#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 3.26 0.64 5.58 2.46 -1.26 -4.89 115.29 121.08 2c44 s HIS 6 Ca 0.00 1.11 -0.16 0.00 0.47 0.00 0.00 55.06 56.48 2c44 s HIS 6 Cb 0.00 -3.22 -0.01 0.00 -0.13 0.00 0.00 32.58 29.22 2c44 s HIS 6 CO 0.00 -0.51 1.13 -0.51 -2.47 0.00 0.00 174.74 172.38 2c44 s LEU 7 N 3.04 3.46 0.33 8.88 1.43 -1.26 -4.99 118.68 129.57 2c44 s LEU 7 Ca 0.37 2.09 -0.27 0.00 -1.03 0.00 0.00 54.13 55.29 2c44 s LEU 7 Cb -0.14 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 41.42 2c44 s LEU 7 CO 0.10 -1.62 1.03 -2.16 0.23 0.00 0.00 176.35 173.93 2c44 s PRO 8 N -3.89 4.48 0.03 1.29 0.04 -1.26 -4.94 135.00 130.75 2c44 s PRO 8 Ca 0.69 1.55 -0.33 0.00 0.04 0.00 0.00 61.00 62.95 2c44 s PRO 8 Cb -0.22 -2.87 -0.12 0.00 0.04 0.00 0.00 34.50 31.32 2c44 s PRO 8 CO 0.39 0.13 1.79 0.39 0.04 0.00 0.00 177.00 179.74 2c44 n GLU 9 N 0.62 2.31 -0.70 4.56 4.71 -1.26 -4.83 120.64 126.05 2c44 n GLU 9 Ca 0.02 0.84 -0.07 0.00 -0.01 0.00 0.00 57.16 57.94 2c44 n GLU 9 Cb 0.48 -2.68 -0.01 0.00 -1.01 0.00 0.00 31.44 28.22 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 5.54 1.38 -3.59 3.49 -0.04 -1.26 -4.79 135.00 135.72 2c44 n PRO 10 Ca 0.20 -0.61 -0.07 0.00 -0.04 0.00 0.00 63.50 62.97 2c44 n PRO 10 Cb 0.31 -1.32 -0.02 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.43 -0.30 -0.07 0.54 -0.12 -1.26 -4.98 117.98 111.37 2c44 s PHE 11 Ca 0.18 0.07 -0.00 0.00 -0.05 0.00 0.00 56.93 57.13 2c44 s PHE 11 Cb 0.11 0.59 -0.03 0.00 -0.63 0.00 0.00 43.02 43.06 2c44 s PHE 11 CO -0.01 -0.73 -0.02 1.03 -0.05 0.00 0.00 175.22 175.44 2c44 s ARG 12 N -3.33 2.87 0.02 1.99 0.52 -1.26 -5.08 118.95 114.68 2c44 s ARG 12 Ca 0.07 -0.49 -0.30 0.00 -0.52 0.00 0.00 55.73 54.49 2c44 s ARG 12 Cb -0.01 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.70 2c44 s ARG 12 CO -0.05 0.68 1.20 0.42 0.02 0.00 0.00 175.30 177.57 2c44 s ILE 13 N -0.89 4.13 -0.12 1.52 1.01 -1.26 -4.93 121.20 120.67 2c44 s ILE 13 Ca 0.14 1.51 0.04 0.00 0.00 0.00 0.00 60.65 62.34 2c44 s ILE 13 Cb -0.11 -3.97 -0.10 0.00 0.01 0.00 0.00 42.46 38.29 2c44 s ILE 13 CO 0.03 0.07 -0.05 0.54 0.00 0.00 0.00 174.94 175.53 2c44 n ARG 14 N 4.41 1.16 -4.03 2.79 3.00 -1.26 -5.03 116.66 117.69 2c44 n ARG 14 Ca 0.10 0.04 -0.16 0.00 -0.01 0.00 0.00 57.85 57.82 2c44 n ARG 14 Cb 0.46 -1.26 -0.15 0.00 0.00 0.00 0.00 32.46 31.51 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 -2.26 0.27 0.15 1.55 1.01 -1.26 -5.16 120.40 114.70 2c44 s VAL 15 Ca -0.12 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 61.85 2c44 s VAL 15 Cb 0.04 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 2c44 s VAL 15 CO 0.35 0.11 -0.17 0.27 0.00 0.00 0.00 175.10 175.67 2c44 s ILE 16 N 0.34 1.61 -0.23 2.22 -4.36 -1.26 -5.12 121.20 114.39 2c44 s ILE 16 Ca -0.03 -1.83 0.02 0.00 -0.26 0.00 0.00 60.65 58.55 2c44 s ILE 16 Cb -0.06 -1.71 0.05 0.00 1.25 0.00 0.00 42.46 41.99 2c44 s ILE 16 CO -0.01 -0.35 -0.12 -0.70 0.24 0.00 0.00 174.94 174.00 2c44 s GLU 17 N -2.73 2.28 0.53 0.37 2.12 -1.26 -5.12 118.70 114.90 2c44 s GLU 17 Ca 0.13 -1.15 -0.22 0.00 0.36 0.00 0.00 54.97 54.08 2c44 s GLU 17 Cb -0.05 -2.74 -0.05 0.00 0.26 0.00 0.00 34.13 31.55 2c44 s GLU 17 CO 0.05 -0.49 1.38 -2.14 -0.54 0.00 0.00 175.26 173.52 2c44 s PRO 18 N 1.20 3.20 0.13 4.30 0.02 -1.26 -5.04 135.00 137.56 2c44 s PRO 18 Ca -0.05 2.29 0.05 0.00 0.02 0.00 0.00 61.00 63.31 2c44 s PRO 18 Cb -0.18 -2.32 -0.04 0.00 0.02 0.00 0.00 34.50 31.98 2c44 s PRO 18 CO -0.07 -1.16 -0.12 0.14 -0.33 0.00 0.00 177.00 175.46 2c44 s VAL 19 N -1.27 1.24 0.52 3.83 -7.23 -1.26 -5.17 120.40 111.07 2c44 s VAL 19 Ca 0.70 -1.81 0.08 0.00 -1.81 0.00 0.00 61.98 59.14 2c44 s VAL 19 Cb -0.42 -1.60 0.05 0.00 0.56 0.00 0.00 36.38 34.97 2c44 s VAL 19 CO 0.50 -0.53 0.58 -0.54 -0.31 0.00 0.00 175.10 174.80 2c44 s LYS 20 N -2.99 2.38 0.36 4.82 1.02 -1.26 -5.12 119.74 118.95 2c44 s LYS 20 Ca 0.11 -1.71 0.07 0.00 0.02 0.00 0.00 55.97 54.45 2c44 s LYS 20 Cb -0.03 -2.43 -0.07 0.00 -0.52 0.00 0.00 37.83 34.78 2c44 s LYS 20 CO 0.02 -0.62 -0.01 1.03 -0.92 0.00 0.00 175.35 174.85 2c44 s ARG 21 N -4.42 1.81 