 128 Cb 0.00 -3.02 0.01 0.00 0.00 0.00 0.00 34.83 31.82 2c44 s MET 128 CO 0.00 0.04 0.00 0.08 0.00 0.00 0.00 175.02 175.14 2c44 s VAL 129 N -1.26 0.04 0.09 5.16 1.01 -0.49 -2.76 120.40 122.19 2c44 s VAL 129 Ca 0.48 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.56 2c44 s VAL 129 Cb -0.32 -0.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 2c44 s VAL 129 CO 0.41 0.05 -0.01 0.00 0.00 0.00 0.00 175.10 175.54 2c44 s ALA 130 N 0.39 3.25 0.26 5.51 0.00 0.09 -4.14 121.76 127.11 2c44 s ALA 130 Ca -0.03 -1.13 0.12 0.00 0.00 0.00 0.00 51.96 50.91 2c44 s ALA 130 Cb -0.05 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 2c44 s ALA 130 CO -0.01 0.69 -0.21 -0.06 0.00 0.00 0.00 175.76 176.18 2c44 s PHE 131 N -1.30 2.28 -0.05 0.00 0.40 -1.17 -1.60 117.98 116.54 2c44 s PHE 131 Ca 0.25 -0.34 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 2c44 s PHE 131 Cb -0.12 -1.02 0.10 0.00 0.51 0.00 0.00 43.02 42.50 2c44 s PHE 131 CO 0.18 0.67 0.84 0.45 0.70 0.00 0.00 175.22 178.06 2c44 s SER 132 N -3.33 -0.46 0.59 1.36 0.15 -1.08 -0.55 113.70 110.38 2c44 s SER 132 Ca 0.28 0.31 0.37 0.00 0.70 0.00 0.00 55.95 57.61 2c44 s SER 132 Cb -0.06 0.42 1.77 0.00 -1.71 0.00 0.00 66.02 66.44 2c44 s SER 132 CO 0.14 -0.56 2.14 -0.55 1.20 0.00 0.00 173.24 175.61 2c44 h ASN 133 N 2.43 0.00 0.00 5.45 -1.07 -1.82 0.22 115.58 120.80 2c44 h ASN 133 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.14 2c44 h ASN 133 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 2c44 h ASN 133 CO 0.34 0.02 0.00 0.00 0.07 0.00 0.00 177.43 177.86 2c44 n TYR 134 N -3.17 0.00 -2.34 4.14 4.19 -1.26 -3.83 117.16 114.90 2c44 n TYR 134 Ca -0.01 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 60.81 2c44 n TYR 134 Cb 0.21 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 40.02 2c44 n TYR 134 CO 0.00 0.00 0.00 -0.06 0.91 0.00 0.00 176.86 177.71 2c44 s PHE 135 N 0.00 3.16 0.63 2.98 0.08 -1.26 -4.71 117.98 118.86 2c44 s PHE 135 Ca 0.00 1.58 -0.14 0.00 0.12 0.00 0.00 56.93 58.48 2c44 s PHE 135 Cb 0.00 -3.37 -0.02 0.00 -0.57 0.00 0.00 43.02 39.06 2c44 s PHE 135 CO 0.00 -1.16 1.06 -0.06 -0.10 0.00 0.00 175.22 174.95 2c44 s PHE 136 N -1.39 3.02 0.20 0.36 0.40 -1.26 -4.82 117.98 114.49 2c44 s PHE 136 Ca 0.55 1.48 -0.11 0.00 -0.60 0.00 0.00 56.93 58.26 2c44 s PHE 136 Cb -0.30 -2.97 0.24 0.00 0.51 0.00 0.00 43.02 40.50 2c44 s PHE 136 CO 0.39 -1.15 1.75 0.38 0.70 0.00 0.00 175.22 177.28 2c44 h ASP 137 N 0.06 0.23 0.20 1.36 -0.00 -1.96 -0.00 116.42 116.31 2c44 h ASP 137 Ca -0.46 0.07 -0.10 0.00 -0.00 0.00 0.00 57.03 56.54 2c44 h ASP 137 Cb 1.22 0.05 -0.01 0.00 -0.00 0.00 0.00 39.33 40.58 2c44 h ASP 137 CO 0.57 0.15 -0.37 0.71 -0.00 0.00 0.00 179.24 180.30 2c44 h THR 138 N 0.40 1.29 -0.23 1.15 1.35 -1.98 0.14 112.91 115.03 2c44 h THR 138 Ca 0.28 -1.41 -0.06 0.00 -0.55 0.00 0.00 66.41 64.67 2c44 h THR 138 Cb 0.32 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 2c44 h THR 138 CO -0.28 0.42 -0.11 0.74 -0.25 0.00 0.00 175.52 176.05 2c44 h THR 139 N 0.20 1.30 -0.69 6.82 2.02 -1.74 -1.03 112.91 119.80 2c44 h THR 139 Ca 0.02 -1.17 -0.02 0.00 0.77 0.00 0.00 66.41 66.01 2c44 h THR 139 Cb 0.75 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.71 2c44 h THR 139 CO 0.06 0.36 0.35 -0.61 0.37 0.00 0.00 175.52 176.05 2c44 h GLN 140 N 0.20 0.97 0.33 6.66 4.15 -0.79 -1.24 115.11 125.40 2c44 h GLN 140 Ca 0.05 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 2c44 h GLN 140 Cb 0.60 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 2c44 h GLN 140 CO 0.03 0.76 -0.23 0.78 -1.93 0.00 0.00 178.83 178.23 2c44 h GLY 141 N 0.95 -0.58 1.77 2.39 0.00 -0.52 -0.86 103.07 106.21 2c44 h GLY 141 Ca 0.24 0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.79 2c44 h GLY 141 CO -0.03 -0.23 -0.08 0.45 0.00 0.00 0.00 176.54 176.65 2c44 h HIS 142 N -0.56 0.30 0.39 5.60 3.86 -1.09 0.66 115.15 124.30 2c44 h HIS 142 Ca -0.03 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2c44 h HIS 142 Cb 0.48 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2c44 h HIS 142 CO -0.12 0.37 -0.19 0.77 0.86 0.00 0.00 177.93 179.63 2c44 h SER 143 N 0.28 -0.44 -0.62 2.45 0.02 -0.93 -2.04 113.55 112.27 2c44 h SER 143 Ca 0.06 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2c44 h SER 143 Cb 0.32 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2c44 h SER 143 CO 0.02 -0.16 0.35 1.56 -1.14 0.00 0.00 176.83 177.46 2c44 h GLN 144 N -0.72 0.87 0.00 3.45 4.20 -0.92 -0.16 115.11 121.84 2c44 h GLN 144 Ca -0.05 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2c44 h GLN 144 Cb 0.50 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2c44 h GLN 144 CO 0.09 0.64 -0.11 0.82 -0.67 0.00 0.00 178.83 179.59 2c44 h ILE 145 N 0.88 0.72 -0.46 2.54 2.04 -0.76 -0.25 117.51 122.23 2c44 h ILE 145 Ca 0.23 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2c44 h ILE 145 Cb 0.01 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2c44 h ILE 145 CO -0.04 0.11 0.00 0.59 0.00 0.00 0.00 178.15 178.81 2c44 n ASN 146 N -3.87 3.29 -0.37 1.72 3.02 -0.21 -4.90 115.26 113.93 2c44 n ASN 146 Ca -0.02 -2.24 -0.05 0.00 -0.03 0.00 0.00 54.58 52.23 2c44 n ASN 146 Cb 0.21 -0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 38.91 2c44 n ASN 146 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c44 n GLY 147 N 0.96 0.75 3.49 7.41 0.00 -0.10 -5.02 105.19 112.68 2c44 n GLY 147 Ca 0.18 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 2c44 n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c44 s THR 149 N 0.72 4.45 0.22 0.00 2.01 -1.11 -2.74 115.64 119.19 2c44 s THR 149 Ca -0.00 1.38 0.11 0.00 0.31 0.00 0.00 61.69 63.49 2c44 s THR 149 Cb -0.14 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 2c44 s THR 149 CO 0.02 -0.41 -0.19 0.68 -0.69 0.00 0.00 174.62 174.03 2c44 s VAL 150 N -2.29 2.61 -0.11 3.82 -7.23 -1.26 -0.73 120.40 115.20 2c44 s VAL 150 Ca 0.61 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.65 2c44 s VAL 150 Cb -0.09 -2.31 0.06 0.00 0.56 0.00 0.00 36.38 34.60 2c44 s VAL 150 CO 0.18 -0.23 0.22 -0.13 -0.31 0.00 0.00 175.10 174.83 2c44 s ARG 151 N -3.04 0.10 -0.26 4.82 1.81 -0.63 -4.91 118.95 116.83 2c44 s ARG 151 Ca 0.25 0.66 -0.18 0.00 -1.72 0.00 0.00 55.73 54.74 2c44 s ARG 151 Cb -0.07 -0.14 -0.02 0.00 -0.45 0.00 0.00 34.95 34.27 2c44 s ARG 151 CO 0.13 -0.29 0.53 -0.80 -0.68 0.00 0.00 175.30 174.20 2c44 s ASN 152 N 2.31 6.45 -0.95 0.23 0.01 -1.26 -2.63 114.94 119.10 2c44 s ASN 152 Ca 0.02 0.53 -0.02 0.00 -0.71 0.00 0.00 52.86 52.68 2c44 s ASN 152 Cb -0.12 -2.29 0.28 0.00 0.41 0.00 0.00 41.25 39.53 2c44 s ASN 152 CO -0.07 -0.31 1.18 1.33 -1.51 0.00 0.00 177.10 177.72 2c44 n VAL 153 N 5.18 4.26 -2.76 1.60 0.24 0.07 -4.95 118.33 121.96 2c44 n VAL 153 Ca -0.04 -5.61 -0.25 0.00 -2.04 0.00 0.00 64.34 56.40 2c44 n VAL 153 Cb 0.50 -2.17 0.01 0.00 -1.47 0.00 0.00 33.84 30.71 2c44 n VAL 153 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 2c44 s TYR 154 N -2.41 3.35 0.50 6.34 -0.85 -1.25 -0.53 117.35 122.50 2c44 s TYR 154 Ca 0.33 0.51 -0.11 0.00 -0.52 0.00 0.00 57.07 57.28 2c44 s TYR 154 Cb 0.04 -2.39 -0.05 0.00 0.38 0.00 0.00 41.96 39.94 2c44 s TYR 154 CO 0.03 -0.43 0.88 0.96 -1.52 0.00 0.00 175.55 175.48 2c44 s ILE 155 N -2.71 4.74 0.44 -3.49 -4.36 -1.25 -4.55 121.20 110.03 2c44 s ILE 155 Ca 0.49 0.71 0.22 0.00 -0.26 0.00 0.00 60.65 61.81 2c44 s ILE 155 Cb -0.10 -3.80 0.42 0.00 1.25 0.00 0.00 42.46 40.23 2c44 s ILE 155 CO 0.42 -0.79 1.82 0.07 0.24 0.00 0.00 174.94 176.69 2c44 h LYS 156 N 0.54 0.30 0.00 0.37 2.10 -1.97 -0.72 116.57 117.19 2c44 h LYS 156 Ca -0.46 -0.02 -0.07 0.00 -2.00 0.00 0.00 60.65 58.10 2c44 h LYS 156 Cb 1.19 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 32.45 2c44 h LYS 156 CO 0.62 0.20 -0.31 0.93 -2.00 0.00 0.00 179.45 178.89 2c44 h GLU 157 N 0.31 0.00 -0.86 0.07 3.07 -1.95 -3.39 114.58 111.83 2c44 h GLU 157 Ca 0.52 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 59.47 2c44 h GLU 157 Cb 1.49 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 29.29 2c44 h GLU 157 CO -0.18 0.31 -0.48 0.00 -1.40 0.00 0.00 179.01 177.25 2c44 n ALA 158 N -2.19 -0.49 -1.12 3.43 0.00 -0.28 -1.71 120.51 118.15 2c44 n ALA 158 Ca 0.02 0.75 -0.10 0.00 0.00 0.00 0.00 53.44 54.11 2c44 n ALA 158 Cb 0.63 -0.15 0.27 0.00 0.00 0.00 0.00 19.45 20.19 2c44 n ALA 158 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2c44 n PHE 159 N -5.10 2.50 -3.21 0.00 3.01 -1.26 -4.79 117.46 108.62 2c44 n PHE 159 Ca 0.03 -1.39 -0.46 0.00 1.01 0.00 0.00 57.45 56.63 2c44 n PHE 159 Cb 0.24 -0.74 -0.02 0.00 -0.01 0.00 0.00 39.48 38.95 2c44 n PHE 159 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2c44 s ASP 160 N -1.23 6.67 0.00 4.37 -1.08 -0.69 -4.86 116.67 119.84 2c44 s ASP 160 Ca 0.55 -2.41 0.10 0.00 -0.52 0.00 0.00 52.55 50.26 2c44 s ASP 160 Cb 0.45 -2.27 0.47 0.00 -1.46 0.00 0.00 42.92 40.11 2c44 s ASP 160 CO 0.12 -0.75 1.20 0.35 0.52 0.00 0.00 175.17 176.61 2c44 n THR 161 N 4.53 0.85 0.96 1.71 -2.24 -1.26 -1.94 114.28 116.89 2c44 n THR 161 Ca 0.14 0.21 0.11 0.00 -2.27 0.00 0.00 64.05 62.24 2c44 n THR 161 Cb 0.47 -1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 67.62 2c44 n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c44 n GLY 162 N -0.48 -1.07 3.37 3.38 0.00 -1.26 -4.63 105.19 104.50 2c44 n GLY 162 Ca 0.04 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 2c44 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c44 s VAL 163 N -3.02 2.33 -0.15 1.61 1.01 -0.82 -5.13 120.40 116.23 2c44 s VAL 163 Ca 0.08 -1.26 -0.09 0.00 0.00 0.00 0.00 61.98 60.70 2c44 s VAL 163 Cb 0.16 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.59 2c44 s VAL 163 CO 0.83 0.41 0.17 0.00 0.00 0.00 0.00 175.10 176.50 2c44 s ARG 164 N -1.16 3.88 -0.05 2.72 3.03 -1.26 -4.86 118.95 121.25 2c44 s ARG 164 Ca 0.12 -0.11 -0.05 0.00 2.03 0.00 0.00 55.73 57.72 2c44 s ARG 164 Cb -0.10 -3.32 0.02 0.00 -1.03 0.00 0.00 34.95 30.52 2c44 s ARG 164 CO 0.02 0.51 0.14 -0.47 -1.13 0.00 0.00 175.30 174.37 2c44 s TYR 165 N -0.27 -0.15 0.34 5.89 5.04 -1.26 -5.08 117.35 121.86 2c44 s TYR 165 Ca 0.13 0.38 0.02 0.00 -2.44 0.00 0.00 57.07 55.15 2c44 s TYR 165 Cb -0.12 0.04 0.61 0.00 0.35 0.00 0.00 41.96 42.84 2c44 s TYR 165 CO 0.02 -0.08 2.00 -0.44 -1.34 0.00 0.00 175.55 175.71 2c44 h ASP 166 N 6.06 0.77 -2.16 4.32 5.19 -1.98 -3.36 116.42 125.26 2c44 h ASP 166 Ca -0.27 -0.02 -0.57 0.00 -0.62 0.00 0.00 57.03 55.55 2c44 h ASP 166 Cb 1.19 -0.19 -0.39 0.00 0.18 0.00 0.00 39.33 40.12 2c44 h ASP 166 CO 0.42 0.55 -1.00 0.49 -3.12 0.00 0.00 179.24 176.58 2c44 n PHE 167 N -4.44 0.05 0.66 4.55 3.01 -1.26 -4.70 117.46 115.32 2c44 n PHE 167 Ca 0.07 -3.59 0.07 0.00 1.01 0.00 0.00 57.45 55.01 2c44 n PHE 167 Cb 0.05 -0.23 0.35 0.00 -0.01 0.00 0.00 39.48 39.65 2c44 n PHE 167 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2c44 n LYS 168 N 1.74 0.19 0.00 -1.08 5.02 -1.24 -2.00 118.16 120.79 2c44 n LYS 168 Ca 0.24 0.16 0.13 0.00 -2.02 0.00 0.00 58.31 56.82 2c44 n LYS 168 Cb 0.50 -1.50 0.39 0.00 -0.02 0.00 0.00 35.03 34.39 2c44 n LYS 168 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c44 n GLY 169 N -0.09 -0.36 3.63 0.72 0.00 -0.66 -4.41 105.19 104.01 2c44 n GLY 169 Ca 0.06 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 2c44 n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c44 n ASN 170 N -0.33 0.66 -4.82 1.61 3.02 -0.85 -4.70 115.26 109.86 2c44 n ASN 170 Ca 0.14 0.70 -0.33 0.00 -0.03 0.00 0.00 54.58 55.06 2c44 n ASN 170 Cb 0.36 -1.42 -0.04 0.00 -0.61 0.00 0.00 39.78 38.08 2c44 n ASN 170 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2c44 s PHE 171 N -1.74 3.20 -0.87 3.10 0.40 -1.26 -3.77 117.98 117.04 2c44 s PHE 171 Ca 0.75 1.54 -0.18 0.00 -0.60 0.00 0.00 56.93 58.44 2c44 s PHE 171 Cb -0.36 -2.93 0.15 0.00 0.51 0.00 0.00 43.02 40.40 2c44 s PHE 171 CO 0.49 -0.57 0.99 0.34 0.70 0.00 0.00 175.22 