0.25 1.68 1.81 -1.26 -4.41 118.95 114.40 2c44 s ARG 21 Ca 0.50 -1.99 -0.01 0.00 -1.72 0.00 0.00 55.73 52.51 2c44 s ARG 21 Cb -0.05 -1.42 -0.03 0.00 -0.45 0.00 0.00 34.95 33.01 2c44 s ARG 21 CO 0.31 -0.03 0.24 0.95 -0.68 0.00 0.00 175.30 176.09 2c44 s THR 22 N -2.86 0.00 0.20 0.02 -4.23 -1.26 -5.07 115.64 102.44 2c44 s THR 22 Ca 0.34 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 2c44 s THR 22 Cb 0.07 -2.47 -0.03 0.00 1.34 0.00 0.00 72.50 71.41 2c44 s THR 22 CO 0.16 0.00 0.34 0.42 -0.54 0.00 0.00 174.62 175.00 2c44 s THR 23 N -3.89 5.27 0.19 3.99 -4.23 -1.26 -5.00 115.64 110.71 2c44 s THR 23 Ca 0.36 -0.76 -0.12 0.00 -1.18 0.00 0.00 61.69 59.99 2c44 s THR 23 Cb 0.04 -3.80 0.09 0.00 1.34 0.00 0.00 72.50 70.18 2c44 s THR 23 CO 0.16 -0.22 1.78 -0.09 -0.54 0.00 0.00 174.62 175.70 2c44 h ARG 24 N 1.65 0.46 -0.64 3.99 9.65 -1.94 -1.44 114.38 126.11 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 -0.10 -0.06 0.00 -1.39 0.00 0.00 29.97 29.62 2c44 h ARG 24 CO 0.65 0.31 0.31 0.00 2.80 0.00 0.00 179.97 184.03 2c44 h ALA 25 N 1.31 0.85 -0.37 2.80 0.00 -1.95 -0.44 119.26 121.46 2c44 h ALA 25 Ca 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2c44 h ALA 25 Cb 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2c44 h ALA 25 CO -0.19 -0.07 0.16 -0.92 0.00 0.00 0.00 179.25 178.23 2c44 h TYR 26 N 0.55 0.55 -0.40 0.00 5.03 -1.75 -2.51 116.97 118.44 2c44 h TYR 26 Ca 0.31 -0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.57 2c44 h TYR 26 Cb 0.29 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.39 2c44 h TYR 26 CO -0.12 0.49 0.21 0.00 -1.32 0.00 0.00 178.16 177.42 2c44 h ARG 27 N 0.46 0.57 -0.86 1.82 3.08 -0.67 0.08 114.38 118.85 2c44 h ARG 27 Ca 0.13 -0.07 0.12 0.00 0.07 0.00 0.00 59.98 60.23 2c44 h ARG 27 Cb 0.16 -0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.02 2c44 h ARG 27 CO -0.01 0.48 0.48 1.49 -1.07 0.00 0.00 179.97 181.33 2c44 h GLU 28 N 0.52 0.72 -0.09 0.04 4.57 -0.97 0.43 114.58 119.79 2c44 h GLU 28 Ca 0.14 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 2c44 h GLU 28 Cb 0.08 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 2c44 h GLU 28 CO -0.02 0.47 -0.05 0.93 -1.18 0.00 0.00 179.01 179.17 2c44 h GLU 29 N 0.74 0.20 -0.50 1.92 3.07 -0.99 -3.18 114.58 115.83 2c44 h GLU 29 Ca 0.44 -0.09 0.02 0.00 -0.50 0.00 0.00 59.36 59.24 2c44 h GLU 29 Cb 0.53 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.40 2c44 h GLU 29 CO -0.31 0.56 0.30 0.00 -1.40 0.00 0.00 179.01 178.16 2c44 h ALA 30 N 0.64 0.64 0.00 3.43 0.00 0.06 -1.67 119.26 122.35 2c44 h ALA 30 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2c44 h ALA 30 Cb 0.50 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2c44 h ALA 30 CO 0.01 0.00 -0.13 0.97 0.00 0.00 0.00 179.25 180.10 2c44 h ILE 31 N 0.60 1.10 0.17 0.00 6.09 -0.26 -0.70 117.51 124.51 2c44 h ILE 31 Ca 0.20 -0.46 -0.25 0.00 -1.37 0.00 0.00 64.86 62.98 2c44 h ILE 31 Cb 0.02 1.25 0.03 0.00 0.47 0.00 0.00 36.82 38.59 2c44 h ILE 31 CO -0.09 0.13 -1.07 0.40 -3.07 0.00 0.00 178.15 174.45 2c44 h ILE 32 N 0.00 1.40 -0.18 2.19 2.04 -1.45 -0.81 117.51 120.70 2c44 h ILE 32 Ca -0.00 -2.55 0.05 0.00 1.00 0.00 0.00 64.86 63.36 2c44 h ILE 32 Cb 0.24 3.05 -0.01 0.00 -0.74 0.00 0.00 36.82 39.36 2c44 h ILE 32 CO 0.02 0.74 0.15 0.50 0.00 0.00 0.00 178.15 179.56 2c44 h LYS 33 N -0.10 0.00 -0.31 2.37 3.64 -0.83 0.31 116.57 121.66 2c44 h LYS 33 Ca -0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2c44 h LYS 33 Cb 1.83 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.65 2c44 h LYS 33 CO 0.20 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 176.25 2c44 n SER 34 N -4.24 1.33 -2.68 4.20 3.41 -0.31 -4.88 113.62 110.45 2c44 n SER 34 Ca 0.01 -2.04 -0.20 0.00 -0.26 0.00 0.00 58.87 56.39 2c44 n SER 34 Cb 0.28 -0.20 0.03 0.00 -0.26 0.00 0.00 64.21 64.05 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 0.76 -0.41 2.52 5.00 0.00 0.11 -2.04 105.19 111.13 2c44 n GLY 35 Ca 0.07 0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.62 -2.28 -3.78 1.61 2.81 -0.32 0.31 117.12 111.85 2c44 n MET 36 Ca -0.12 0.89 -0.30 0.00 -1.81 0.00 0.00 57.70 56.36 2c44 n MET 36 Cb 0.62 -5.57 -0.15 0.00 -0.71 0.00 0.00 33.22 27.41 2c44 n MET 36 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2c44 s ASN 37 N -2.15 3.91 0.49 7.83 3.84 -0.86 -4.76 114.94 123.23 2c44 s ASN 37 Ca 0.05 -1.50 0.31 0.00 0.21 0.00 0.00 52.86 51.93 2c44 s ASN 37 Cb -0.02 -0.93 1.42 0.00 -0.55 0.00 0.00 41.25 41.16 2c44 s ASN 37 CO 0.06 -0.37 1.75 -0.65 -2.79 0.00 0.00 177.10 175.10 2c44 h PRO 38 N 8.05 0.12 -0.19 0.43 0.11 -1.88 0.30 132.00 138.94 2c44 h PRO 38 Ca -0.14 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.02 2c44 h PRO 38 Cb 1.04 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2c44 h PRO 38 CO 0.45 0.08 0.22 0.74 -0.21 0.00 0.00 178.00 179.28 2c44 h PHE 39 N 0.13 0.00 -0.19 0.65 -1.00 -1.89 -0.32 116.94 114.32 2c44 h PHE 39 Ca 0.64 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.42 2c44 h PHE 39 Cb 2.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.76 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 -3.77 2.40 -4.82 1.54 4.77 0.11 -4.94 117.00 112.28 2c44 n LEU 40 Ca 0.02 -0.96 -0.33 0.00 -0.03 0.00 0.00 56.01 54.71 2c44 n LEU 40 Cb 0.35 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 2c44 n LEU 40 CO 0.27 0.48 0.66 -0.76 -1.33 0.00 0.00 177.39 176.71 2c44 s LEU 41 N -1.67 3.85 0.34 2.23 1.43 -0.13 -4.85 118.68 119.88 2c44 s LEU 41 Ca 0.34 1.68 -0.26 0.00 -1.03 0.00 0.00 54.13 54.87 2c44 s LEU 41 Cb 0.20 -4.53 -0.10 0.00 0.03 0.00 0.00 46.19 41.79 2c44 s LEU 41 CO 0.30 -0.46 0.98 -1.81 0.23 0.00 0.00 176.35 175.59 2c44 s ASP 42 N -2.39 7.19 0.19 2.29 1.01 -1.26 -4.96 116.67 118.73 2c44 s ASP 42 Ca 0.62 1.90 -0.12 0.00 0.71 0.00 0.00 52.55 55.66 2c44 s ASP 42 Cb -0.10 -2.58 0.22 0.00 1.01 0.00 0.00 42.92 41.47 2c44 s ASP 42 CO 0.18 -0.18 1.72 -1.28 0.21 0.00 0.00 175.17 175.82 2c44 h SER 43 N 3.01 0.05 0.22 0.27 0.87 -1.96 -0.72 113.55 115.30 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 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2c44 h SER 43 CO 0.64 0.05 0.00 -0.62 -0.53 0.00 0.00 176.83 176.37 2c44 n GLU 44 N -5.09 0.01 -0.38 2.24 1.02 -1.26 -1.09 120.64 116.09 2c44 n GLU 44 Ca 0.07 0.38 0.10 0.00 -0.02 0.00 0.00 57.16 57.68 2c44 n GLU 44 Cb 0.26 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.47 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 -1.49 3.65 -4.17 1.62 8.00 -0.28 -4.77 116.55 119.12 2c44 n ASP 45 Ca 0.02 -2.10 -0.31 0.00 0.71 0.00 0.00 54.79 53.11 2c44 n ASP 45 Cb 0.08 -0.46 -0.17 0.00 -0.02 0.00 0.00 41.12 40.55 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 -1.31 1.88 -0.12 2.53 1.01 -0.25 -4.95 120.40 119.19 2c44 s VAL 46 Ca 0.44 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2c44 s VAL 46 Cb 0.24 -1.65 -0.10 0.00 0.00 0.00 0.00 36.38 34.87 2c44 s VAL 46 CO 0.27 0.52 0.25 0.15 0.00 0.00 0.00 175.10 176.30 2c44 h PHE 47 N 6.98 0.00 -3.82 5.22 -0.00 -1.45 -3.44 116.94 120.43 2c44 h PHE 47 Ca -0.25 0.00 -0.67 0.00 -0.00 0.00 0.00 57.97 57.05 2c44 h PHE 47 Cb 1.21 0.00 -0.38 0.00 -0.00 0.00 0.00 35.95 36.79 2c44 h PHE 47 CO 0.47 0.42 -0.78 0.42 -0.00 0.00 0.00 178.31 178.85 2c44 s ILE 48 N -1.88 2.21 -0.74 1.41 1.01 -1.17 -4.93 121.20 117.11 2c44 s ILE 48 Ca -0.09 -1.85 -0.20 0.00 0.00 0.00 0.00 60.65 58.51 2c44 s ILE 48 Cb -0.00 -2.40 0.10 0.00 0.01 0.00 0.00 42.46 40.16 2c44 s ILE 48 CO 0.28 -0.20 0.96 -0.62 0.00 0.00 0.00 174.94 175.37 2c44 s ASP 49 N 1.04 6.34 -0.28 3.58 3.68 -1.26 -1.79 116.67 127.99 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 -2.38 0.79 0.00 -1.45 0.00 0.00 42.92 39.68 2c44 s ASP 49 CO -0.06 -1.23 1.78 0.18 0.13 0.00 0.00 175.17 175.97 2c44 n LEU 50 N 6.96 5.90 -0.29 -1.34 4.77 0.11 -4.57 117.00 128.54 2c44 n LEU 50 Ca 0.05 -3.07 0.04 0.00 -0.03 0.00 0.00 56.01 53.00 2c44 n LEU 50 Cb 0.46 -0.71 0.18 0.00 -2.33 0.00 0.00 43.42 41.02 2c44 n LEU 50 CO 0.58 0.71 1.13 0.25 -1.33 0.00 0.00 177.39 178.73 2c44 h LEU 51 N 3.40 0.64 -7.02 2.23 5.85 -1.61 -2.46 115.31 116.34 2c44 h LEU 51 Ca 0.12 0.06 0.17 0.00 0.84 0.00 0.00 57.88 59.06 2c44 h LEU 51 Cb 2.14 -0.06 -0.16 0.00 0.37 0.00 0.00 40.66 42.95 2c44 h LEU 51 CO 0.60 0.35 0.61 0.28 -0.34 0.00 0.00 178.44 179.94 2c44 s THR 52 N -6.01 0.00 -2.71 1.05 -1.32 -1.26 -4.43 115.64 100.96 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 0.20 -1.04 0.33 0.00 -1.51 0.00 0.00 72.50 70.47 2c44 s THR 52 CO 0.78 0.00 1.35 -0.90 -2.21 0.00 0.00 174.62 173.65 2c44 n ASP 53 N -0.20 3.18 -4.57 8.08 5.75 -1.26 -4.50 116.55 123.03 2c44 n ASP 53 Ca -0.05 -1.98 -0.42 0.00 -0.01 0.00 0.00 54.79 52.33 2c44 n ASP 53 Cb 0.60 -0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.54 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 -1.73 6.32 -0.56 -1.12 0.15 -1.26 -3.81 113.70 111.70 2c44 s SER 54 Ca 0.34 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.06 2c44 s SER 54 Cb 0.21 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2c44 s SER 54 CO 0.31 -1.60 0.00 0.61 1.20 0.00 0.00 173.24 173.76 2c44 n GLY 55 N 5.16 0.75 0.19 9.45 0.00 0.82 -4.88 105.19 116.68 2c44 n GLY 55 Ca 0.09 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.67 0.00 -2.07 2.61 -2.24 -1.25 -4.51 114.28 104.14 2c44 n THR 56 Ca -0.05 -0.41 -0.26 0.00 -2.27 0.00 0.00 64.05 61.06 2c44 n THR 56 Cb 0.26 1.10 0.17 0.00 -2.10 0.00 0.00 70.33 69.76 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 0.85 -0.90 3.92 3.38 0.00 -1.26 -4.81 105.19 106.37 2c44 n GLY 57 Ca 0.03 -1.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 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 -3.75 3.18 0.35 4.61 0.00 0.04 -4.86 121.76 121.33 2c44 s ALA 58 Ca 0.69 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.91 2c44 s ALA 58 Cb -0.02 -2.64 -0.07 0.00 0.00 0.00 0.00 23.12 20.39 2c44 s ALA 58 CO 0.48 -1.14 -0.00 0.14 0.00 0.00 0.00 175.76 175.24 2c44 s VAL 59 N -3.18 1.73 0.40 0.00 -7.23 -1.26 -4.85 120.40 106.01 2c44 s VAL 59 Ca 0.58 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.75 2c44 s VAL 59 Cb -0.11 -2.80 -0.00 0.00 0.56 0.00 0.00 36.38 34.03 2c44 s VAL 59 CO 0.45 -0.08 0.57 0.42 -0.31 0.00 0.00 175.10 176.16 2c44 s THR 60 N -2.92 3.77 0.18 5.32 -4.23 -1.26 -4.94 115.64 111.55 2c44 s THR 60 Ca 0.34 -0.82 -0.13 0.00 -1.18 0.00 0.00 61.69 59.90 2c44 s THR 60 Cb 0.08 -3.33 0.09 0.00 1.34 0.00 0.00 72.50 70.67 2c44 s THR 60 CO 0.16 -0.17 1.77 1.56 -0.54 0.00 0.00 174.62 177.40 2c44 h GLN 61 N 0.63 0.45 -0.97 3.99 4.20 -2.00 -1.03 115.11 120.37 2c44 h GLN 61 Ca -0.45 -0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.35 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 0.30 0.62 0.77 -0.67 0.00 0.00 178.83 180.37 2c44 h SER 62 N 0.46 0.89 -0.20 1.46 0.02 -1.98 0.35 113.55 114.54 2c44 h SER 62 Ca 0.23 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.16 2c44 h SER 62 Cb 0.18 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 2c44 h SER 62 CO -0.19 0.49 -0.14 0.24 -1.14 0.00 0.00 176.83 176.09 2c44 h MET 63 N 0.96 0.45 -0.54 3.45 2.86 -1.65 0.08 114.93 120.54 2c44 h MET 63 Ca 0.47 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.85 2c44 h MET 63 Cb 0.48 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 2c44 h MET 63 CO -0.24 0.76 0.12 0.37 1.06 0.00 0.00 176.91 178.99 2c44 h GLN 64 N 0.13 0.84 -0.50 1.72 4.15 -0.40 -1.93 115.11 119.12 2c44 h GLN 64 Ca 0.04 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.23 2c44 h GLN 64 Cb 0.65 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.20 2c44 h GLN 64 CO 0.04 0.76 0.09 0.00 -1.93 0.00 0.00 178.83 177.79 2c44 h ALA 65 N 1.33 0.66 -0.86 3.38 0.00 -0.18 -2.86 119.26 120.73 2c44 h ALA 65 Ca 0.18 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2c44 h ALA 65 Cb 0.31 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2c44 h ALA 65 CO 0.00 0.39 0.57 0.00 0.00 0.00 0.00 179.25 180.20 2c44 h ALA 66 N 0.97 1.42 0.00 0.00 0.00 -0.50 -0.62 119.26 120.54 2c44 h ALA 66 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2c44 h ALA 66 Cb 0.38 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2c44 h ALA 66 CO 0.01 0.52 0.07 1.98 0.00 0.00 0.00 179.25 181.82 2c44 h MET 67 N 1.12 0.00 -0.00 0.00 -1.53 -1.12 -1.91 