177.17 2c44 s ASP 172 N -2.48 6.61 0.17 1.36 -1.08 0.31 -4.73 116.67 116.83 2c44 s ASP 172 Ca 0.63 -2.13 -0.19 0.00 -0.52 0.00 0.00 52.55 50.34 2c44 s ASP 172 Cb -0.13 -2.34 0.09 0.00 -1.46 0.00 0.00 42.92 39.08 2c44 s ASP 172 CO 0.24 -0.95 1.65 -0.07 0.52 0.00 0.00 175.17 176.56 2c44 h LEU 173 N 9.70 -0.57 -0.21 -1.34 3.38 -1.93 0.30 115.31 124.65 2c44 h LEU 173 Ca 0.09 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.23 2c44 h LEU 173 Cb 1.04 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 2c44 h LEU 173 CO 1.01 -0.20 0.02 -0.33 0.09 0.00 0.00 178.44 179.03 2c44 h GLU 174 N -0.10 0.09 -0.83 1.13 5.08 -1.99 -1.75 114.58 116.21 2c44 h GLU 174 Ca 0.19 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.58 2c44 h GLU 174 Cb 0.38 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 2c44 h GLU 174 CO -0.44 0.06 0.53 0.78 -1.00 0.00 0.00 179.01 178.94 2c44 h GLY 175 N 0.09 1.22 0.98 -3.84 0.00 -1.69 -0.69 103.07 99.14 2c44 h GLY 175 Ca 0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2c44 h GLY 175 CO -0.14 0.32 0.26 -2.00 0.00 0.00 0.00 176.54 174.98 2c44 h LEU 176 N 1.02 0.59 -0.14 3.11 5.85 0.01 0.11 115.31 125.86 2c44 h LEU 176 Ca 0.34 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 2c44 h LEU 176 Cb 0.05 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2c44 h LEU 176 CO -0.13 0.51 0.03 -0.08 -0.34 0.00 0.00 178.44 178.43 2c44 h GLU 177 N 0.63 0.22 -0.46 1.25 4.81 -0.93 -0.78 114.58 119.32 2c44 h GLU 177 Ca 0.17 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 2c44 h GLU 177 Cb 0.05 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.35 2c44 h GLU 177 CO -0.03 0.40 0.20 0.00 -0.73 0.00 0.00 179.01 178.85 2c44 h ARG 178 N 0.02 0.38 -0.40 1.92 3.08 -0.98 -1.28 114.38 117.10 2c44 h ARG 178 Ca 0.04 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.08 2c44 h ARG 178 Cb 0.28 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2c44 h ARG 178 CO 0.00 0.25 0.25 0.78 -1.07 0.00 0.00 179.97 180.18 2c44 h GLY 179 N 0.39 0.56 1.72 0.04 0.00 -0.59 -0.02 103.07 105.17 2c44 h GLY 179 Ca 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 2c44 h GLY 179 CO -0.18 0.17 0.04 -2.22 0.00 0.00 0.00 176.54 174.34 2c44 h ILE 180 N 0.50 1.14 0.19 2.60 2.04 -0.65 -1.24 117.51 122.08 2c44 h ILE 180 Ca 0.16 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2c44 h ILE 180 Cb -0.01 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2c44 h ILE 180 CO -0.06 0.18 -0.09 -0.33 0.00 0.00 0.00 178.15 177.85 2c44 h GLU 181 N 0.36 -0.24 -0.58 2.37 5.08 -0.44 0.13 114.58 121.26 2c44 h GLU 181 Ca 0.09 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.55 2c44 h GLU 181 Cb 0.19 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.42 2c44 h GLU 181 CO 0.00 0.15 0.21 0.93 -1.00 0.00 0.00 179.01 179.29 2c44 h GLU 182 N -0.73 0.37 0.00 2.33 5.08 -0.75 -2.57 114.58 118.32 2c44 h GLU 182 Ca -0.03 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.13 2c44 h GLU 182 Cb 0.50 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2c44 h GLU 182 CO 0.04 0.25 -0.86 0.28 -1.00 0.00 0.00 179.01 177.72 2c44 h VAL 183 N 0.38 1.54 -0.20 3.13 2.07 -1.26 -3.50 116.25 118.42 2c44 h VAL 183 Ca 0.29 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 65.09 2c44 h VAL 183 Cb 0.35 2.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2c44 h VAL 183 CO -0.30 0.79 0.00 0.61 0.02 0.00 0.00 177.57 178.69 2c44 n GLY 184 N 0.87 0.47 0.54 2.17 0.00 0.45 -4.64 105.19 105.04 2c44 n GLY 184 Ca -0.02 -1.01 0.35 0.00 0.00 0.00 0.00 46.02 45.33 2c44 n GLY 184 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c44 h PRO 185 N 0.00 0.00 0.00 1.61 0.13 -1.82 0.26 132.00 132.18 2c44 h PRO 185 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2c44 h PRO 185 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2c44 h PRO 185 CO 0.00 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 176.86 2c44 h ASN 186 N 0.00 0.00 -0.71 1.44 2.35 -1.90 -3.05 115.58 113.71 2c44 h ASN 186 Ca 0.55 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.30 2c44 h ASN 186 Cb 2.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.80 2c44 h ASN 186 CO -0.01 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.36 2c44 n ASN 187 N -2.96 3.80 -4.20 5.81 3.02 0.91 -3.87 115.26 117.78 2c44 n ASN 187 Ca 0.02 -2.00 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 2c44 n ASN 187 Cb 0.34 -0.47 -0.08 0.00 -0.61 0.00 0.00 39.78 38.95 2c44 n ASN 187 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2c44 s VAL 188 N -1.05 4.20 0.39 2.41 1.01 -1.15 -1.40 120.40 124.81 2c44 s VAL 188 Ca 0.47 -1.93 0.18 0.00 0.00 0.00 0.00 61.98 60.70 2c44 s VAL 188 Cb 0.25 -3.76 0.18 0.00 0.00 0.00 0.00 36.38 33.04 2c44 s VAL 188 CO 0.32 -0.79 1.94 1.55 0.00 0.00 0.00 175.10 178.12 2c44 h PRO 189 N 8.29 0.00 -1.56 2.72 0.13 -1.86 -3.45 132.00 136.26 2c44 h PRO 189 Ca -0.18 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 65.21 2c44 h PRO 189 Cb 1.06 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.03 2c44 h PRO 189 CO 0.84 0.24 0.78 1.52 -0.23 0.00 0.00 178.00 181.15 2c44 s TYR 190 N -4.29 -0.12 -0.09 1.56 -0.85 -1.26 -4.31 117.35 107.99 2c44 s TYR 190 Ca -0.03 0.05 0.03 0.00 -0.52 0.00 0.00 57.07 56.60 2c44 s TYR 190 Cb 0.14 0.53 0.01 0.00 0.38 0.00 0.00 41.96 43.02 2c44 s TYR 190 CO 0.68 -0.27 -0.19 0.42 -1.52 0.00 0.00 175.55 174.67 2c44 s ILE 191 N -2.51 1.64 -0.22 -3.49 1.01 -0.53 -3.02 121.20 114.08 2c44 s ILE 191 Ca 0.10 -0.77 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 2c44 s ILE 191 Cb 0.00 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 2c44 s ILE 191 CO -0.05 0.47 0.03 -0.69 0.00 0.00 0.00 174.94 174.70 2c44 s VAL 192 N 0.52 4.10 -0.40 2.92 1.01 0.29 -0.77 120.40 128.07 2c44 s VAL 192 Ca -0.16 -0.25 -0.15 0.00 0.00 0.00 0.00 61.98 61.41 2c44 s VAL 192 Cb -0.17 -2.89 0.01 0.00 0.00 0.00 0.00 36.38 33.34 2c44 s VAL 192 CO 0.06 0.39 0.32 0.00 0.00 0.00 0.00 175.10 175.87 2c44 s ALA 193 N 1.30 3.47 -0.70 5.51 0.00 0.36 -3.36 121.76 128.35 2c44 s ALA 193 Ca 0.04 -1.63 -0.20 0.00 0.00 0.00 0.00 51.96 50.17 2c44 s ALA 193 Cb -0.15 -2.89 0.10 0.00 0.00 0.00 0.00 23.12 20.18 2c44 s ALA 193 CO 0.02 -1.41 0.92 0.99 0.00 0.00 0.00 175.76 176.27 2c44 s THR 194 N 1.78 4.58 -0.62 0.00 2.01 -1.26 -0.13 115.64 122.01 2c44 s THR 194 Ca 0.07 -0.85 -0.26 0.00 0.31 0.00 0.00 61.69 60.96 2c44 s THR 194 Cb -0.18 -4.64 -0.04 0.00 0.01 0.00 0.00 72.50 67.64 2c44 s THR 194 CO 0.11 -1.36 2.06 -0.63 -0.69 0.00 0.00 174.62 174.11 2c44 s ILE 195 N 3.28 3.24 0.00 1.82 -1.09 -0.59 -2.96 121.20 124.90 2c44 s ILE 195 Ca 0.21 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.70 2c44 s ILE 195 Cb -0.16 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.09 2c44 s ILE 195 CO 0.04 -0.60 0.00 0.41 -1.23 0.00 0.00 174.94 173.56 2c44 n THR 196 N 7.60 -1.13 -2.15 2.92 -1.04 -1.26 -3.83 114.28 115.39 2c44 n THR 196 Ca 0.29 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.87 2c44 n THR 196 Cb 0.52 -1.44 -0.02 0.00 -1.82 0.00 0.00 70.33 67.57 2c44 n THR 196 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2c44 s SER 197 N 0.00 6.03 0.08 8.00 0.15 0.44 -4.81 113.70 123.59 2c44 s SER 197 Ca 0.00 1.03 -0.33 0.00 0.70 0.00 0.00 55.95 57.35 2c44 s SER 197 Cb 0.00 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 61.61 2c44 s SER 197 CO 0.00 -1.64 1.61 -1.13 1.20 0.00 0.00 173.24 173.27 2c44 h ASN 198 N 12.11 -0.95 0.17 5.45 -0.73 -1.87 0.13 115.58 129.89 2c44 h ASN 198 Ca -0.31 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 57.89 2c44 h ASN 198 Cb 1.14 0.29 -0.00 0.00 0.27 0.00 0.00 38.32 40.01 2c44 h ASN 198 CO 1.07 -0.57 -0.16 0.28 -0.37 0.00 0.00 177.43 177.67 2c44 h SER 199 N -0.90 0.00 0.62 1.15 0.02 -1.90 -0.60 113.55 111.94 2c44 h SER 199 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2c44 h SER 199 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2c44 h SER 199 CO 0.05 0.16 0.00 0.00 -1.14 0.00 0.00 176.83 175.90 2c44 n ALA 200 N -2.50 1.69 0.00 3.77 0.00 -1.14 -4.81 120.51 117.51 2c44 n ALA 200 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2c44 n ALA 200 Cb 0.23 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2c44 n ALA 200 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c44 n GLY 201 N 0.06 1.55 2.76 0.00 0.00 -0.27 -4.54 105.19 104.74 2c44 n GLY 201 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 2c44 n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c44 n GLY 202 N -0.27 -0.25 3.79 -0.02 0.00 0.42 -4.08 105.19 104.79 2c44 n GLY 202 Ca 0.00 -0.07 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2c44 n GLY 202 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c44 s GLN 203 N -5.47 4.41 0.64 1.61 -1.52 -0.98 -2.07 119.66 116.28 2c44 s GLN 203 Ca 0.25 0.98 -0.14 0.00 -1.95 0.00 0.00 55.36 54.50 2c44 s GLN 203 Cb -0.11 -3.24 -0.01 0.00 -0.22 0.00 0.00 33.01 29.43 2c44 s GLN 203 CO 0.31 0.59 1.06 -1.25 -0.25 0.00 0.00 175.29 175.76 2c44 s PRO 204 N -1.16 3.09 -0.18 2.91 0.04 -1.26 -0.42 135.00 138.02 2c44 s PRO 204 Ca 0.33 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.50 2c44 s PRO 204 Cb -0.21 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.32 2c44 s PRO 204 CO 0.23 -0.99 -0.11 0.08 0.04 0.00 0.00 177.00 176.26 2c44 s VAL 205 N -2.65 3.02 0.65 -0.36 1.01 -1.26 -1.65 120.40 119.17 2c44 s VAL 205 Ca 0.62 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2c44 s VAL 205 Cb -0.16 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.90 2c44 s VAL 205 CO 0.44 0.48 1.12 -0.94 0.00 0.00 0.00 175.10 176.20 2c44 s SER 206 N 0.97 5.08 0.23 3.32 1.04 -1.26 -4.90 113.70 118.19 2c44 s SER 206 Ca -0.01 2.05 -0.02 0.00 0.48 0.00 0.00 55.95 58.44 2c44 s SER 206 Cb -0.15 -2.56 0.24 0.00 0.10 0.00 0.00 66.02 63.66 2c44 s SER 206 CO -0.01 -1.65 1.64 0.25 0.98 0.00 0.00 173.24 174.45 2c44 h LEU 207 N 0.10 0.66 -0.63 2.42 5.85 -1.97 -2.29 115.31 119.45 2c44 h LEU 207 Ca -0.47 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.00 2c44 h LEU 207 Cb 1.25 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 2c44 h LEU 207 CO 0.54 0.91 0.41 0.00 -0.34 0.00 0.00 178.44 179.96 2c44 h ALA 208 N 1.13 0.80 -0.86 1.25 0.00 -2.00 -1.26 119.26 118.33 2c44 h ALA 208 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 208 Cb 0.77 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2c44 h ALA 208 CO 0.06 0.25 0.52 -0.97 0.00 0.00 0.00 179.25 179.11 2c44 h ASN 209 N 0.86 1.03 -0.65 0.00 -0.73 -1.86 -1.56 115.58 112.67 2c44 h ASN 209 Ca 0.23 -0.07 -0.07 0.00 1.87 0.00 0.00 56.30 58.26 2c44 h ASN 209 Cb -0.08 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.22 2c44 h ASN 209 CO -0.05 0.79 0.13 -0.07 -0.37 0.00 0.00 177.43 177.87 2c44 h LEU 210 N 1.18 1.01 -0.08 0.34 3.38 -0.87 -0.17 115.31 120.10 2c44 h LEU 210 Ca 0.31 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2c44 h LEU 210 Cb -0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.43 2c44 h LEU 210 CO -0.06 1.00 0.05 0.11 0.09 0.00 0.00 178.44 179.63 2c44 h LYS 211 N 0.98 0.11 -0.33 1.13 1.57 -0.74 0.13 116.57 119.42 2c44 h LYS 211 Ca 0.20 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.99 2c44 h LYS 211 Cb 0.40 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2c44 h LYS 211 CO 0.01 0.11 0.19 0.00 -0.57 0.00 0.00 179.45 179.18 2c44 h ALA 212 N 0.99 0.41 -0.27 3.86 0.00 -1.12 -0.18 119.26 122.95 2c44 h ALA 212 Ca 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2c44 h ALA 212 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2c44 h ALA 212 CO -0.01 -0.17 0.17 1.98 0.00 0.00 0.00 179.25 181.22 2c44 h MET 213 N 0.39 0.37 -0.22 0.00 1.85 -0.76 -1.59 114.93 114.96 2c44 h MET 213 Ca 0.13 -0.03 -0.03 0.00 -0.61 0.00 0.00 59.70 59.16 2c44 h MET 213 Cb 0.00 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 31.94 2c44 h MET 213 CO -0.06 0.28 -0.01 -0.92 -0.40 0.00 0.00 176.91 175.80 2c44 h TYR 214 N 0.35 0.33 -0.46 1.39 3.20 -0.48 -1.03 116.97 120.26 2c44 h TYR 214 Ca 0.10 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 2c44 h TYR 214 Cb -0.00 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 2c44 h TYR 214 CO -0.05 0.35 0.14 1.03 -1.64 0.00 0.00 178.16 177.99 2c44 h SER 215 N 0.32 0.67 -0.47 -2.11 0.87 -0.39 0.18 113.55 112.63 2c44 h SER 215 Ca 0.07 -0.21 -0.03 0.00 -1.23 0.00 0.00 61.79 60.40 2c44 h SER 215 Cb 0.23 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2c44 h SER 215 CO 0.01 0.70 0.18 0.40 -0.53 0.00 0.00 176.83 177.58 2c44 h ILE 216 N 0.61 1.21 -0.71 2.23 2.04 -0.58 -2.01 117.51 120.31 2c44 h ILE 216 Ca 0.15 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 2c44 h ILE 216 Cb 0.27 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2c44 h ILE 216 CO -0.00 0.25 0.32 0.00 0.00 0.00 0.00 178.15 178.72 2c44 h ALA 217 N 1.02 0.91 -0.81 1.87 0.00 -0.80 -2.43 119.26 119.03 2c44 h ALA 217 Ca 0.16 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2c44 h ALA 217 Cb 0.21 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2c44 h ALA 217 CO -0.01 0.49 0.53 1.57 0.00 0.00 0.00 179.25 181.83 2c44 h LYS 218 N 0.99 1.08 -0.62 0.00 -0.00 -0.44 0.12 116.57 117.70 2c44 h LYS 218 Ca 0.24 -0.07 0.11 0.00 -0.00 0.00 0.00 60.65 60.93 2c44 h LYS 218 Cb 0.15 -0.24 -0.08 0.00 -0.00 0.00 0.00 32.23 32.05 2c44 h LYS 218 CO -0.03 0.72 0.16 -0.22 -0.00 0.00 0.00 179.45 180.09 2c44 h LYS 219 N 1.10 0.29 -0.57 0.07 3.64 -0.87 -0.83 116.57 119.39 2c44 h LYS 219 Ca 0.30 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2c44 h LYS 219 Cb -0.11 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 2c44 h LYS 219 CO -0.06 0.19 0.00 0.66 -2.27 0.00 0.00 179.45 177.97 2c44 n TYR 220 N -5.09 0.76 -3.72 1.91 4.02 -0.97 -4.95 117.16 109.12 2c44 n TYR 220 Ca 0.09 -0.38 -0.24 0.00 -0.01 0.00 0.00 57.90 57.37 2c44 n TYR 220 Cb 0.33 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.69 2c44 n TYR 220 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2c44 n ASP 221 N 1.37 -3.02 -4.62 7.72 2.03 0.21 -4.95 116.55 115.29 2c44 n ASP 221 Ca 0.21 -0.75 -0.36 0.00 0.52 0.00 0.00 54.79 54.41 2c44 n ASP 221 Cb 0.55 -4.25 -0.10 0.00 -0.72 0.00 0.00 41.12 36.59 2c44 n ASP 221 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2c44 s ILE 222 N -3.48 5.16 0.28 5.18 1.01 -0.01 -5.01 121.20 124.33 2c44 s ILE 222 Ca 0.28 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.74 2c44 s ILE 222 Cb -0.13 -3.41 -0.13 0.00 0.01 0.00 0.00 42.46 38.80 2c44 s ILE 222 CO 0.80 0.34 1.41 -2.65 0.00 0.00 0.00 174.94 174.84 2c44 n PRO 223 N 4.40 2.21 -3.97 2.79 -0.02 -1.26 -4.61 135.00 134.54 2c44 n PRO 223 Ca -0.15 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 61.77 2c44 n PRO 223 Cb 0.52 -2.44 -0.15 0.00 -0.02 0.00 0.00 33.50 31.41 2c44 n PRO 223 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c44 s VAL 224 N -0.37 2.96 -0.23 -1.45 1.01 -1.26 -1.45 120.40 119.61 2c44 s VAL 224 Ca 0.63 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 2c44 s VAL 224 Cb -0.59 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 2c44 s VAL 224 CO 0.53 0.42 0.05 -0.69 0.00 0.00 0.00 175.10 175.42 2c44 s VAL 225 N 1.41 4.30 -0.54 2.92 1.01 0.05 -0.86 120.40 128.69 2c44 s VAL 225 Ca 0.05 -0.18 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 2c44 s VAL 225 Cb -0.14 -2.99 0.06 0.00 0.00 0.00 0.00 36.38 33.31 2c44 s VAL 225 CO -0.06 0.37 0.75 -0.32 0.00 0.00 0.00 175.10 175.84 2c44 s MET 226 N 1.33 3.17 -0.37 2.72 1.75 -0.16 -0.48 119.30 127.26 2c44 s MET 226 Ca 0.05 -0.74 -0.29 0.00 -1.25 0.00 0.00 55.69 53.46 2c44 s MET 226 Cb -0.15 -4.11 0.00 0.00 2.84 0.00 0.00 34.83 33.42 2c44 s MET 226 CO 0.03 -1.37 1.47 0.34 -0.65 0.00 0.00 175.02 174.83 2c44 s ASP 227 N 2.90 6.32 -0.23 1.11 -1.08 0.82 -2.09 116.67 124.42 2c44 s ASP 227 Ca 0.20 1.00 0.14 0.00 -0.52 0.00 0.00 52.55 53.37 2c44 s ASP 227 Cb -0.18 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.40 2c44 s ASP 227 CO 0.13 -1.41 1.59 -1.20 0.52 0.00 0.00 175.17 174.80 2c44 n SER 228 N 8.85 4.52 -0.31 -0.34 7.64 -0.52 -1.55 113.62 131.91 2c44 n SER 228 Ca 0.17 -3.08 0.14 0.00 1.01 0.00 0.00 58.87 57.11 2c44 n SER 228 Cb 0.47 -0.63 0.31 0.00 -1.01 0.00 0.00 64.21 63.36 2c44 n SER 228 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2c44 h ALA 229 N 2.56 1.44 -1.40 -0.43 0.00 -1.80 -2.62 119.26 117.01 2c44 h ALA 229 Ca 0.06 0.17 -0.55 0.00 0.00 0.00 0.00 54.91 54.59 2c44 h ALA 229 Cb 1.77 0.17 -0.42 0.00 0.00 0.00 0.00 17.79 19.31 2c44 h ALA 229 CO 0.40 -0.37 -0.81 0.54 0.00 0.00 0.00 179.25 179.01 2c44 n ARG 230 N -5.07 3.09 -0.05 0.00 1.74 -1.25 -2.14 116.66 112.98 2c44 n ARG 230 Ca 0.23 -4.30 -0.01 0.00 -0.77 0.00 0.00 57.85 52.99 2c44 n ARG 230 Cb 0.68 -2.10 0.25 0.00 -1.02 0.00 0.00 32.46 30.27 2c44 n ARG 230 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2c44 h PHE 231 N 2.62 0.66 -0.33 -1.55 -0.00 -1.63 -2.85 116.94 113.87 2c44 h PHE 231 Ca 0.24 -0.07 -0.04 0.00 -0.00 0.00 0.00 57.97 58.10 2c44 h PHE 231 Cb 0.99 -0.19 -0.01 0.00 -0.00 0.00 0.00 35.95 36.74 2c44 h PHE 231 CO 0.77 0.61 0.05 0.00 -0.00 0.00 0.00 178.31 179.74 2c44 h ALA 232 N 1.43 0.44 -0.68 12.09 0.00 -1.88 -1.15 119.26 129.51 2c44 h ALA 232 Ca 0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2c44 h ALA 232 Cb 0.33 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2c44 h ALA 232 CO 0.01 0.14 0.23 0.93 0.00 0.00 0.00 179.25 180.57 2c44 h GLU 233 N 0.38 1.03 -0.72 0.00 5.08 -1.89 -1.15 114.58 117.32 2c44 h GLU 233 Ca 0.10 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2c44 h GLU 233 Cb 0.36 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2c44 h GLU 233 CO 0.01 0.86 0.31 -0.97 -1.00 0.00 0.00 179.01 178.22 2c44 h ASN 234 N 1.00 0.97 -0.35 1.42 -1.24 -1.31 -1.40 115.58 114.66 2c44 h ASN 234 Ca 0.23 -0.16 -0.02 0.00 0.71 0.00 0.00 56.30 57.06 2c44 h ASN 234 Cb 0.25 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 2c44 h ASN 234 CO -0.01 0.86 0.16 0.00 -1.29 0.00 0.00 177.43 177.15 2c44 h ALA 235 N 1.15 1.52 -0.23 1.57 0.00 -0.47 -1.47 119.26 121.33 2c44 h ALA 235 Ca 0.24 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2c44 h ALA 235 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2c44 h ALA 235 CO -0.02 0.37 -0.02 -0.92 0.00 0.00 0.00 179.25 178.66 2c44 h TYR 236 N 0.57 0.45 -0.62 0.00 3.20 -0.28 -1.77 116.97 118.52 2c44 h TYR 236 Ca 0.14 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 2c44 h TYR 236 Cb 0.12 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 2c44 h TYR 236 CO 0.01 0.61 0.16 0.74 -1.64 0.00 0.00 178.16 178.03 2c44 h PHE 237 N 0.17 1.00 -0.38 -3.82 0.04 -0.91 -1.11 116.94 111.93 2c44 h PHE 237 Ca 0.06 -0.10 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 2c44 h PHE 237 Cb 0.44 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 2c44 h PHE 237 CO 0.04 0.82 0.23 0.82 -0.60 0.00 0.00 178.31 179.63 2c44 h ILE 238 N 0.93 1.12 -0.10 -0.55 2.04 -1.19 0.25 117.51 120.02 2c44 h ILE 238 Ca 0.20 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 2c44 h ILE 238 Cb 0.32 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2c44 h ILE 238 CO -0.00 0.12 -0.07 0.50 0.00 0.00 0.00 178.15 178.70 2c44 h LYS 239 N 0.50 0.14 0.00 2.37 3.64 -0.65 0.18 116.57 122.75 2c44 h LYS 239 Ca 0.14 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.33 2c44 h LYS 239 Cb -0.00 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2c44 h LYS 239 CO -0.03 0.22 -1.41 1.04 -2.27 0.00 0.00 179.45 177.01 2c44 n GLN 240 N -4.38 0.62 -0.02 1.90 1.13 -0.48 -4.02 117.38 112.13 2c44 n GLN 240 Ca -0.01 0.22 -0.01 0.00 -1.94 0.00 0.00 57.00 55.25 2c44 n GLN 240 Cb 0.19 -1.81 -0.05 0.00 0.11 0.00 0.00 30.24 28.68 2c44 n GLN 240 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2c44 n ARG 241 N -2.87 2.06 -3.11 -1.09 1.74 0.83 -4.92 116.66 109.30 2c44 n ARG 241 Ca -0.09 -0.02 -0.44 0.00 -0.77 0.00 0.00 57.85 56.52 2c44 n ARG 241 Cb 0.83 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 31.04 2c44 n ARG 241 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2c44 s GLU 242 N -2.27 3.08 0.18 5.56 2.12 0.62 -4.96 118.70 123.03 2c44 s GLU 242 Ca -0.03 -1.13 -0.06 0.00 0.36 0.00 0.00 54.97 54.11 2c44 s GLU 242 Cb 0.03 -4.20 0.29 0.00 0.26 0.00 0.00 34.13 30.51 2c44 s GLU 242 CO 0.28 -1.44 1.04 0.00 -0.54 0.00 0.00 175.26 174.60 2c44 n ALA 243 N 6.36 0.14 0.18 6.30 0.00 -1.26 -0.55 120.51 131.68 2c44 n ALA 243 Ca -0.08 0.73 0.18 0.00 0.00 0.00 0.00 53.44 54.27 2c44 n ALA 243 Cb 0.44 -0.43 0.81 0.00 0.00 0.00 0.00 19.45 20.27 2c44 n ALA 243 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2c44 h GLU 244 N 0.00 0.00 -0.22 0.00 4.81 -1.93 -2.80 114.58 114.44 2c44 h GLU 244 Ca 0.31 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2c44 h GLU 244 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2c44 h GLU 244 CO -0.69 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.25 2c44 n TYR 245 N -3.78 0.30 -0.35 0.92 4.01 0.29 -4.71 117.16 113.84 2c44 n TYR 245 Ca 0.03 -0.46 0.24 0.00 -0.16 0.00 0.00 57.90 57.55 2c44 n TYR 245 Cb 0.39 -0.03 0.49 0.00 -0.31 0.00 0.00 39.34 39.88 2c44 n TYR 245 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2c44 h LYS 246 N 1.43 0.34 -0.68 -0.72 6.56 -1.47 0.05 116.57 122.09 2c44 h LYS 246 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2c44 h LYS 246 Cb 0.63 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.22 2c44 h LYS 246 CO 0.00 0.22 0.00 -0.25 -2.06 0.00 0.00 179.45 177.36 2c44 n ASP 247 N -4.89 4.46 -4.91 0.86 8.00 -1.26 -4.90 116.55 113.91 2c44 n ASP 247 Ca 0.30 -2.30 -0.27 0.00 0.71 0.00 0.00 54.79 53.23 2c44 n ASP 247 Cb 0.99 -0.55 -0.01 0.00 -0.02 0.00 0.00 41.12 41.53 2c44 n ASP 247 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2c44 s TRP 248 N -1.59 3.54 0.47 1.24 0.52 0.00 -5.09 118.94 118.03 2c44 s TRP 248 Ca 0.50 0.71 -0.03 0.00 0.02 0.00 0.00 56.10 57.30 2c44 s TRP 248 Cb 0.30 -2.20 -0.02 0.00 -1.15 0.00 0.00 33.47 30.39 2c44 s TRP 248 CO 0.27 -0.14 0.74 0.95 0.02 0.00 0.00 176.95 178.79 2c44 s THR 249 N -2.56 4.61 0.25 2.01 -4.23 -1.26 -4.90 115.64 109.57 2c44 s THR 249 Ca 0.46 -0.07 -0.04 0.00 -1.18 0.00 0.00 61.69 60.85 2c44 s THR 249 Cb -0.10 -3.74 0.24 0.00 1.34 0.00 0.00 72.50 70.24 2c44 s THR 249 CO 0.41 -0.65 1.87 0.40 -0.54 0.00 0.00 174.62 176.10 2c44 h ILE 250 N 0.29 1.08 -0.46 2.99 1.08 -1.91 0.05 117.51 120.64 2c44 h ILE 250 Ca -0.47 -0.37 -0.01 0.00 -0.39 0.00 0.00 64.86 63.61 2c44 h ILE 250 Cb 1.22 -0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.85 2c44 h ILE 250 CO 0.61 0.20 0.24 -0.33 -0.69 0.00 0.00 178.15 178.18 2c44 h GLU 251 N 1.09 0.64 -0.41 2.37 3.07 -1.93 -0.62 114.58 118.78 2c44 h GLU 251 Ca 0.40 -0.08 -0.06 0.00 -0.50 0.00 0.00 59.36 59.12 2c44 h GLU 251 Cb 0.14 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2c44 h GLU 251 CO -0.16 0.52 0.03 1.96 -1.40 0.00 0.00 179.01 179.95 2c44 h GLN 252 N 0.60 0.71 -0.74 2.33 4.20 -1.72 -1.47 115.11 119.02 2c44 h GLN 252 Ca 0.16 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 2c44 h GLN 252 Cb 0.07 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 2c44 h GLN 252 CO -0.02 0.77 0.29 0.82 -0.67 0.00 0.00 178.83 180.02 2c44 h ILE 253 N 0.55 1.25 -0.06 2.54 2.04 -0.87 -1.50 117.51 121.46 2c44 h ILE 253 Ca 0.12 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 2c44 h ILE 253 Cb 0.43 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2c44 h ILE 253 CO 0.02 0.32 0.02 0.74 0.00 0.00 0.00 178.15 179.24 2c44 h THR 254 N 1.07 1.18 -0.61 -0.27 2.02 -0.94 0.59 112.91 115.96 2c44 h THR 254 Ca 0.25 -0.55 0.09 0.00 0.77 0.00 0.00 66.41 66.97 2c44 h THR 254 Cb 0.21 1.43 -0.07 0.00 -1.74 0.00 0.00 68.15 67.98 2c44 h THR 254 CO -0.02 0.15 0.25 -0.09 0.37 0.00 0.00 175.52 176.18 2c44 h ARG 255 N -0.10 0.43 0.12 6.66 9.65 -1.05 -1.60 114.38 128.49 2c44 h ARG 255 Ca 0.02 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2c44 h ARG 255 Cb 0.23 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2c44 h ARG 255 CO -0.00 0.28 -0.06 1.49 2.80 0.00 0.00 179.97 184.48 2c44 h GLU 256 N 0.44 -0.16 -0.68 0.20 4.57 -1.10 -3.13 114.58 114.72 2c44 h GLU 256 Ca 0.30 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.64 2c44 h GLU 256 Cb 0.34 0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 28.86 2c44 h GLU 256 CO -0.28 -0.01 0.07 1.15 -1.18 0.00 0.00 179.01 178.76 2c44 h THR 257 N -0.27 0.48 0.00 0.32 2.02 -0.20 -1.71 112.91 113.55 2c44 h THR 257 Ca -0.02 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2c44 h THR 257 Cb 0.22 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2c44 h THR 257 CO 0.03 0.03 0.00 -1.22 0.37 0.00 0.00 175.52 174.73 2c44 n TYR 258 N -5.24 0.00 0.84 3.16 4.01 -0.66 -2.24 117.16 117.02 2c44 n TYR 258 Ca 0.12 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.99 2c44 n TYR 258 Cb 0.41 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 39.85 2c44 n TYR 258 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2c44 n LYS 259 N -0.65 0.11 -1.69 -0.72 5.02 -0.64 -3.92 118.16 115.66 2c44 n LYS 259 Ca 0.05 0.07 -0.33 0.00 -2.02 0.00 0.00 58.31 56.08 2c44 n LYS 259 Cb 0.02 -1.61 0.05 0.00 -0.02 0.00 0.00 35.03 33.48 2c44 n LYS 259 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2c44 n TYR 260 N -1.79 3.09 -3.48 2.13 4.01 -0.95 -4.93 117.16 115.25 2c44 n TYR 260 Ca 0.06 -2.73 -0.11 0.00 -0.16 0.00 0.00 57.90 54.96 2c44 n TYR 260 Cb 0.38 -1.04 -0.02 0.00 -0.31 0.00 0.00 39.34 38.35 2c44 n TYR 260 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2c44 s ALA 261 N -3.80 -1.53 -0.05 -0.72 0.00 -1.25 -4.67 121.76 109.74 2c44 s ALA 261 Ca 0.58 0.37 0.20 0.00 0.00 0.00 0.00 51.96 53.11 2c44 s ALA 261 Cb 0.47 0.88 -0.31 0.00 0.00 0.00 0.00 23.12 24.16 2c44 s ALA 261 CO -0.08 -0.80 0.40 -0.25 0.00 0.00 0.00 175.76 175.02 2c44 n ASP 262 N -0.39 0.33 -3.83 0.00 8.00 -0.04 -4.88 116.55 115.74 2c44 n ASP 262 Ca -0.15 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.28 2c44 n ASP 262 Cb 0.64 1.81 -0.02 0.00 -0.02 0.00 0.00 41.12 43.53 2c44 n ASP 262 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c44 s MET 263 N -3.29 1.71 0.02 -1.24 0.23 -1.07 -1.08 119.30 114.58 2c44 s MET 263 Ca -0.08 -0.94 0.02 0.00 -1.03 0.00 0.00 55.69 53.67 2c44 s MET 263 Cb 0.12 0.59 -0.01 0.00 -1.53 0.00 0.00 34.83 34.00 2c44 s MET 263 CO 0.84 -0.78 -0.07 -0.48 -2.03 0.00 0.00 175.02 172.49 2c44 s LEU 264 N -2.91 2.11 -0.10 0.18 0.05 0.88 -0.98 118.68 117.90 2c44 s LEU 264 Ca 0.11 -0.29 0.02 0.00 0.05 0.00 0.00 54.13 54.01 2c44 s LEU 264 Cb -0.05 -0.28 0.01 0.00 -2.05 0.00 0.00 46.19 43.82 2c44 s LEU 264 CO 0.06 -0.03 -0.15 0.00 -0.55 0.00 0.00 176.35 175.67 2c44 s ALA 265 N -0.63 1.68 -0.00 1.48 0.00 -0.89 -0.90 121.76 122.50 2c44 s ALA 265 Ca -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2c44 s ALA 265 Cb -0.05 -0.81 -0.00 0.00 0.00 0.00 0.00 23.12 22.25 2c44 s ALA 265 CO 0.00 -0.05 -0.02 1.41 0.00 0.00 0.00 175.76 177.11 2c44 s MET 266 N 0.94 0.16 -0.66 0.00 0.00 0.84 -1.44 119.30 119.13 2c44 s MET 266 Ca -0.08 -0.07 -0.17 0.00 0.00 0.00 0.00 55.69 55.37 2c44 s MET 266 Cb -0.15 -0.15 0.13 0.00 0.00 0.00 0.00 34.83 34.66 2c44 s MET 266 CO -0.01 0.04 0.71 0.45 0.00 0.00 0.00 175.02 176.21 2c44 s SER 267 N -0.03 6.34 0.18 1.11 0.15 -1.26 -0.55 113.70 119.63 2c44 s SER 267 Ca 0.01 -1.82 0.14 0.00 0.70 0.00 0.00 55.95 54.98 2c44 s SER 267 Cb -0.01 -2.27 0.71 0.00 -1.71 0.00 0.00 66.02 62.74 2c44 s SER 267 CO -0.00 -0.95 1.43 0.00 1.20 0.00 0.00 173.24 174.92 2c44 n ALA 268 N 5.65 1.15 0.43 5.45 0.00 -0.13 -3.01 120.51 130.05 2c44 n ALA 268 Ca -0.03 0.10 0.03 0.00 0.00 0.00 0.00 53.44 53.54 2c44 n ALA 268 Cb 0.43 -1.21 0.19 0.00 0.00 0.00 0.00 19.45 18.87 2c44 n ALA 268 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2c44 n LYS 269 N -1.94 0.21 0.00 0.00 5.02 -1.20 -3.39 118.16 116.87 2c44 n LYS 269 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2c44 n LYS 269 Cb 0.06 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 2c44 n LYS 269 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2c44 n LYS 270 N -0.98 0.00 0.05 1.97 4.01 -1.16 -0.11 118.16 121.94 2c44 n LYS 270 Ca 0.05 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 57.94 2c44 n LYS 270 Cb 0.02 0.00 0.54 0.00 -0.51 0.00 0.00 35.03 35.08 2c44 n LYS 270 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2c44 h ASP 271 N 0.00 0.25 0.39 4.39 5.19 -1.64 0.15 116.42 125.15 2c44 h ASP 271 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2c44 h ASP 271 Cb 0.00 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2c44 h ASP 271 CO 0.00 0.17 0.00 0.00 -3.12 0.00 0.00 179.24 176.29 2c44 n ALA 272 N -2.53 1.67 -1.50 3.45 0.00 -1.22 -4.34 120.51 116.05 2c44 n ALA 272 Ca 0.04 -0.05 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 2c44 n ALA 272 Cb 0.23 -1.22 -0.07 0.00 0.00 0.00 0.00 19.45 18.39 2c44 n ALA 272 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2c44 n MET 273 N -1.42 -1.21 -3.86 0.00 2.81 0.53 -4.17 117.12 109.79 2c44 n MET 273 Ca 0.04 1.10 -0.30 0.00 -1.81 0.00 0.00 57.70 56.73 2c44 n MET 273 Cb 0.14 -5.34 -0.04 0.00 -0.71 0.00 0.00 33.22 27.27 2c44 n MET 273 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2c44 s VAL 274 N -2.62 5.33 -0.74 2.03 -7.23 -1.23 -4.57 120.40 111.37 2c44 s VAL 274 Ca 0.00 -0.33 0.22 0.00 -1.81 0.00 0.00 61.98 60.06 2c44 s VAL 274 Cb 0.00 -3.64 0.21 0.00 0.56 0.00 0.00 36.38 33.51 2c44 s VAL 274 CO 0.00 0.08 1.67 -0.81 -0.31 0.00 0.00 175.10 175.73 2c44 n PRO 275 N 0.12 0.12 -3.63 4.82 -0.04 -1.26 -4.09 135.00 131.04 2c44 n PRO 275 Ca -0.05 0.29 -0.13 0.00 -0.04 0.00 0.00 63.50 63.57 2c44 n PRO 275 Cb 0.52 -1.71 -0.07 0.00 -0.04 0.00 0.00 33.50 32.20 2c44 n PRO 275 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2c44 s MET 276 N -3.15 0.81 0.00 0.54 -2.45 -1.26 -4.62 119.30 109.17 2c44 s MET 276 Ca 0.07 1.01 0.00 0.00 -1.25 0.00 0.00 55.69 55.52 2c44 s MET 276 Cb 0.11 0.38 0.00 0.00 1.25 0.00 0.00 34.83 36.57 2c44 s MET 276 CO 0.40 -0.10 0.00 0.41 1.05 0.00 0.00 175.02 176.77 2c44 n GLY 277 N 2.83 4.44 3.57 2.11 0.00 0.24 -4.85 105.19 113.53 2c44 n GLY 277 Ca -0.15 -0.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 2c44 n GLY 277 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c44 s GLY 278 N 0.00 0.40 -0.04 -0.02 0.00 0.23 -0.95 107.32 106.94 2c44 s GLY 278 Ca 0.00 -0.75 -0.08 0.00 0.00 0.00 0.00 44.72 43.89 2c44 s GLY 278 CO 0.00 -0.56 0.19 1.08 0.00 0.00 0.00 173.10 173.81 2c44 s LEU 279 N -2.99 1.30 -0.23 0.66 1.43 0.29 -2.07 118.68 117.07 2c44 s LEU 279 Ca 0.19 0.12 -0.03 0.00 -1.03 0.00 0.00 54.13 53.38 2c44 s LEU 279 Cb -0.01 0.78 0.07 0.00 0.03 0.00 0.00 46.19 47.06 2c44 s LEU 279 CO 0.06 -0.25 0.06 -0.22 0.23 0.00 0.00 176.35 176.24 2c44 s LEU 280 N -0.70 1.28 0.04 1.79 2.96 -0.30 -0.11 118.68 123.64 2c44 s LEU 280 Ca -0.08 -1.05 0.05 0.00 -0.22 0.00 0.00 54.13 52.82 2c44 s LEU 280 Cb -0.05 -0.60 -0.02 0.00 0.50 0.00 0.00 46.19 46.02 2c44 s LEU 280 CO 0.01 -0.35 -0.14 0.00 -1.32 0.00 0.00 176.35 174.55 2c44 s MET 282 N -1.16 3.00 0.10 0.00 -1.94 -0.25 -0.09 119.30 118.97 2c44 s MET 282 Ca 0.01 -0.53 -0.28 0.00 -1.71 0.00 0.00 55.69 53.19 2c44 s MET 282 Cb -0.08 -2.69 -0.12 0.00 2.01 0.00 0.00 34.83 33.95 2c44 s MET 282 CO 0.01 0.56 1.66 -0.22 -0.01 0.00 0.00 175.02 177.02 2c44 h LYS 283 N 5.60 -0.46 0.00 2.03 3.64 -1.41 -2.13 116.57 123.83 2c44 h LYS 283 Ca -0.44 0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 58.84 2c44 h LYS 283 Cb 1.18 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.08 2c44 h LYS 283 CO 0.55 -0.31 -0.03 -0.40 -2.27 0.00 0.00 179.45 176.99 2c44 n ASP 284 N -5.34 -0.87 -0.27 4.20 5.68 -1.26 -1.92 116.55 116.76 2c44 n ASP 284 Ca -0.08 -2.02 0.28 0.00 -0.50 0.00 0.00 54.79 52.46 2c44 n ASP 284 Cb 0.25 1.57 0.65 0.00 -1.14 0.00 0.00 41.12 42.46 2c44 n ASP 284 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2c44 h ASP 285 N 1.10 0.16 0.00 -1.12 3.04 -2.00 -0.21 116.42 117.39 2c44 h ASP 285 Ca -0.16 0.03 0.00 0.00 -3.24 0.00 0.00 57.03 53.66 2c44 h ASP 285 Cb 0.67 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.96 2c44 h ASP 285 CO 0.21 0.04 0.02 0.77 -2.04 0.00 0.00 179.24 178.24 2c44 h SER 286 N 0.15 0.00 -0.14 4.15 4.64 -2.00 0.56 113.55 120.90 2c44 h SER 286 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 2c44 h SER 286 Cb 1.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 2c44 h SER 286 CO -0.10 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.35 2c44 n PHE 287 N -2.75 0.42 -0.30 4.77 3.72 -0.09 -4.69 117.46 118.54 2c44 n PHE 287 Ca -0.02 -0.84 0.09 0.00 -0.05 0.00 0.00 57.45 56.63 2c44 n PHE 287 Cb 0.08 -0.19 0.31 0.00 -0.94 0.00 0.00 39.48 38.74 2c44 n PHE 287 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 2c44 h PHE 288 N 0.94 0.96 -0.51 1.38 3.57 -0.91 -1.67 116.94 120.71 2c44 h PHE 288 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2c44 h PHE 288 Cb 1.09 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 2c44 h PHE 288 CO 0.22 0.39 0.21 -0.44 -2.23 0.00 0.00 178.31 176.46 2c44 h ASP 289 N 0.85 0.70 0.28 0.41 3.32 -1.84 -0.67 116.42 119.47 2c44 h ASP 289 Ca 0.45 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.25 2c44 h ASP 289 Cb 0.55 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2c44 h ASP 289 CO -0.22 0.67 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.23 2c44 h VAL 290 N 0.68 1.29 0.21 -1.35 -1.51 -1.76 -1.18 116.25 112.64 2c44 h VAL 290 Ca 0.17 -1.38 -0.01 0.00 -1.23 0.00 0.00 66.70 64.25 2c44 h VAL 290 Cb 0.19 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.00 2c44 h VAL 290 CO -0.01 0.41 -0.10 0.22 -1.23 0.00 0.00 177.57 176.85 2c44 h TYR 291 N 0.12 -0.27 0.00 5.19 5.03 -0.55 0.30 116.97 126.80 2c44 h TYR 291 Ca 0.01 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 2c44 h TYR 291 Cb 0.72 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 39.08 2c44 h TYR 291 CO 0.01 -0.14 -0.26 1.79 -1.32 0.00 0.00 178.16 178.24 2c44 h THR 292 N -0.32 0.73 -0.14 1.81 1.35 -0.98 -0.84 112.91 114.53 2c44 h THR 292 Ca -0.03 -1.10 -0.16 0.00 -0.55 0.00 0.00 66.41 64.58 2c44 h THR 292 Cb 0.25 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 2c44 h THR 292 CO 0.05 0.25 -0.58 -0.33 -0.25 0.00 0.00 175.52 174.66 2c44 h GLU 293 N 0.00 0.43 -0.01 4.72 4.39 -0.66 -2.43 114.58 121.02 2c44 h GLU 293 Ca -0.00 -0.29 -0.14 0.00 0.34 0.00 0.00 59.36 59.27 2c44 h GLU 293 Cb 0.67 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 2c44 h GLU 293 CO 0.03 0.89 -0.63 0.00 -1.16 0.00 0.00 179.01 178.14 2c44 h ARG 295 N 0.03 0.69 -0.37 0.00 3.08 -0.90 0.13 114.38 117.05 2c44 h ARG 295 Ca -0.01 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 59.72 2c44 h ARG 295 Cb 1.12 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 2c44 h ARG 295 CO 0.09 0.81 -0.11 1.15 -1.07 0.00 0.00 179.97 180.84 2c44 h THR 296 N 0.62 1.28 0.00 2.04 2.02 -1.22 -2.68 112.91 114.97 2c44 h THR 296 Ca 0.10 -1.20 -0.11 0.00 0.77 0.00 0.00 66.41 65.97 2c44 h THR 296 Cb 0.61 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 2c44 h THR 296 CO 0.04 0.40 -0.54 0.25 0.37 0.00 0.00 175.52 176.04 2c44 h LEU 297 N 0.53 0.00 -0.65 2.58 5.85 -1.27 -3.17 115.31 119.18 2c44 h LEU 297 Ca 0.09 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.71 2c44 h LEU 297 Cb 0.63 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 2c44 h LEU 297 CO 0.04 0.54 -0.06 0.00 -0.34 0.00 0.00 178.44 178.62 2c44 h VAL 299 N 0.89 0.97 0.05 0.00 2.07 -1.45 0.20 116.25 118.99 2c44 h VAL 299 Ca 0.15 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 