114.93 111.49 2c44 h MET 67 Ca 0.33 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.59 2c44 h MET 67 Cb -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 30.98 2c44 h MET 67 CO -0.08 0.00 -0.31 -1.33 0.14 0.00 0.00 176.91 175.33 2c44 n MET 68 N -3.01 0.04 -2.49 0.39 2.81 -0.24 -4.32 117.12 110.30 2c44 n MET 68 Ca -0.03 -0.02 -0.21 0.00 -1.81 0.00 0.00 57.70 55.64 2c44 n MET 68 Cb 0.13 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.15 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 -1.47 2.80 -3.32 0.03 1.85 -0.72 -5.08 116.66 110.75 2c44 n ARG 69 Ca 0.06 -4.11 -0.32 0.00 -1.00 0.00 0.00 57.85 52.49 2c44 n ARG 69 Cb 0.34 -1.97 -0.05 0.00 -1.05 0.00 0.00 32.46 29.72 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 -3.45 2.27 -0.49 2.89 0.00 -1.26 -4.89 107.32 102.40 2c44 s GLY 70 Ca 0.42 -0.19 -0.16 0.00 0.00 0.00 0.00 44.72 44.79 2c44 s GLY 70 CO -0.10 -0.03 0.42 -0.35 0.00 0.00 0.00 173.10 173.04 2c44 s ASP 71 N -2.38 6.16 0.00 1.64 2.15 -1.26 -4.68 116.67 118.29 2c44 s ASP 71 Ca 0.49 -1.40 0.00 0.00 0.43 0.00 0.00 52.55 52.07 2c44 s ASP 71 Cb -0.11 -2.19 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 2c44 s ASP 71 CO 0.21 -0.69 0.53 -0.62 -0.17 0.00 0.00 175.17 174.42 2c44 n GLU 72 N 5.24 0.86 -1.66 4.34 -0.58 -1.26 -4.29 120.64 123.28 2c44 n GLU 72 Ca -0.13 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.22 2c44 n GLU 72 Cb 0.43 -1.33 0.03 0.00 -0.57 0.00 0.00 31.44 30.01 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 -0.06 0.72 0.12 0.62 0.00 -1.26 -4.89 120.51 115.75 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 0.16 -2.19 0.09 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 1.24 0.00 -3.84 0.00 3.20 -1.99 -3.42 116.97 112.16 2c44 h TYR 74 Ca -0.48 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.11 2c44 h TYR 74 Cb 1.33 0.00 -0.28 0.00 1.54 0.00 0.00 36.73 39.33 2c44 h TYR 74 CO 0.42 0.70 -0.74 -1.12 -1.64 0.00 0.00 178.16 175.78 2c44 s SER 75 N -6.73 0.37 -1.64 -2.11 0.01 -1.26 -4.75 113.70 97.60 2c44 s SER 75 Ca -0.00 -0.10 -0.01 0.00 1.31 0.00 0.00 55.95 57.15 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 0.01 0.14 0.61 0.41 0.00 0.00 173.24 175.18 2c44 n GLY 76 N 2.87 -0.45 3.74 3.44 0.00 -1.26 -4.94 105.19 108.59 2c44 n GLY 76 Ca -0.13 -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 -1.89 3.42 0.27 1.61 2.88 -1.26 -4.87 113.62 113.78 2c44 n SER 77 Ca -0.20 1.21 0.15 0.00 -1.33 0.00 0.00 58.87 58.69 2c44 n SER 77 Cb 0.66 -1.56 0.72 0.00 -0.75 0.00 0.00 64.21 63.28 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 3.14 0.00 -0.15 -1.46 0.11 -1.92 -1.10 114.38 112.99 2c44 h ARG 78 Ca -0.48 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.49 2c44 h ARG 78 Cb 1.25 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 2c44 h ARG 78 CO 0.66 0.09 -0.36 0.77 0.10 0.00 0.00 179.97 181.23 2c44 h SER 79 N 0.00 0.33 -0.18 0.08 0.02 -1.89 -1.25 113.55 110.66 2c44 h SER 79 Ca -0.00 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 2c44 h SER 79 Cb 0.44 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 2c44 h SER 79 CO 0.01 0.67 0.07 0.22 -1.14 0.00 0.00 176.83 176.67 2c44 h TYR 80 N 0.28 0.28 -0.19 3.45 3.20 -1.44 -2.00 116.97 120.54 2c44 h TYR 80 Ca 0.03 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2c44 h TYR 80 Cb 0.76 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2c44 h TYR 80 CO 0.02 0.34 -0.02 1.88 -1.64 0.00 0.00 178.16 178.73 2c44 h TYR 81 N 0.14 0.28 -0.30 -3.82 0.05 -1.32 0.95 116.97 112.96 2c44 h TYR 81 Ca 0.06 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 2c44 h TYR 81 Cb 0.18 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 2c44 h TYR 81 CO -0.01 0.31 0.11 0.00 -1.05 0.00 0.00 178.16 177.52 2c44 h ALA 82 N 1.71 0.39 -0.21 3.88 0.00 -0.85 0.76 119.26 124.95 2c44 h ALA 82 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2c44 h ALA 82 Cb 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2c44 h ALA 82 CO 0.01 0.00 0.08 1.25 0.00 0.00 0.00 179.25 180.59 2c44 h LEU 83 N 0.34 0.30 -0.85 0.00 5.85 -0.64 -2.11 