2c44 h VAL 299 Cb 0.61 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2c44 h VAL 299 CO 0.04 0.11 -0.40 0.58 0.02 0.00 0.00 177.57 177.91 2c44 h VAL 300 N 0.59 1.61 0.08 2.57 2.07 -1.51 -3.35 116.25 118.30 2c44 h VAL 300 Ca 0.29 -2.31 -0.30 0.00 0.82 0.00 0.00 66.70 65.19 2c44 h VAL 300 Cb 0.36 3.13 -0.02 0.00 -1.52 0.00 0.00 31.29 33.24 2c44 h VAL 300 CO -0.09 0.63 -1.57 1.56 0.02 0.00 0.00 177.57 178.13 2c44 h GLN 301 N -0.59 0.16 0.00 1.57 1.08 -1.06 -3.45 115.11 112.82 2c44 h GLN 301 Ca -0.07 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 56.86 2c44 h GLN 301 Cb 1.27 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 2c44 h GLN 301 CO 0.08 0.96 -0.99 0.39 -0.95 0.00 0.00 178.83 178.32 2c44 n GLU 302 N -3.34 0.00 -2.28 1.46 -0.58 0.55 -5.08 120.64 111.37 2c44 n GLU 302 Ca -0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 2c44 n GLU 302 Cb 1.03 -0.73 0.00 0.00 -0.57 0.00 0.00 31.44 31.17 2c44 n GLU 302 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c44 n GLY 303 N 3.22 -1.00 3.66 0.62 0.00 -0.27 -3.51 105.19 107.90 2c44 n GLY 303 Ca 0.00 -1.58 -0.44 0.00 0.00 0.00 0.00 46.02 44.00 2c44 n GLY 303 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2c44 n PHE 304 N 1.39 2.01 0.03 1.61 7.35 -1.26 -3.22 117.46 125.38 2c44 n PHE 304 Ca 0.00 0.54 0.00 0.00 -0.76 0.00 0.00 57.45 57.23 2c44 n PHE 304 Cb 0.00 -2.40 0.01 0.00 0.35 0.00 0.00 39.48 37.44 2c44 n PHE 304 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2c44 n PRO 305 N 1.19 0.01 -0.17 -7.13 -0.04 -1.26 -0.08 135.00 127.51 2c44 n PRO 305 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 2c44 n PRO 305 Cb 0.33 -1.34 0.19 0.00 -0.04 0.00 0.00 33.50 32.64 2c44 n PRO 305 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c44 n THR 306 N -0.84 0.55 0.00 0.52 -2.24 -1.26 -4.25 114.28 106.76 2c44 n THR 306 Ca 0.00 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 2c44 n THR 306 Cb 0.00 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 2c44 n THR 306 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c44 n TYR 307 N 1.23 0.00 -3.77 4.78 4.11 -0.85 -4.54 117.16 118.12 2c44 n TYR 307 Ca 0.17 0.00 -0.27 0.00 -0.00 0.00 0.00 57.90 57.80 2c44 n TYR 307 Cb 0.54 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.81 2c44 n TYR 307 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2c44 n GLY 308 N 0.03 -0.19 0.59 -7.48 0.00 0.89 -0.12 105.19 98.90 2c44 n GLY 308 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2c44 n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c44 n GLY 309 N -1.52 0.80 3.36 -0.02 0.00 -1.23 -1.63 105.19 104.95 2c44 n GLY 309 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2c44 n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c44 s LEU 310 N 0.00 2.34 0.67 0.99 1.43 0.83 -4.46 118.68 120.48 2c44 s LEU 310 Ca 0.00 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 2c44 s LEU 310 Cb 0.00 -1.45 -0.00 0.00 0.03 0.00 0.00 46.19 44.77 2c44 s LEU 310 CO 0.00 0.29 1.06 -1.83 0.23 0.00 0.00 176.35 176.10 2c44 s GLU 311 N -0.43 3.03 0.18 1.70 -1.05 -1.26 -4.79 118.70 116.08 2c44 s GLU 311 Ca 0.05 1.01 -0.22 0.00 -0.15 0.00 0.00 54.97 55.65 2c44 s GLU 311 Cb -0.12 -2.00 0.10 0.00 -0.44 0.00 0.00 34.13 31.67 2c44 s GLU 311 CO 0.01 -1.03 1.58 0.78 0.95 0.00 0.00 175.26 177.55 2c44 h GLY 312 N -0.45 -0.23 0.98 -3.83 0.00 -1.91 0.20 103.07 97.83 2c44 h GLY 312 Ca -0.44 0.49 0.10 0.00 0.00 0.00 0.00 47.33 47.48 2c44 h GLY 312 CO 0.57 -0.19 0.44 -1.33 0.00 0.00 0.00 176.54 176.03 2c44 h GLY 313 N -0.17 0.71 1.61 4.60 0.00 -1.83 -0.73 103.07 107.26 2c44 h GLY 313 Ca 0.22 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 2c44 h GLY 313 CO -0.71 0.13 -0.05 0.00 0.00 0.00 0.00 176.54 175.90 2c44 h ALA 314 N 1.67 1.35 -0.04 3.60 0.00 -1.27 0.66 119.26 125.23 2c44 h ALA 314 Ca 0.30 -0.22 -0.22 0.00 0.00 0.00 0.00 54.91 54.77 2c44 h ALA 314 Cb 0.51 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2c44 h ALA 314 CO -0.09 0.44 -0.89 0.52 0.00 0.00 0.00 179.25 179.22 2c44 h MET 315 N 0.45 0.51 -0.48 0.00 2.86 -0.74 -1.45 114.93 116.08 2c44 h MET 315 Ca 0.09 -0.50 -0.06 0.00 -2.06 0.00 0.00 59.70 57.17 2c44 h MET 315 Cb 0.38 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 2c44 h MET 315 CO 0.02 1.14 0.07 0.93 1.06 0.00 0.00 176.91 180.13 2c44 h GLU 316 N 0.31 0.80 -0.60 1.72 4.39 -1.02 -0.84 114.58 119.35 2c44 h GLU 316 Ca -0.07 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.40 2c44 h GLU 316 Cb 1.52 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 30.05 2c44 h GLU 316 CO 0.16 0.81 0.35 -0.09 -1.16 0.00 0.00 179.01 179.09 2c44 h ARG 317 N 0.67 0.82 -0.38 2.33 2.43 -0.81 -2.59 114.38 116.86 2c44 h ARG 317 Ca 0.15 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.14 2c44 h ARG 317 Cb 0.40 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 2c44 h ARG 317 CO 0.01 0.60 -0.18 1.25 -1.51 0.00 0.00 179.97 180.14 2c44 h LEU 318 N 0.81 0.71 -1.99 3.80 5.85 -1.05 0.60 115.31 124.04 2c44 h LEU 318 Ca 0.21 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.77 2c44 h LEU 318 Cb -0.00 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 2c44 h LEU 318 CO -0.04 0.89 0.18 0.00 -0.34 0.00 0.00 178.44 179.13 2c44 h ALA 319 N 1.17 2.23 0.13 1.25 0.00 -0.77 -1.52 119.26 121.75 2c44 h ALA 319 Ca 0.10 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.66 2c44 h ALA 319 Cb 0.65 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2c44 h ALA 319 CO 0.05 -0.30 -1.82 0.28 0.00 0.00 0.00 179.25 177.46 2c44 h VAL 320 N 0.01 0.77 -0.88 0.00 2.07 -1.13 -3.38 116.25 113.71 2c44 h VAL 320 Ca 0.12 -2.38 0.06 0.00 0.82 0.00 0.00 66.70 65.32 2c44 h VAL 320 Cb 0.47 2.58 -0.06 0.00 -1.52 0.00 0.00 31.29 32.76 2c44 h VAL 320 CO -0.00 0.83 0.55 1.23 0.02 0.00 0.00 177.57 180.20 2c44 h GLY 321 N 0.72 1.32 0.53 2.17 0.00 -0.31 -0.93 103.07 106.57 2c44 h GLY 321 Ca -0.38 -0.40 0.19 0.00 0.00 0.00 0.00 47.33 46.74 2c44 h GLY 321 CO 0.09 0.27 0.53 1.41 0.00 0.00 0.00 176.54 178.85 2c44 h LEU 322 N 1.00 0.22 0.00 3.11 3.38 -1.46 0.13 115.31 121.68 2c44 h LEU 322 Ca 0.38 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.31 2c44 h LEU 322 Cb 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2c44 h LEU 322 CO -0.17 0.10 -0.43 1.88 0.09 0.00 0.00 178.44 179.91 2c44 h TYR 323 N 0.22 0.00 -0.75 1.13 0.05 -1.42 -3.35 116.97 112.86 2c44 h TYR 323 Ca 0.38 0.00 0.14 0.00 0.05 0.00 0.00 58.73 59.30 2c44 h TYR 323 Cb 1.17 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.86 2c44 h TYR 323 CO -0.00 0.60 0.50 -0.44 -1.05 0.00 0.00 178.16 177.77 2c44 h ASP 324 N -1.00 0.40 0.60 3.88 5.19 -0.98 0.11 116.42 124.62 2c44 h ASP 324 Ca -0.08 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 2c44 h ASP 324 Cb 0.68 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.13 2c44 h ASP 324 CO -0.05 0.21 0.00 1.23 -3.12 0.00 0.00 179.24 177.51 2c44 h GLY 325 N 0.43 0.00 -0.80 2.75 0.00 -0.91 -2.82 103.07 101.71 2c44 h GLY 325 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2c44 h GLY 325 CO -0.12 0.00 -0.10 1.03 0.00 0.00 0.00 176.54 177.35 2c44 n MET 326 N -2.42 1.64 -1.69 4.80 2.81 0.39 -4.78 117.12 117.88 2c44 n MET 326 Ca 0.01 -1.15 -0.45 0.00 -1.81 0.00 0.00 57.70 54.31 2c44 n MET 326 Cb 0.20 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.19 2c44 n MET 326 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2c44 n ASN 327 N 0.32 3.56 -0.19 7.83 2.85 -1.07 -4.77 115.26 123.79 2c44 n ASN 327 Ca 0.15 1.04 -0.07 0.00 -0.11 0.00 0.00 54.58 55.59 2c44 n ASN 327 Cb 0.43 -1.48 0.02 0.00 1.24 0.00 0.00 39.78 39.99 2c44 n ASN 327 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2c44 h LEU 328 N 7.11 0.69 -0.92 1.20 5.85 -1.92 -1.20 115.31 126.12 2c44 h LEU 328 Ca -0.45 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.11 2c44 h LEU 328 Cb 1.24 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 2c44 h LEU 328 CO 0.92 0.61 0.34 0.44 -0.34 0.00 0.00 178.44 180.42 2c44 h ASP 329 N 0.71 1.02 0.78 1.25 3.45 -1.99 -1.18 116.42 120.46 2c44 h ASP 329 Ca 0.18 -0.13 -0.04 0.00 0.43 0.00 0.00 57.03 57.47 2c44 h ASP 329 Cb 0.10 -0.26 0.01 0.00 -0.56 0.00 0.00 39.33 38.61 2c44 h ASP 329 CO -0.03 0.88 -0.37 -0.25 -1.57 0.00 0.00 179.24 177.90 2c44 h TRP 330 N 1.10 -0.97 -0.77 4.55 -0.00 -1.87 -1.80 115.95 116.20 2c44 h TRP 330 Ca 0.26 -0.02 0.13 0.00 -0.00 0.00 0.00 58.89 59.26 2c44 h TRP 330 Cb 0.15 0.32 -0.09 0.00 -0.00 0.00 0.00 29.16 29.55 2c44 h TRP 330 CO 0.02 -0.59 0.36 -0.07 -0.00 0.00 0.00 178.44 178.16 2c44 h LEU 331 N -1.13 0.42 -0.69 0.65 3.38 -1.09 0.12 115.31 116.97 2c44 h LEU 331 Ca -0.11 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2c44 h LEU 331 Cb 0.82 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 2c44 h LEU 331 CO 0.18 0.20 0.43 0.00 0.09 0.00 0.00 178.44 179.33 2c44 h ALA 332 N 1.51 0.88 0.38 1.53 0.00 -1.15 -1.47 119.26 120.95 2c44 h ALA 332 Ca 0.41 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2c44 h ALA 332 Cb 0.55 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2c44 h ALA 332 CO -0.34 0.34 -0.18 -0.92 0.00 0.00 0.00 179.25 178.15 2c44 h TYR 333 N 0.94 -0.47 -0.13 0.00 3.20 -0.25 -1.22 116.97 119.05 2c44 h TYR 333 Ca 0.25 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.16 2c44 h TYR 333 Cb -0.05 0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.31 2c44 h TYR 333 CO -0.02 -0.17 -0.31 -0.09 -1.64 0.00 0.00 178.16 175.93 2c44 h ARG 334 N -0.75 -0.38 0.00 1.82 1.12 -0.72 -0.84 114.38 114.63 2c44 h ARG 334 Ca -0.05 0.03 -0.05 0.00 -1.11 0.00 0.00 59.98 58.79 2c44 h ARG 334 Cb 0.51 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 30.55 2c44 h ARG 334 CO 0.09 -0.25 -0.24 0.82 -3.11 0.00 0.00 179.97 177.28 2c44 h ILE 335 N -0.39 1.11 -0.11 1.20 2.04 -1.33 -2.25 117.51 117.78 2c44 h ILE 335 Ca 0.10 -0.83 -0.14 0.00 1.00 0.00 0.00 64.86 64.99 2c44 h ILE 335 Cb 0.54 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2c44 h ILE 335 CO -0.35 0.23 -0.53 0.00 0.00 0.00 0.00 178.15 177.51 2c44 h ALA 336 N 1.76 0.90 -0.37 1.87 0.00 -0.27 -1.87 119.26 121.28 2c44 h ALA 336 Ca -0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2c44 h ALA 336 Cb 0.44 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2c44 h ALA 336 CO 0.03 0.68 0.10 0.37 0.00 0.00 0.00 179.25 180.43 2c44 h GLN 337 N 0.24 0.59 -0.62 0.00 4.15 -0.59 -0.39 115.11 118.49 2c44 h GLN 337 Ca 0.01 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 2c44 h GLN 337 Cb 1.01 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.59 2c44 h GLN 337 CO 0.09 0.62 0.34 0.28 -1.93 0.00 0.00 178.83 178.22 2c44 h VAL 338 N 0.45 1.20 -0.76 2.39 2.07 -1.38 -1.88 116.25 118.34 2c44 h VAL 338 Ca 0.12 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.17 2c44 h VAL 338 Cb 0.28 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 2c44 h VAL 338 CO -0.00 0.22 0.47 -0.61 0.02 0.00 0.00 177.57 177.66 2c44 h GLN 339 N 0.84 0.86 -0.37 1.57 5.75 -1.04 -0.46 115.11 122.26 2c44 h GLN 339 Ca 0.22 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.70 2c44 h GLN 339 Cb 0.05 -0.19 -0.04 0.00 1.07 0.00 0.00 27.48 28.37 2c44 h GLN 339 CO -0.03 0.57 0.15 -0.92 -2.65 0.00 0.00 178.83 175.94 2c44 h TYR 340 N 0.88 0.27 -0.37 3.99 3.20 -0.44 0.12 116.97 124.62 2c44 h TYR 340 Ca 0.32 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.17 2c44 h TYR 340 Cb 0.09 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 2c44 h TYR 340 CO -0.04 0.12 0.11 1.25 -1.64 0.00 0.00 178.16 177.96 2c44 h LEU 341 N 0.31 0.55 -0.49 2.82 5.85 -0.75 -0.21 115.31 123.40 2c44 h LEU 341 Ca 0.16 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2c44 h LEU 341 Cb 0.12 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2c44 h LEU 341 CO -0.15 0.63 0.25 0.58 -0.34 0.00 0.00 178.44 179.41 2c44 h VAL 342 N 0.46 1.18 -0.41 1.05 2.07 -0.78 -0.84 116.25 118.98 2c44 h VAL 342 Ca 0.12 -0.49 -0.09 0.00 0.82 0.00 0.00 66.70 67.06 2c44 h VAL 342 Cb 0.28 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2c44 h VAL 342 CO -0.00 0.20 -0.13 0.44 0.02 0.00 0.00 177.57 178.10 2c44 h ASP 343 N 0.65 0.73 -0.49 0.57 3.32 -0.64 -0.84 116.42 119.71 2c44 h ASP 343 Ca 0.17 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 2c44 h ASP 343 Cb 0.08 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2c44 h ASP 343 CO -0.02 0.88 0.19 1.23 -1.72 0.00 0.00 179.24 179.79 2c44 h GLY 344 N 0.97 0.79 0.92 2.75 0.00 -0.70 -0.78 103.07 107.03 2c44 h GLY 344 Ca 0.11 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 2c44 h GLY 344 CO 0.04 0.41 0.02 1.41 0.00 0.00 0.00 176.54 178.43 2c44 h LEU 345 N 0.65 0.61 -1.61 3.11 3.38 -0.96 -2.69 115.31 117.80 2c44 h LEU 345 Ca 0.16 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c44 h LEU 345 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2c44 h LEU 345 CO -0.01 0.75 0.10 -0.08 0.09 0.00 0.00 178.44 179.28 2c44 h GLU 346 N 0.45 0.35 -0.11 1.13 4.57 -0.97 -1.13 114.58 118.86 2c44 h GLU 346 Ca 0.11 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 2c44 h GLU 346 Cb 0.42 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2c44 h GLU 346 CO 0.01 0.30 -0.32 0.93 -1.18 0.00 0.00 179.01 178.76 2c44 h GLU 347 N 0.36 0.22 -0.45 1.92 3.07 -0.81 -2.55 114.58 116.34 2c44 h GLU 347 Ca 0.09 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2c44 h GLU 347 Cb 0.08 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 2c44 h GLU 347 CO -0.01 0.52 0.00 0.44 -1.40 0.00 0.00 179.01 178.56 2c44 n ILE 348 N -4.11 0.67 -0.46 3.13 -5.35 -0.80 -4.90 119.36 107.55 2c44 n ILE 348 Ca -0.01 -0.57 0.00 0.00 -0.27 0.00 0.00 62.75 61.90 2c44 n ILE 348 Cb 0.40 0.19 0.00 0.00 -1.74 0.00 0.00 39.64 38.49 2c44 n ILE 348 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2c44 n GLY 349 N 1.04 0.74 3.29 3.28 0.00 -0.96 -5.02 105.19 107.56 2c44 n GLY 349 Ca 0.14 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2c44 n GLY 349 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c44 s VAL 350 N -2.00 4.65 0.21 1.61 1.01 -0.49 -5.00 120.40 120.39 2c44 s VAL 350 Ca 0.00 -1.44 -0.30 0.00 0.00 0.00 0.00 61.98 60.23 2c44 s VAL 350 Cb 0.00 -3.91 -0.10 0.00 0.00 0.00 0.00 36.38 32.37 2c44 s VAL 350 CO 0.00 -0.67 1.45 -0.69 0.00 0.00 0.00 175.10 175.20 2c44 s VAL 351 N 1.49 2.76 0.23 2.92 1.01 -1.26 -3.31 120.40 124.25 2c44 s VAL 351 Ca 0.04 0.61 0.03 0.00 0.00 0.00 0.00 61.98 62.66 2c44 s VAL 351 Cb -0.26 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2c44 s VAL 351 CO 0.03 0.08 0.01 0.00 0.00 0.00 0.00 175.10 175.21 2c44 s GLN 353 N -3.88 2.91 0.44 0.00 2.00 -0.39 -4.80 119.66 115.93 2c44 s GLN 353 Ca 0.29 1.56 -0.26 0.00 -2.00 0.00 0.00 55.36 54.96 2c44 s GLN 353 Cb 0.06 -1.95 -0.09 0.00 0.80 0.00 0.00 33.01 31.83 2c44 s GLN 353 CO 0.09 -1.20 1.45 0.00 -0.50 0.00 0.00 175.29 175.13 2c44 n GLN 354 N -2.00 2.36 -1.67 1.67 10.64 -1.26 -4.66 117.38 122.45 2c44 n GLN 354 Ca 0.12 0.84 -0.61 0.00 -1.83 0.00 0.00 57.00 55.51 2c44 n GLN 354 Cb 0.51 -2.65 -0.08 0.00 -0.86 0.00 0.00 30.24 27.16 2c44 n GLN 354 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2c44 n ALA 355 N -0.08 -1.46 -2.20 2.61 0.00 -1.26 -4.96 120.51 113.17 2c44 n ALA 355 Ca 0.04 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2c44 n ALA 355 Cb 0.41 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 17.87 2c44 n ALA 355 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c44 n GLY 356 N 3.36 2.74 0.13 0.00 0.00 -1.26 -5.00 105.19 105.16 2c44 n GLY 356 Ca 0.26 -1.94 -0.19 0.00 0.00 0.00 0.00 46.02 44.14 2c44 n GLY 356 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2c44 h GLY 357 N 0.00 0.27 -0.21 -0.02 0.00 -1.65 -3.43 103.07 98.03 2c44 h GLY 357 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2c44 h GLY 357 CO 0.00 0.61 -0.14 -2.39 0.00 0.00 0.00 176.54 174.62 2c44 n HIS 358 N -3.42 0.00 -3.55 5.60 1.44 -1.26 -4.55 115.22 109.48 2c44 n HIS 358 Ca -0.28 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.35 2c44 n HIS 358 Cb 1.05 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 31.14 2c44 n HIS 358 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2c44 s ALA 359 N -1.05 -1.80 -0.19 1.59 0.00 -1.26 -1.53 121.76 117.52 2c44 s ALA 359 Ca 0.04 0.85 -0.14 0.00 0.00 0.00 0.00 51.96 52.71 2c44 s ALA 359 Cb 0.04 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.58 2c44 s ALA 359 CO 0.15 -0.76 0.31 0.00 0.00 0.00 0.00 175.76 175.47 2c44 s ALA 360 N -3.15 3.58 -0.41 0.00 0.00 -1.03 -4.21 121.76 116.54 2c44 s ALA 360 Ca 0.06 -0.55 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 2c44 s ALA 360 Cb -0.01 -2.48 0.07 0.00 0.00 0.00 0.00 23.12 20.70 2c44 s ALA 360 CO -0.07 -0.11 0.24 -0.06 0.00 0.00 0.00 175.76 175.76 2c44 s PHE 361 N 0.89 3.33 0.15 0.00 0.40 -1.26 -0.55 117.98 120.93 2c44 s PHE 361 Ca 0.16 -1.48 -0.30 0.00 -0.60 0.00 0.00 56.93 54.71 2c44 s PHE 361 Cb -0.14 -2.85 -0.07 0.00 0.51 0.00 0.00 43.02 40.47 2c44 s PHE 361 CO 0.05 -0.82 1.03 0.08 0.70 0.00 0.00 175.22 176.27 2c44 s VAL 362 N 1.43 4.17 -0.99 -0.44 1.01 0.40 -1.26 120.40 124.72 2c44 s VAL 362 Ca 0.03 1.84 -0.20 0.00 0.00 0.00 0.00 61.98 63.65 2c44 s VAL 362 Cb -0.22 -4.17 0.11 0.00 0.00 0.00 0.00 36.38 32.09 2c44 s VAL 362 CO 0.02 0.30 1.27 -0.62 0.00 0.00 0.00 175.10 176.08 2c44 s ASP 363 N -0.08 6.63 0.40 3.32 3.68 -0.59 -0.26 116.67 129.78 2c44 s ASP 363 Ca 0.48 -1.95 0.09 0.00 2.13 0.00 0.00 52.55 53.30 2c44 s ASP 363 Cb -0.26 -2.46 0.88 0.00 -1.45 0.00 0.00 42.92 39.63 2c44 s ASP 363 CO 0.32 -1.18 2.00 0.00 0.13 0.00 0.00 175.17 176.44 2c44 h ALA 364 N 8.95 1.81 -0.27 3.66 0.00 -1.26 -1.31 119.26 130.85 2c44 h ALA 364 Ca 0.19 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2c44 h ALA 364 Cb 1.00 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 2c44 h ALA 364 CO 1.23 0.10 0.03 0.78 0.00 0.00 0.00 179.25 181.39 2c44 h GLY 365 N 0.56 0.29 1.67 0.00 0.00 -1.80 0.46 103.07 104.27 2c44 h GLY 365 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.42 2c44 h GLY 365 CO -0.07 -0.03 -0.58 0.50 0.00 0.00 0.00 176.54 176.37 2c44 h LYS 366 N 0.13 0.34 -0.02 4.80 1.57 -1.70 -2.93 116.57 118.76 2c44 h LYS 366 Ca 0.13 -0.22 -0.20 0.00 -1.87 0.00 0.00 60.65 58.49 2c44 h LYS 366 Cb 0.15 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2c44 h LYS 366 CO -0.19 0.82 -0.84 1.25 -0.57 0.00 0.00 179.45 179.92 2c44 h LEU 367 N 0.26 0.35 -6.01 2.94 5.85 -0.80 -3.36 115.31 114.54 2c44 h LEU 367 Ca -0.00 -0.26 -0.58 0.00 0.84 0.00 0.00 57.88 57.87 2c44 h LEU 367 Cb 1.09 -0.11 -0.41 0.00 0.37 0.00 0.00 40.66 41.60 2c44 h LEU 367 CO 0.10 1.04 -0.74 0.18 -0.34 0.00 0.00 178.44 178.67 2c44 n LEU 368 N -3.72 2.95 0.32 2.25 4.77 0.16 -4.79 117.00 118.94 2c44 n LEU 368 Ca -0.04 -5.30 0.22 0.00 -0.03 0.00 0.00 56.01 50.86 2c44 n LEU 368 Cb 0.78 -0.30 1.11 0.00 -2.33 0.00 0.00 43.42 42.68 2c44 n LEU 368 CO 0.48 2.12 1.15 1.55 -1.33 0.00 0.00 177.39 181.36 2c44 h PRO 369 N 3.89 0.00 0.00 3.23 0.13 -1.68 -2.77 132.00 134.80 2c44 h PRO 369 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2c44 h PRO 369 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 2c44 h PRO 369 CO 0.74 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.12 2c44 n HIS 370 N -3.07 0.86 -3.62 1.56 1.44 -1.26 -4.74 115.22 106.39 2c44 n HIS 370 Ca -0.02 0.27 -0.37 0.00 -2.01 0.00 0.00 57.72 55.59 2c44 n HIS 370 Cb 0.12 -0.95 -0.10 0.00 0.12 0.00 0.00 29.99 29.18 2c44 n HIS 370 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2c44 s ILE 371 N -3.16 5.33 0.41 0.61 1.01 -1.05 -5.06 121.20 119.29 2c44 s ILE 371 Ca 0.09 0.18 -0.25 0.00 0.00 0.00 0.00 60.65 60.66 2c44 s ILE 371 Cb 0.12 -3.52 -0.08 0.00 0.01 0.00 0.00 42.46 38.98 2c44 s ILE 371 CO 0.53 0.29 1.22 -2.16 0.00 0.00 0.00 174.94 174.82 2c44 s PRO 372 N 1.47 4.00 0.34 2.79 0.04 -1.26 -4.73 135.00 137.64 2c44 s PRO 372 Ca 0.07 1.96 0.13 0.00 0.04 0.00 0.00 61.00 63.20 2c44 s PRO 372 Cb -0.15 -2.69 0.99 0.00 0.04 0.00 0.00 34.50 32.69 2c44 s PRO 372 CO 0.08 -0.40 1.71 0.00 0.04 0.00 0.00 177.00 178.42 2c44 h ALA 373 N 2.61 1.92 -0.12 8.56 0.00 -1.97 0.78 119.26 131.04 2c44 h ALA 373 Ca -0.49 0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.60 2c44 h ALA 373 Cb 1.24 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2c44 h ALA 373 CO 0.62 -0.44 0.23 0.38 0.00 0.00 0.00 179.25 180.04 2c44 h ASP 374 N 0.46 0.00 -0.69 0.00 3.04 -1.97 -0.03 116.42 117.22 2c44 h ASP 374 Ca 0.68 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.47 2c44 h ASP 374 Cb 1.45 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.74 2c44 h ASP 374 CO -0.50 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 176.70 2c44 n GLN 375 N -3.40 3.21 -3.49 4.15 6.02 0.27 -4.94 117.38 119.20 2c44 n GLN 375 Ca 0.00 -2.75 -0.16 0.00 -0.01 0.00 0.00 57.00 54.09 2c44 n GLN 375 Cb 0.33 -1.73 0.01 0.00 1.02 0.00 0.00 30.24 29.86 2c44 n GLN 375 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2c44 n PHE 376 N 1.40 -2.40 0.00 1.08 3.01 -0.03 -0.98 117.46 119.55 2c44 n PHE 376 Ca 0.25 0.90 0.08 0.00 1.01 0.00 0.00 57.45 59.69 2c44 n PHE 376 Cb 0.75 -3.40 0.49 0.00 -0.01 0.00 0.00 39.48 37.31 2c44 n PHE 376 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2c44 h PRO 377 N -0.23 0.39 -0.03 -1.08 0.13 -1.80 -1.84 132.00 127.55 2c44 h PRO 377 Ca -0.39 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.62 2c44 h PRO 377 Cb 1.24 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2c44 h PRO 377 CO 0.36 0.26 -0.46 0.00 -0.23 0.00 0.00 178.00 177.93 2c44 h ALA 378 N 1.76 1.17 -0.11 -0.56 0.00 -1.88 -0.99 119.26 118.64 2c44 h ALA 378 Ca 0.18 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 2c44 h ALA 378 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2c44 h ALA 378 CO -0.04 0.60 -0.75 1.96 0.00 0.00 0.00 179.25 181.02 2c44 h GLN 379 N 0.06 0.55 -0.42 0.00 1.08 -1.70 -1.70 115.11 112.99 2c44 h GLN 379 Ca 0.00 -0.45 -0.03 0.00 -1.45 0.00 0.00 58.65 56.72 2c44 h GLN 379 Cb 0.85 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.35 2c44 h GLN 379 CO 0.06 1.08 0.14 0.00 -0.95 0.00 0.00 178.83 179.16 2c44 h ALA 380 N 0.80 0.55 -0.89 3.87 0.00 -1.15 -2.17 119.26 120.27 2c44 h ALA 380 Ca -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2c44 h ALA 380 Cb 1.34 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 2c44 h ALA 380 CO 0.14 0.19 0.59 1.25 0.00 0.00 0.00 179.25 181.41 2c44 h LEU 381 N 0.54 1.03 -0.29 0.00 5.85 -1.11 -0.91 115.31 120.41 2c44 h LEU 381 Ca 0.14 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.84 2c44 h LEU 381 Cb 0.25 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2c44 h LEU 381 CO -0.01 0.75 0.16 0.00 -0.34 0.00 0.00 178.44 179.00 2c44 h ALA 382 N 1.32 0.36 -0.41 1.25 0.00 -0.91 0.67 119.26 121.54 2c44 h ALA 382 Ca 0.33 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 2c44 h ALA 382 Cb -0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2c44 h ALA 382 CO -0.07 -0.22 0.05 0.00 0.00 0.00 0.00 179.25 179.01 2c44 h GLU 384 N 0.61 0.08 -0.62 0.00 4.57 -0.42 -1.53 114.58 117.28 2c44 h GLU 384 Ca 0.13 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 2c44 h GLU 384 Cb 0.32 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.84 2c44 h GLU 384 CO 0.01 0.29 0.33 1.25 -1.18 0.00 0.00 179.01 179.70 2c44 h LEU 385 N -0.14 0.47 0.05 1.64 5.85 -0.59 -1.02 115.31 121.57 2c44 h LEU 385 Ca 0.02 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2c44 h LEU 385 Cb 0.24 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2c44 h LEU 385 CO 0.00 0.31 -0.02 0.22 -0.34 0.00 0.00 178.44 178.61 2c44 h TYR 386 N 0.61 -0.06 -0.60 1.25 3.20 -1.16 -2.13 116.97 118.08 2c44 h TYR 386 Ca 0.28 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.26 