115.31 118.20 2c44 h LEU 83 Ca 0.10 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2c44 h LEU 83 Cb 0.20 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 2c44 h LEU 83 CO -0.01 0.39 0.51 0.00 -0.34 0.00 0.00 178.44 178.99 2c44 h ALA 84 N 0.92 1.20 -0.63 1.25 0.00 -0.62 -1.19 119.26 120.18 2c44 h ALA 84 Ca 0.07 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2c44 h ALA 84 Cb 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2c44 h ALA 84 CO -0.00 0.19 0.27 1.05 0.00 0.00 0.00 179.25 180.75 2c44 h GLU 85 N 0.89 0.93 -0.69 0.00 -0.00 -0.52 -0.51 114.58 114.67 2c44 h GLU 85 Ca 0.39 -0.16 0.00 0.00 -0.00 0.00 0.00 59.36 59.60 2c44 h GLU 85 Cb 0.28 -0.16 -0.03 0.00 -0.00 0.00 0.00 28.75 28.84 2c44 h GLU 85 CO -0.21 0.78 0.44 0.77 -0.00 0.00 0.00 179.01 180.79 2c44 h SER 86 N 0.88 0.81 -0.58 3.06 0.02 -0.65 -0.46 113.55 116.63 2c44 h SER 86 Ca 0.21 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 2c44 h SER 86 Cb 0.18 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 2c44 h SER 86 CO -0.02 0.61 0.20 0.58 -1.14 0.00 0.00 176.83 177.06 2c44 h VAL 87 N 0.94 1.23 -0.49 2.27 2.07 -0.89 -0.31 116.25 121.08 2c44 h VAL 87 Ca 0.25 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2c44 h VAL 87 Cb -0.08 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2c44 h VAL 87 CO -0.05 0.29 0.17 0.11 0.02 0.00 0.00 177.57 178.10 2c44 h LYS 88 N 0.80 0.75 0.00 1.57 6.56 -0.54 -0.76 116.57 124.95 2c44 h LYS 88 Ca 0.19 -0.15 -0.15 0.00 -1.06 0.00 0.00 60.65 59.48 2c44 h LYS 88 Cb 0.25 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 2c44 h LYS 88 CO -0.01 0.70 -0.69 -2.95 -2.06 0.00 0.00 179.45 174.43 2c44 h ASN 89 N 0.65 0.00 0.00 0.86 -1.07 -0.95 -0.99 115.58 114.08 2c44 h ASN 89 Ca 0.16 0.00 -0.13 0.00 0.07 0.00 0.00 56.30 56.39 2c44 h ASN 89 Cb 0.25 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.48 2c44 h ASN 89 CO -0.01 0.69 -0.80 0.40 0.07 0.00 0.00 177.43 177.78 2c44 h ILE 90 N 0.00 0.93 0.00 6.14 2.04 -1.01 -3.41 117.51 122.20 2c44 h ILE 90 Ca -0.01 -1.99 0.00 0.00 1.00 0.00 0.00 64.86 63.87 2c44 h ILE 90 Cb 1.35 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 2c44 h ILE 90 CO 0.09 0.32 -1.49 0.49 0.00 0.00 0.00 178.15 177.56 2c44 n PHE 91 N -4.52 0.16 -1.06 1.37 3.72 -0.32 -3.97 117.46 112.83 2c44 n PHE 91 Ca -0.22 0.05 -0.02 0.00 -0.05 0.00 0.00 57.45 57.20 2c44 n PHE 91 Cb 0.54 -0.44 -0.01 0.00 -0.94 0.00 0.00 39.48 38.64 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 1.32 0.55 3.76 1.37 0.00 -0.37 -4.83 105.19 106.99 2c44 n GLY 92 Ca -0.01 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.08 3.53 -0.35 1.61 1.51 -1.24 -4.91 117.35 115.43 2c44 s TYR 93 Ca 0.00 0.73 0.23 0.00 -1.01 0.00 0.00 57.07 57.02 2c44 s TYR 93 Cb 0.00 -2.35 0.17 0.00 -0.11 0.00 0.00 41.96 39.67 2c44 s TYR 93 CO 0.00 0.33 1.28 -0.56 -1.11 0.00 0.00 175.55 175.49 2c44 h GLN 94 N 6.22 0.00 -5.21 -0.62 3.07 -1.26 -3.26 115.11 114.05 2c44 h GLN 94 Ca -0.44 0.00 -0.67 0.00 0.09 0.00 0.00 58.65 57.63 2c44 h GLN 94 Cb 1.18 0.00 -0.31 0.00 0.08 0.00 0.00 27.48 28.43 2c44 h GLN 94 CO 0.72 0.00 -0.82 0.71 0.09 0.00 0.00 178.83 179.53 2c44 s TYR 95 N -3.29 2.74 -0.03 0.06 2.02 -0.84 -5.01 117.35 113.00 2c44 s TYR 95 Ca 0.03 -1.09 0.04 0.00 -0.37 0.00 0.00 57.07 55.68 2c44 s TYR 95 Cb 0.08 -1.86 -0.01 0.00 -0.40 0.00 0.00 41.96 39.78 2c44 s TYR 95 CO 0.74 -0.49 -0.16 0.99 -1.57 0.00 0.00 175.55 175.06 2c44 s THR 96 N 0.76 1.28 -0.15 -0.71 2.01 -1.26 -1.08 115.64 116.49 2c44 s THR 96 Ca -0.07 -0.65 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2c44 s THR 96 Cb -0.16 -1.09 0.05 0.00 0.01 0.00 0.00 72.50 71.31 2c44 s THR 96 CO 0.00 0.37 0.01 -0.63 -0.69 0.00 0.00 174.62 173.69 2c44 s ILE 97 N -0.10 0.54 0.46 1.82 1.01 -0.21 -5.00 121.20 119.71 2c44 s ILE 97 Ca 0.00 -0.33 -0.20 0.00 0.00 0.00 0.00 60.65 60.12 2c44 s ILE 97 Cb -0.09 -0.88 -0.10 0.00 0.01 0.00 0.00 42.46 41.40 2c44 s ILE 97 CO 0.01 -0.01 0.99 -2.16 0.00 0.00 0.00 174.94 173.77 2c44 s PRO 98 N 1.87 4.03 0.08 2.79 0.04 -1.26 -1.22 135.00 141.33 2c44 s PRO 98 Ca 0.01 1.22 0.01 0.00 0.04 0.00 0.00 61.00 62.29 2c44 s PRO 98 Cb -0.15 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2c44 s PRO 98 CO -0.07 -0.22 -0.06 0.95 0.04 0.00 0.00 177.00 177.64 2c44 s THR 99 N -2.11 0.54 0.42 1.26 -4.23 -0.88 -3.78 115.64 106.87 2c44 s THR 99 Ca 0.64 -1.73 0.14 0.00 -1.18 0.00 0.00 61.69 59.56 2c44 s THR 99 Cb -0.12 -1.41 0.16 0.00 1.34 0.00 0.00 72.50 72.46 2c44 s THR 99 CO 0.17 -0.81 1.95 1.12 -0.54 0.00 0.00 174.62 176.51 2c44 h HIS 100 N 3.32 0.01 -1.92 3.99 2.07 -1.51 0.88 115.15 121.99 2c44 h HIS 100 Ca -0.35 -0.00 0.08 0.00 -2.85 0.00 0.00 60.37 57.25 2c44 h HIS 100 Cb 1.17 -0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.13 2c44 h HIS 100 CO 0.59 0.24 0.27 0.00 -3.07 0.00 0.00 177.93 175.96 2c44 n GLN 101 N -4.26 0.24 -0.05 5.12 10.64 -1.26 -0.57 117.38 127.24 2c44 n GLN 101 Ca -0.02 -0.58 -0.04 0.00 -1.83 0.00 0.00 57.00 54.53 2c44 n GLN 101 Cb 0.29 0.80 -0.03 0.00 -0.86 0.00 0.00 30.24 30.43 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 0.83 -1.73 2.00 2.61 0.00 -1.78 -0.91 103.07 104.10 2c44 h GLY 102 Ca -0.11 0.83 0.00 0.00 0.00 0.00 0.00 47.33 48.05 2c44 h GLY 102 CO 0.15 -0.57 0.00 -0.96 0.00 0.00 0.00 176.54 175.15 2c44 n ARG 103 N -3.53 0.06 0.01 4.80 1.85 -1.26 -0.72 116.66 117.87 2c44 n ARG 103 Ca -0.01 0.54 -0.15 0.00 -1.00 0.00 0.00 57.85 57.24 2c44 n ARG 103 Cb 0.10 -1.68 -0.04 0.00 -1.05 0.00 0.00 32.46 29.79 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 0.10 0.72 1.46 2.89 0.00 -1.58 -2.38 103.07 104.29 2c44 h GLY 104 Ca 0.00 -1.03 -0.27 0.00 0.00 0.00 0.00 47.33 46.03 2c44 h GLY 104 CO 0.00 0.91 -1.16 0.00 0.00 0.00 0.00 176.54 176.29 2c44 h ALA 105 N 0.69 0.14 -0.34 3.60 0.00 -0.76 -3.32 119.26 119.27 2c44 h ALA 105 Ca -0.05 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.07 2c44 h ALA 105 Cb 1.39 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 2c44 h ALA 105 CO 0.15 0.82 0.19 0.93 0.00 0.00 0.00 179.25 181.34 2c44 h GLU 106 N 0.19 0.46 0.00 0.00 5.08 -1.44 -1.48 114.58 117.40 2c44 h GLU 106 Ca -0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2c44 h GLU 106 Cb 1.84 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.99 2c44 h GLU 106 CO 0.21 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.59 2c44 n GLN 107 N -4.79 0.11 -0.06 2.33 10.64 -0.90 -2.24 117.38 122.47 2c44 n GLN 107 Ca -0.01 0.19 -0.09 0.00 -1.83 0.00 0.00 57.00 55.26 2c44 n GLN 107 Cb 0.07 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 27.92 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 -1.24 1.39 -0.06 -0.39 5.41 -0.66 -4.55 119.36 119.27 2c44 n ILE 108 Ca 0.03 0.14 -0.03 0.00 1.00 0.00 0.00 62.75 63.90 2c44 n ILE 108 Cb 0.05 -2.11 0.20 0.00 -0.71 0.00 0.00 39.64 37.07 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 -0.74 0.71 0.20 1.39 -0.00 -1.30 -2.73 116.97 114.50 2c44 h TYR 109 Ca -0.07 -0.10 0.00 0.00 -0.00 0.00 0.00 58.73 58.57 2c44 h TYR 109 Cb 0.84 -0.20 -0.02 0.00 -0.00 0.00 0.00 36.73 37.35 2c44 h TYR 109 CO -0.29 0.70 -0.20 0.82 -0.00 0.00 0.00 178.16 179.19 2c44 h ILE 110 N 0.63 0.57 -0.58 -0.90 2.04 -1.69 0.37 117.51 117.94 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 0.45 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2c44 h ILE 110 CO 0.02 0.00 0.35 -0.65 0.00 0.00 0.00 178.15 177.87 2c44 h PRO 111 N -0.43 0.79 -0.09 2.37 0.11 -1.79 -1.67 132.00 131.29 2c44 h PRO 111 Ca -0.00 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2c44 h PRO 111 Cb 0.40 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 2c44 h PRO 111 CO -0.05 0.57 0.06 0.28 -0.21 0.00 0.00 178.00 178.65 2c44 h VAL 112 N 0.79 1.03 -0.53 3.15 2.07 -1.16 -1.78 116.25 119.82 2c44 h VAL 112 Ca 0.21 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 67.60 2c44 h VAL 112 Cb -0.02 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 2c44 h VAL 112 CO -0.04 0.02 0.02 -0.07 0.02 0.00 0.00 177.57 177.53 2c44 h LEU 113 N 0.12 0.84 0.13 2.57 3.38 -0.16 -1.94 115.31 120.26 2c44 h LEU 113 Ca 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2c44 h LEU 113 Cb -0.01 