2c44 h TYR 386 Cb 0.19 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.40 2c44 h TYR 386 CO -0.09 0.02 0.16 0.87 -1.64 0.00 0.00 178.16 177.48 2c44 h LYS 387 N -0.12 0.29 0.05 1.82 1.57 -0.88 0.22 116.57 119.51 2c44 h LYS 387 Ca -0.01 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2c44 h LYS 387 Cb 0.11 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2c44 h LYS 387 CO 0.01 0.19 -0.03 0.28 -0.57 0.00 0.00 179.45 179.34 2c44 h VAL 388 N 0.30 0.99 0.00 0.50 2.07 -0.88 -3.41 116.25 115.82 2c44 h VAL 388 Ca 0.32 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.70 2c44 h VAL 388 Cb 0.45 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2c44 h VAL 388 CO -0.38 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.24 2c44 n ALA 389 N -2.15 0.98 -1.45 1.67 0.00 -0.83 -5.00 120.51 113.73 2c44 n ALA 389 Ca -0.08 -0.46 -0.02 0.00 0.00 0.00 0.00 53.44 52.88 2c44 n ALA 389 Cb 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.53 2c44 n ALA 389 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c44 n GLY 390 N -0.06 0.44 3.77 0.00 0.00 0.75 -4.81 105.19 105.28 2c44 n GLY 390 Ca 0.00 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.75 2c44 n GLY 390 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c44 s ILE 391 N -2.09 5.43 -0.15 -0.61 1.01 -1.26 -1.35 121.20 122.18 2c44 s ILE 391 Ca 0.00 0.22 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 2c44 s ILE 391 Cb 0.00 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 2c44 s ILE 391 CO 0.00 0.49 -0.06 -0.60 0.00 0.00 0.00 174.94 174.77 2c44 s ARG 392 N -0.03 3.59 0.29 2.79 3.52 -0.81 -2.98 118.95 125.31 2c44 s ARG 392 Ca 0.10 -0.56 0.03 0.00 -0.13 0.00 0.00 55.73 55.18 2c44 s ARG 392 Cb -0.11 -2.84 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 2c44 s ARG 392 CO 0.00 0.25 0.16 0.00 -0.81 0.00 0.00 175.30 174.90 2c44 s ALA 393 N 0.33 1.81 0.18 6.12 0.00 -1.26 0.04 121.76 128.98 2c44 s ALA 393 Ca -0.05 -1.79 0.11 0.00 0.00 0.00 0.00 51.96 50.22 2c44 s ALA 393 Cb -0.15 1.22 -0.04 0.00 0.00 0.00 0.00 23.12 24.15 2c44 s ALA 393 CO 0.04 -0.54 -0.23 0.14 0.00 0.00 0.00 175.76 175.17 2c44 s VAL 394 N -3.68 2.22 0.00 0.00 -7.23 -1.14 -4.80 120.40 105.77 2c44 s VAL 394 Ca 0.37 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.50 2c44 s VAL 394 Cb 0.05 -2.04 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 2c44 s VAL 394 CO 0.18 -0.13 0.28 -1.83 -0.31 0.00 0.00 175.10 173.28 2c44 s GLU 395 N -2.60 3.60 -0.52 4.82 4.04 -1.26 0.12 118.70 126.89 2c44 s GLU 395 Ca 0.19 -0.04 0.07 0.00 0.04 0.00 0.00 54.97 55.23 2c44 s GLU 395 Cb -0.08 -3.09 0.27 0.00 0.02 0.00 0.00 34.13 31.25 2c44 s GLU 395 CO 0.09 0.65 0.69 -0.89 -1.84 0.00 0.00 175.26 173.96 2c44 n ILE 396 N 1.19 1.16 0.00 1.83 2.08 0.12 -4.68 119.36 121.06 2c44 n ILE 396 Ca -0.12 -4.78 0.00 0.00 0.56 0.00 0.00 62.75 58.41 2c44 n ILE 396 Cb 0.53 -1.82 0.00 0.00 -0.75 0.00 0.00 39.64 37.60 2c44 n ILE 396 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2c44 n GLY 397 N 0.88 5.39 0.25 7.39 0.00 -1.26 -2.98 105.19 114.85 2c44 n GLY 397 Ca 0.27 -0.80 -0.04 0.00 0.00 0.00 0.00 46.02 45.45 2c44 n GLY 397 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2c44 h SER 398 N 0.00 0.59 -0.32 1.61 0.02 -1.85 -1.89 113.55 111.72 2c44 h SER 398 Ca 0.00 -0.19 0.04 0.00 -0.84 0.00 0.00 61.79 60.81 2c44 h SER 398 Cb 0.00 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.34 2c44 h SER 398 CO 0.00 0.79 0.08 0.15 -1.14 0.00 0.00 176.83 176.71 2c44 h PHE 399 N 0.53 0.13 -0.09 3.45 -0.00 -1.94 -2.94 116.94 116.09 2c44 h PHE 399 Ca 0.09 0.02 -0.23 0.00 -0.00 0.00 0.00 57.97 57.84 2c44 h PHE 399 Cb 0.62 -0.01 0.01 0.00 -0.00 0.00 0.00 35.95 36.57 2c44 h PHE 399 CO 0.02 0.04 -0.87 1.25 -0.00 0.00 0.00 178.31 178.76 2c44 h LEU 400 N 0.20 0.86 -1.46 0.59 6.46 -1.81 -3.29 115.31 116.85 2c44 h LEU 400 Ca 0.15 -0.61 0.12 0.00 -0.12 0.00 0.00 57.88 57.41 2c44 h LEU 400 Cb 0.15 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 39.77 2c44 h LEU 400 CO -0.18 1.41 0.50 0.25 -0.62 0.00 0.00 178.44 179.80 2c44 h LEU 401 N 0.45 0.53 0.00 2.25 5.85 -1.20 -3.46 115.31 119.72 2c44 h LEU 401 Ca -0.08 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2c44 h LEU 401 Cb 1.50 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2c44 h LEU 401 CO 0.17 0.30 0.00 0.61 -0.34 0.00 0.00 178.44 179.18 2c44 n GLY 402 N -1.48 -1.85 3.82 3.75 0.00 -1.12 -4.91 105.19 103.41 2c44 n GLY 402 Ca 0.14 -1.52 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 2c44 n GLY 402 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c44 s ARG 403 N 0.00 2.81 -0.23 1.61 0.52 -1.26 -1.66 118.95 120.73 2c44 s ARG 403 Ca 0.00 -1.16 -0.29 0.00 -0.52 0.00 0.00 55.73 53.76 2c44 s ARG 403 Cb 0.00 -2.50 -0.02 0.00 0.52 0.00 0.00 34.95 32.95 2c44 s ARG 403 CO 0.00 0.30 1.54 0.34 0.02 0.00 0.00 175.30 177.50 2c44 s ASP 404 N -3.88 6.47 0.45 0.23 -1.08 0.11 -4.77 116.67 114.21 2c44 s ASP 404 Ca 0.35 1.55 0.24 0.00 -0.52 0.00 0.00 52.55 54.18 2c44 s ASP 404 Cb -0.07 -2.53 1.31 0.00 -1.46 0.00 0.00 42.92 40.17 2c44 s ASP 404 CO 0.25 -1.19 1.71 1.55 0.52 0.00 0.00 175.17 178.01 2c44 h PRO 405 N 10.28 0.00 0.00 4.34 0.13 -1.95 1.00 132.00 145.80 2c44 h PRO 405 Ca -0.32 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.49 2c44 h PRO 405 Cb 1.14 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 2c44 h PRO 405 CO 1.01 0.00 -1.96 1.63 -0.23 0.00 0.00 178.00 178.45 2c44 n LYS 406 N -2.46 0.57 -0.02 0.86 4.01 -1.26 -4.61 118.16 115.25 2c44 n LYS 406 Ca -0.02 0.31 -0.17 0.00 -0.51 0.00 0.00 58.31 57.92 2c44 n LYS 406 Cb 0.21 -1.52 -0.08 0.00 -0.51 0.00 0.00 35.03 33.13 2c44 n LYS 406 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2c44 h THR 407 N -1.00 1.31 0.00 -0.18 1.03 -1.90 -3.47 112.91 108.71 2c44 h THR 407 Ca -0.48 -1.94 0.00 0.00 -0.01 0.00 0.00 66.41 63.98 2c44 h THR 407 Cb 1.39 2.11 0.00 0.00 -1.07 0.00 0.00 68.15 70.58 2c44 h THR 407 CO -0.29 0.60 0.00 0.61 -0.01 0.00 0.00 175.52 176.43 2c44 n GLY 408 N 0.74 0.73 3.92 2.99 0.00 0.34 -4.98 105.19 108.94 2c44 n GLY 408 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 2c44 n GLY 408 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c44 s LYS 409 N -0.54 3.51 0.12 1.61 3.01 -1.26 -4.67 119.74 121.52 2c44 s LYS 409 Ca 0.00 -0.35 -0.34 0.00 -1.01 0.00 0.00 55.97 54.26 2c44 s LYS 409 Cb 0.00 -2.89 -0.14 0.00 -1.01 0.00 0.00 37.83 33.79 2c44 s LYS 409 CO 0.00 0.46 1.57 0.94 0.51 0.00 0.00 175.35 178.83 2c44 n GLN 410 N -0.39 1.99 -2.37 1.68 -0.06 -1.26 0.05 117.38 117.02 2c44 n GLN 410 Ca -0.05 0.72 -0.38 0.00 -2.00 0.00 0.00 57.00 55.29 2c44 n GLN 410 Cb 0.53 -2.48 -0.03 0.00 -4.06 0.00 0.00 30.24 24.21 2c44 n GLN 410 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2c44 s LEU 411 N 1.19 4.20 0.32 1.69 1.43 -0.67 -4.78 118.68 122.08 2c44 s LEU 411 Ca 0.81 2.27 -0.29 0.00 -1.03 0.00 0.00 54.13 55.89 2c44 s LEU 411 Cb -0.73 -4.04 -0.10 0.00 0.03 0.00 0.00 46.19 41.36 2c44 s LEU 411 CO 0.41 -0.60 1.22 -2.16 0.23 0.00 0.00 176.35 175.45 2c44 s PRO 412 N -2.29 4.41 -0.09 1.29 0.04 -1.26 -4.92 135.00 132.18 2c44 s PRO 412 Ca 0.56 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.68 2c44 s PRO 412 Cb -0.29 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.18 2c44 s PRO 412 CO 0.36 -0.07 -0.22 0.00 0.04 0.00 0.00 177.00 177.11 2c44 h PRO 414 N 6.51 0.00 -1.59 0.00 0.13 -1.97 -3.45 132.00 131.63 2c44 h PRO 414 Ca -0.24 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.95 2c44 h PRO 414 Cb 1.22 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 2c44 h PRO 414 CO 0.49 0.04 0.49 0.00 -0.23 0.00 0.00 178.00 178.79 2c44 s ALA 415 N -3.86 -1.95 -0.62 -0.56 0.00 -1.26 -4.95 121.76 108.56 2c44 s ALA 415 Ca -0.01 1.72 -0.10 0.00 0.00 0.00 0.00 51.96 53.57 2c44 s ALA 415 Cb 0.11 -1.05 0.16 0.00 0.00 0.00 0.00 23.12 22.34 2c44 s ALA 415 CO 0.53 -0.27 0.51 -1.21 0.00 0.00 0.00 175.76 175.31 2c44 s GLU 416 N -0.46 2.88 -0.03 0.00 0.41 -1.26 -4.30 118.70 115.94 2c44 s GLU 416 Ca 0.00 -2.15 0.01 0.00 -0.41 0.00 0.00 54.97 52.42 2c44 s GLU 416 Cb -0.03 -4.07 -0.03 0.00 -1.78 0.00 0.00 34.13 28.22 2c44 s GLU 416 CO -0.02 -1.23 -0.02 -0.51 -0.49 0.00 0.00 175.26 172.99 2c44 s LEU 417 N 0.69 3.43 -0.30 1.80 1.43 -1.16 -0.75 118.68 123.82 2c44 s LEU 417 Ca 0.12 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.14 2c44 s LEU 417 Cb -0.20 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.12 2c44 s LEU 417 CO -0.03 0.32 0.12 -0.22 0.23 0.00 0.00 176.35 176.76 2c44 s LEU 418 N -1.25 3.91 -0.37 1.79 2.96 0.64 0.15 118.68 126.53 2c44 s LEU 418 Ca 0.16 -0.53 -0.17 0.00 -0.22 0.00 0.00 54.13 53.38 2c44 s LEU 418 Cb -0.11 -1.95 -0.00 0.00 0.50 0.00 0.00 46.19 44.63 2c44 s LEU 418 CO 0.06 -0.17 0.44 -0.60 -1.32 0.00 0.00 176.35 174.77 2c44 s ARG 419 N 1.58 3.47 -1.20 1.98 3.52 0.12 -0.45 118.95 127.97 2c44 s ARG 419 Ca 0.04 -0.40 -0.12 0.00 -0.13 0.00 0.00 55.73 55.12 2c44 s ARG 419 Cb -0.17 -3.85 0.20 0.00 -1.56 0.00 0.00 34.95 29.57 2c44 s ARG 419 CO 0.05 -0.66 1.41 1.28 -0.81 0.00 0.00 175.30 176.58 2c44 n LEU 420 N 5.59 5.43 -4.69 -0.88 4.32 0.28 -2.88 117.00 124.17 2c44 n LEU 420 Ca -0.07 -4.61 -0.42 0.00 -0.02 0.00 0.00 56.01 50.89 2c44 n LEU 420 Cb 0.49 -1.57 -0.03 0.00 -1.62 0.00 0.00 43.42 40.69 2c44 n LEU 420 CO 0.44 0.92 1.18 -0.89 -1.22 0.00 0.00 177.39 177.82 2c44 s THR 421 N 0.81 3.47 -0.42 -5.08 2.01 -0.95 -2.48 115.64 112.99 2c44 s THR 421 Ca 0.40 0.90 -0.14 0.00 0.31 0.00 0.00 61.69 63.16 2c44 s THR 421 Cb -0.03 -3.58 0.05 0.00 0.01 0.00 0.00 72.50 68.95 2c44 s THR 421 CO -0.01 0.00 0.31 -0.63 -0.69 0.00 0.00 174.62 173.60 2c44 s ILE 422 N 2.34 4.98 0.49 1.82 -1.09 -0.58 -4.31 121.20 124.84 2c44 s ILE 422 Ca 0.67 -0.93 -0.24 0.00 -2.23 0.00 0.00 60.65 57.91 2c44 s ILE 422 Cb -0.34 -3.87 -0.07 0.00 -1.58 0.00 0.00 42.46 36.59 2c44 s ILE 422 CO 0.28 -0.41 1.42 -2.65 -1.23 0.00 0.00 174.94 172.35 2c44 n PRO 423 N 5.11 2.08 -1.99 2.79 -0.02 -1.26 -4.75 135.00 136.95 2c44 n PRO 423 Ca -0.12 0.75 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 2c44 n PRO 423 Cb 0.45 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 2c44 n PRO 423 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2c44 s ARG 424 N -2.61 4.24 -1.58 -0.52 0.52 -1.26 -3.39 118.95 114.34 2c44 s ARG 424 Ca 0.65 2.29 -0.11 0.00 -0.52 0.00 0.00 55.73 58.04 2c44 s ARG 424 Cb -0.43 -3.18 0.09 0.00 0.52 0.00 0.00 34.95 31.95 2c44 s ARG 424 CO 0.55 -0.56 0.62 0.00 0.02 0.00 0.00 175.30 175.92 2c44 n ALA 425 N 3.90 -1.58 -0.04 2.13 0.00 -1.26 -0.90 120.51 122.77 2c44 n ALA 425 Ca 0.13 -0.12 -0.06 0.00 0.00 0.00 0.00 53.44 53.39 2c44 n ALA 425 Cb 0.39 -2.65 -0.03 0.00 0.00 0.00 0.00 19.45 17.17 2c44 n ALA 425 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2c44 n THR 426 N -4.41 0.43 -4.25 0.00 -1.04 -1.22 -4.27 114.28 99.51 2c44 n THR 426 Ca -0.09 -0.15 -0.23 0.00 -2.04 0.00 0.00 64.05 61.54 2c44 n THR 426 Cb 0.58 -0.98 -0.07 0.00 -1.82 0.00 0.00 70.33 68.04 2c44 n THR 426 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2c44 s TYR 427 N -2.15 2.71 0.52 -1.42 2.02 -1.26 -5.07 117.35 112.70 2c44 s TYR 427 Ca -0.10 -0.25 0.06 0.00 -0.37 0.00 0.00 57.07 56.41 2c44 s TYR 427 Cb 0.03 -1.29 0.06 0.00 -0.40 0.00 0.00 41.96 40.36 2c44 s TYR 427 CO 0.16 0.56 0.54 0.25 -1.57 0.00 0.00 175.55 175.49 2c44 n THR 428 N -0.96 0.00 0.05 -0.71 -2.24 -1.26 -4.98 114.28 104.19 2c44 n THR 428 Ca -0.06 -1.90 0.02 0.00 -2.27 0.00 0.00 64.05 59.84 2c44 n THR 428 Cb 0.59 -0.28 0.37 0.00 -2.10 0.00 0.00 70.33 68.91 2c44 n THR 428 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2c44 h GLN 429 N 0.00 0.40 -0.64 -0.78 4.15 -1.99 -1.67 115.11 114.58 2c44 h GLN 429 Ca -0.29 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.03 2c44 h GLN 429 Cb 1.16 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.75 2c44 h GLN 429 CO 0.44 0.43 0.28 1.15 -1.93 0.00 0.00 178.83 179.20 2c44 h THR 430 N 0.39 1.22 -0.40 2.39 2.02 -1.99 -0.63 112.91 115.90 2c44 h THR 430 Ca 0.09 -0.64 -0.09 0.00 0.77 0.00 0.00 66.41 66.54 2c44 h THR 430 Cb 0.26 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2c44 h THR 430 CO 0.01 0.26 -0.09 0.45 0.37 0.00 0.00 175.52 176.52 2c44 h HIS 431 N 0.92 0.86 -0.42 3.16 3.86 -1.70 -0.61 115.15 121.22 2c44 h HIS 431 Ca 0.22 -0.18 0.06 0.00 -1.16 0.00 0.00 60.37 59.31 2c44 h HIS 431 Cb 0.13 -0.21 -0.05 0.00 1.06 0.00 0.00 27.41 28.34 2c44 h HIS 431 CO 0.01 0.89 0.12 0.52 0.86 0.00 0.00 177.93 180.34 2c44 h MET 432 N 0.59 0.26 -0.73 2.45 2.07 -0.81 0.17 114.93 118.93 2c44 h MET 432 Ca 0.10 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.71 2c44 h MET 432 Cb 0.61 -0.06 -0.04 0.00 -1.87 0.00 0.00 31.60 30.24 2c44 h MET 432 CO 0.04 0.18 0.42 -0.44 1.07 0.00 0.00 176.91 178.18 2c44 h ASP 433 N 0.27 0.89 -0.62 1.22 3.45 -0.92 -0.42 116.42 120.29 2c44 h ASP 433 Ca 0.20 -0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.58 2c44 h ASP 433 Cb 0.22 -0.22 -0.03 0.00 -0.56 0.00 0.00 39.33 38.73 2c44 h ASP 433 CO -0.23 0.69 0.31 0.15 -1.57 0.00 0.00 179.24 178.59 2c44 h PHE 434 N 1.01 0.88 -0.34 4.55 3.57 0.59 0.20 116.94 127.41 2c44 h PHE 434 Ca 0.26 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2c44 h PHE 434 Cb -0.01 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 2c44 h PHE 434 CO 0.00 0.66 0.09 0.82 -2.23 0.00 0.00 178.31 177.65 2c44 h ILE 435 N 0.84 1.22 -0.63 1.41 2.04 0.04 -1.30 117.51 121.13 2c44 h ILE 435 Ca 0.21 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 2c44 h ILE 435 Cb 0.10 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2c44 h ILE 435 CO -0.03 0.25 0.38 0.40 0.00 0.00 0.00 178.15 179.14 2c44 h ILE 436 N 0.39 1.18 -0.96 -0.67 2.04 -0.79 -1.83 117.51 116.88 2c44 h ILE 436 Ca 0.11 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.56 2c44 h ILE 436 Cb 0.28 0.33 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 2c44 h ILE 436 CO -0.00 0.19 0.62 -0.08 0.00 0.00 0.00 178.15 178.88 2c44 h GLU 437 N 0.85 1.27 -0.49 2.37 4.57 -0.77 -2.23 114.58 120.15 2c44 h GLU 437 Ca 0.22 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.32 2c44 h GLU 437 Cb -0.02 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.27 2c44 h GLU 437 CO -0.04 0.85 0.30 0.00 -1.18 0.00 0.00 179.01 178.94 2c44 h ALA 438 N 1.34 0.62 0.00 2.92 0.00 -0.62 -2.13 119.26 121.40 2c44 h ALA 438 Ca 0.35 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2c44 h ALA 438 Cb -0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2c44 h ALA 438 CO -0.07 0.11 -0.01 0.74 0.00 0.00 0.00 179.25 180.01 2c44 h PHE 439 N 0.66 0.00 -0.71 0.00 0.04 -0.75 -1.24 116.94 114.94 2c44 h PHE 439 Ca 0.18 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.94 2c44 h PHE 439 Cb -0.01 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 2c44 h PHE 439 CO -0.03 0.01 0.41 0.87 -0.60 0.00 0.00 178.31 178.97 2c44 h LYS 440 N 0.00 0.97 -0.28 1.51 1.57 -1.11 0.32 116.57 119.55 2c44 h LYS 440 Ca -0.00 -0.10 -0.15 0.00 -1.87 0.00 0.00 60.65 58.53 2c44 h LYS 440 Cb 0.14 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 2c44 h LYS 440 CO 0.00 0.71 -0.41 0.45 -0.57 0.00 0.00 179.45 179.63 2c44 h HIS 441 N 0.97 0.95 -0.43 -1.35 3.86 -1.32 -2.24 115.15 115.58 2c44 h HIS 441 Ca 0.25 -0.32 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2c44 h HIS 441 Cb -0.00 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.25 2c44 h HIS 441 CO -0.01 1.10 0.24 0.28 0.86 0.00 0.00 177.93 180.40 2c44 h VAL 442 N 0.52 1.01 -0.16 2.45 2.07 -1.09 -2.51 116.25 118.54 2c44 h VAL 442 Ca 0.03 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2c44 h VAL 442 Cb 1.00 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2c44 h VAL 442 CO 0.09 0.09 0.09 0.50 0.02 0.00 0.00 177.57 178.37 2c44 h LYS 443 N 0.47 0.22 -0.25 1.57 3.64 -0.92 -1.57 116.57 119.72 2c44 h LYS 443 Ca 0.18 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.61 2c44 h LYS 443 Cb 0.05 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2c44 h LYS 443 CO -0.10 0.19 0.37 1.49 -2.27 0.00 0.00 179.45 179.13 2c44 h GLU 444 N 0.18 0.00 -0.24 1.90 4.57 -1.04 -0.37 114.58 119.58 2c44 h GLU 444 Ca 0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2c44 h GLU 444 Cb 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2c44 h GLU 444 CO -0.01 0.00 0.00 -1.71 -1.18 0.00 0.00 179.01 176.11 2c44 n ASN 445 N -3.47 2.61 -0.16 1.04 5.15 -0.80 -4.77 115.26 114.86 2c44 n ASN 445 Ca 0.04 -1.91 -0.12 0.00 -0.60 0.00 0.00 54.58 51.98 2c44 n ASN 445 Cb 0.50 -0.16 -0.08 0.00 -0.53 0.00 0.00 39.78 39.51 2c44 n ASN 445 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2c44 h ALA 446 N 1.66 -0.61 -0.18 5.20 0.00 -0.11 -1.65 119.26 123.56 2c44 h ALA 446 Ca 0.00 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2c44 h ALA 446 Cb 0.64 1.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2c44 h ALA 446 CO 0.00 -0.97 0.48 1.03 0.00 0.00 0.00 179.25 179.80 2c44 h SER 447 N -0.33 0.00 -0.11 0.00 0.87 -1.86 -1.39 113.55 110.73 2c44 h SER 447 Ca 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2c44 h SER 447 Cb 0.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2c44 h SER 447 CO -0.63 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.26 2c44 n ASN 448 N -3.11 2.93 -4.69 6.23 3.02 -0.62 -4.94 115.26 114.07 2c44 n ASN 448 Ca 0.02 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.20 2c44 n ASN 448 Cb 0.58 -0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.67 2c44 n ASN 448 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2c44 s ILE 449 N -1.89 4.61 0.56 2.41 1.01 -0.53 -5.03 121.20 122.35 2c44 s ILE 449 Ca 0.31 1.89 -0.10 0.00 0.00 0.00 0.00 60.65 62.75 2c44 s ILE 449 Cb 0.21 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.42 2c44 s ILE 449 CO 0.31 0.04 0.96 -0.54 0.00 0.00 0.00 174.94 175.70 2c44 s LYS 450 N 1.80 3.64 0.78 2.79 -0.14 -1.26 -4.93 119.74 122.42 2c44 s LYS 450 Ca 0.52 0.64 -0.10 0.00 -1.36 0.00 0.00 55.97 55.66 2c44 s LYS 450 Cb -0.21 -2.17 0.08 0.00 -1.68 0.00 0.00 37.83 33.85 2c44 s LYS 450 CO 0.22 -0.42 1.13 0.20 -0.76 0.00 0.00 175.35 175.71 2c44 s GLY 451 N -3.98 1.63 0.29 -3.33 0.00 -1.26 -4.79 107.32 95.88 2c44 s GLY 451 Ca 0.54 -0.76 0.11 0.00 0.00 0.00 0.00 44.72 44.61 2c44 s GLY 451 CO 0.48 -0.29 -0.16 1.08 0.00 0.00 0.00 173.10 174.21 2c44 s LEU 452 N -5.48 2.62 -0.08 0.66 1.43 -0.15 0.79 118.68 118.47 2c44 s LEU 452 Ca 0.62 -1.08 -0.18 0.00 -1.03 0.00 0.00 54.13 52.46 2c44 s LEU 452 Cb -0.11 -1.03 0.04 0.00 0.03 0.00 0.00 46.19 45.13 2c44 s LEU 452 CO 0.48 -0.05 0.43 0.28 0.23 0.00 0.00 176.35 177.72 2c44 s THR 453 N -2.59 0.02 0.62 5.49 -1.32 -0.11 -4.48 115.64 113.28 2c44 s THR 453 Ca 0.30 -0.20 -0.19 0.00 -1.21 0.00 0.00 61.69 60.39 2c44 s THR 453 Cb -0.02 -0.69 -0.03 0.00 -1.51 0.00 0.00 72.50 70.25 2c44 s THR 453 CO 0.15 -0.11 1.18 0.49 -2.21 0.00 0.00 174.62 174.11 2c44 n PHE 454 N 1.83 1.56 0.00 9.09 3.01 -1.26 -0.71 117.46 130.98 2c44 n PHE 454 Ca -0.18 0.43 0.00 0.00 1.01 0.00 0.00 57.45 58.71 2c44 n PHE 454 Cb 0.56 -2.23 0.00 0.00 -0.01 0.00 0.00 39.48 37.81 2c44 n PHE 454 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2c44 n THR 455 N -1.76 0.00 -3.47 4.37 -2.24 -0.39 -4.73 114.28 106.05 2c44 n THR 455 Ca 0.15 -0.03 0.01 0.00 -2.27 0.00 0.00 64.05 61.90 2c44 n THR 455 Cb 0.47 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 2c44 n THR 455 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2c44 s TYR 456 N -0.51 -1.40 -0.15 4.78 5.04 -1.07 -4.97 117.35 119.07 2c44 s TYR 456 Ca 0.00 2.08 -0.01 0.00 -2.44 0.00 0.00 57.07 56.70 2c44 s TYR 456 Cb 0.00 0.71 0.04 0.00 0.35 0.00 0.00 41.96 43.06 2c44 s TYR 456 CO 0.00 -0.72 -0.03 -2.00 -1.34 0.00 0.00 175.55 171.46 2c44 s GLU 457 N 2.87 1.15 0.83 4.97 2.12 -1.26 -1.57 118.70 127.81 2c44 s GLU 457 Ca 0.03 -0.37 -0.11 0.00 0.36 0.00 0.00 54.97 54.88 2c44 s GLU 457 Cb -0.13 -1.82 0.09 0.00 0.26 0.00 0.00 34.13 32.54 2c44 s GLU 457 CO -0.20 -0.44 1.12 -2.14 -0.54 0.00 0.00 175.26 173.07 2c44 s PRO 458 N 1.74 1.74 0.29 4.30 0.02 -1.26 -4.95 135.00 136.88 2c44 s PRO 458 Ca 0.01 1.38 0.16 0.00 0.02 0.00 0.00 61.00 62.57 2c44 s PRO 458 Cb -0.15 -1.82 0.09 0.00 0.02 0.00 0.00 34.50 32.63 2c44 s PRO 458 CO -0.07 -2.06 1.45 1.57 -0.33 0.00 0.00 177.00 177.56 2c44 h LYS 459 N -1.34 0.00 -5.43 5.54 -0.00 -2.00 -3.40 116.57 109.94 2c44 h LYS 459 Ca -0.44 0.00 -0.50 0.00 -0.00 0.00 0.00 60.65 59.71 2c44 h LYS 459 Cb 1.25 0.00 -0.28 0.00 -0.00 0.00 0.00 32.23 33.20 2c44 h LYS 459 CO 0.47 0.45 -0.82 0.54 -0.00 0.00 0.00 179.45 180.10 2c44 s VAL 460 N -2.98 1.20 -1.63 0.07 0.11 -1.26 -4.81 120.40 111.10 2c44 s VAL 460 Ca 0.04 -0.71 -0.10 0.00 -2.93 0.00 0.00 61.98 58.28 2c44 s VAL 460 Cb 0.07 -1.02 0.09 0.00 -1.53 0.00 0.00 36.38 34.00 2c44 s VAL 460 CO 0.74 0.29 0.41 0.18 -3.33 0.00 0.00 175.10 173.39 2c44 n LEU 461 N 2.57 -1.39 -0.32 2.54 4.77 -1.26 -4.84 117.00 119.08 2c44 n LEU 461 Ca -0.15 -1.15 0.17 0.00 -0.03 0.00 0.00 56.01 54.85 2c44 n LEU 461 Cb 0.55 -1.85 0.37 0.00 -2.33 0.00 0.00 43.42 40.15 2c44 n LEU 461 CO 0.24 0.34 1.04 0.08 -1.33 0.00 0.00 177.39 177.76 2c44 h ARG 462 N -1.53 0.31 -0.21 3.23 0.11 -1.87 -2.88 114.38 111.54 2c44 h ARG 462 Ca -0.62 -0.02 0.06 0.00 0.10 0.00 0.00 59.98 59.50 2c44 h ARG 462 Cb 1.39 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.39 2c44 h ARG 462 CO 0.75 0.21 0.34 1.12 0.10 0.00 0.00 179.97 182.49 2c44 h HIS 463 N 0.32 0.00 -0.15 4.08 2.07 -1.88 -1.89 115.15 117.70 2c44 h HIS 463 Ca 0.63 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.97 2c44 h HIS 463 Cb 1.30 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.28 2c44 h HIS 463 CO -0.13 0.00 -0.64 0.74 -3.07 0.00 0.00 177.93 174.83 2c44 h PHE 464 N 0.00 0.70 0.00 6.12 -1.00 -1.88 -3.38 116.94 117.50 2c44 h PHE 464 Ca 0.10 -0.28 0.00 0.00 2.81 0.00 0.00 57.97 60.60 2c44 h PHE 464 Cb 0.79 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 40.23 2c44 h PHE 464 CO 0.00 1.03 -0.03 0.25 -1.61 0.00 0.00 178.31 177.95 2c44 n THR 465 N -3.91 0.52 -1.45 -1.55 -2.24 -1.08 -4.68 114.28 99.89 2c44 n THR 465 Ca -0.04 -0.54 -0.31 0.00 -2.27 0.00 0.00 64.05 60.89 2c44 n THR 465 Cb 0.66 0.69 0.07 0.00 -2.10 0.00 0.00 70.33 69.65 2c44 n THR 465 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c44 s ALA 466 N -0.58 2.44 0.01 6.98 0.00 -0.73 -4.92 121.76 124.95 2c44 s ALA 466 Ca 0.02 0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.14 2c44 s ALA 466 Cb 0.02 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 2c44 s ALA 466 CO 0.00 -1.51 -0.16 0.15 0.00 0.00 0.00 175.76 174.24 2c44 s LYS 467 N -5.00 1.19 0.29 0.00 1.02 -0.61 -4.73 119.74 111.90 2c44 s LYS 467 Ca 0.60 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.97 2c44 s LYS 467 Cb -0.15 -1.18 -0.06 0.00 -0.52 0.00 0.00 37.83 35.92 2c44 s LYS 467 CO 0.55 0.31 0.06 -0.51 -0.92 0.00 0.00 175.35 174.85 2c44 s LEU 468 N -0.64 1.98 0.08 3.17 1.02 0.18 -1.27 118.68 123.21 2c44 s LEU 468 Ca 0.05 -1.36 0.02 0.00 0.02 0.00 0.00 54.13 52.86 2c44 s LEU 468 Cb -0.07 -0.22 -0.04 0.00 0.02 0.00 0.00 46.19 45.89 2c44 s LEU 468 CO 0.00 -0.64 -0.07 -1.59 0.02 0.00 0.00 176.35 174.07 2c44 s LYS 469 N -3.94 0.73 1.01 1.70 -2.85 0.11 -4.03 119.74 112.47 2c44 s LYS 469 Ca 0.36 -1.13 -0.17 0.00 -1.00 0.00 0.00 55.97 54.03 2c44 s LYS 469 Cb 0.08 -0.24 0.21 0.00 -2.06 0.00 0.00 37.83 35.83 2c44 s LYS 469 CO 0.14 0.01 1.26 -1.83 0.10 0.00 0.00 175.35 175.03 2c44 s GLU 470 N -3.04 0.26 0.00 1.78 -1.05 -1.26 -0.93 118.70 114.46 2c44 s GLU 470 Ca 0.04 -0.29 0.00 0.00 -0.15 0.00 0.00 54.97 54.57 2c44 s GLU 470 Cb -0.00 -1.79 0.00 0.00 -0.44 0.00 0.00 34.13 31.90 2c44 s GLU 470 CO -0.03 -2.68 0.00 1.55 0.95 0.00 0.00 175.26 175.05