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.52 2c44 h LEU 113 CO -0.01 0.89 -0.06 0.40 0.09 0.00 0.00 178.44 179.75 2c44 h ILE 114 N 0.82 0.93 -0.84 1.22 2.04 -1.11 -2.54 117.51 118.03 2c44 h ILE 114 Ca 0.16 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.84 2c44 h ILE 114 Cb 0.46 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 2c44 h ILE 114 CO 0.02 0.06 0.55 0.11 0.00 0.00 0.00 178.15 178.89 2c44 h LYS 115 N -0.30 0.83 0.51 2.37 1.57 -1.22 -2.09 116.57 118.24 2c44 h LYS 115 Ca -0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2c44 h LYS 115 Cb 0.24 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2c44 h LYS 115 CO 0.03 0.55 -0.39 -0.22 -0.57 0.00 0.00 179.45 178.85 2c44 h LYS 116 N 0.86 -0.84 0.00 3.15 3.64 -0.97 0.45 116.57 122.86 2c44 h LYS 116 Ca 0.38 0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.79 2c44 h LYS 116 Cb 0.34 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2c44 h LYS 116 CO -0.15 -0.56 -0.12 -0.09 -2.27 0.00 0.00 179.45 176.26 2c44 h ARG 117 N -0.88 0.00 -0.05 1.90 2.43 -1.27 0.10 114.38 116.61 2c44 h ARG 117 Ca -0.06 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2c44 h ARG 117 Cb 0.74 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2c44 h ARG 117 CO 0.01 0.12 -0.06 1.49 -1.51 0.00 0.00 179.97 180.02 2c44 h GLU 118 N 0.00 0.13 0.00 0.20 4.81 -0.81 0.64 114.58 119.55 2c44 h GLU 118 Ca -0.00 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2c44 h GLU 118 Cb 0.37 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2c44 h GLU 118 CO 0.02 0.59 -0.45 1.96 -0.73 0.00 0.00 179.01 180.40 2c44 h GLN 119 N -0.33 0.00 0.04 1.92 4.20 -0.46 -2.72 115.11 117.77 2c44 h GLN 119 Ca 0.01 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.36 2c44 h GLN 119 Cb 0.57 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 2c44 h GLN 119 CO 0.01 0.45 -2.05 0.39 -0.67 0.00 0.00 178.83 176.96 2c44 n GLU 120 N -3.63 0.65 -0.07 1.46 1.02 0.31 -4.66 120.64 115.73 2c44 n GLU 120 Ca -0.01 0.31 0.02 0.00 -0.02 0.00 0.00 57.16 57.47 2c44 n GLU 120 Cb 0.54 -1.63 0.06 0.00 -0.02 0.00 0.00 31.44 30.39 2c44 n GLU 120 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2c44 n LYS 121 N -3.83 2.95 -2.93 3.49 5.02 0.16 -5.00 118.16 118.01 2c44 n LYS 121 Ca -0.40 -1.72 -0.13 0.00 -2.02 0.00 0.00 58.31 54.05 2c44 n LYS 121 Cb 0.91 -1.11 0.03 0.00 -0.02 0.00 0.00 35.03 34.85 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 -0.10 0.11 3.68 0.72 0.00 -0.91 -4.90 105.19 103.80 2c44 n GLY 122 Ca 0.05 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.68 4.39 -4.13 0.99 0.00 -0.84 -4.92 117.00 109.82 2c44 n LEU 123 Ca -0.02 0.93 -0.35 0.00 0.00 0.00 0.00 56.01 56.56 2c44 n LEU 123 Cb 0.54 -1.47 -0.12 0.00 0.00 0.00 0.00 43.42 42.37 2c44 n LEU 123 CO 0.31 -1.19 -0.23 -0.62 0.00 0.00 0.00 177.39 175.66 2c44 s ASP 124 N -1.01 5.12 0.49 1.96 3.68 -1.26 -4.67 116.67 120.98 2c44 s ASP 124 Ca 0.72 -1.84 0.34 0.00 2.13 0.00 0.00 52.55 53.90 2c44 s ASP 124 Cb -0.44 -1.78 1.48 0.00 -1.45 0.00 0.00 42.92 40.72 2c44 s ASP 124 CO 0.50 -0.45 1.68 0.03 0.13 0.00 0.00 175.17 177.06 2c44 h ARG 125 N 8.00 0.09 0.00 4.34 3.08 -1.94 0.50 114.38 128.45 2c44 h ARG 125 Ca -0.14 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2c44 h ARG 125 Cb 1.05 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2c44 h ARG 125 CO 0.64 0.06 0.00 -1.13 -1.07 0.00 0.00 179.97 178.47 2c44 n SER 126 N -4.38 0.33 -0.01 7.04 3.41 -1.26 -3.44 113.62 115.30 2c44 n SER 126 Ca 0.34 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.51 2c44 n SER 126 Cb 1.42 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 64.74 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 -1.83 1.58 -2.51 4.33 4.01 0.17 -5.09 118.16 118.82 2c44 n LYS 127 Ca 0.05 -1.09 -0.40 0.00 -0.51 0.00 0.00 58.31 56.36 2c44 n LYS 127 Cb 0.29 -0.79 -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 -0.60 4.58 -0.01 1.97 0.00 -0.62 -4.92 119.30 119.69 2c44 s MET 128 Ca 0.01 1.73 0.00 0.00 0.00 0.00 0.00 55.69 57.44 2c44 s MET 128 Cb 0.01 -3.09 0.01 0.00 0.00 0.00 0.00 34.83 31.76 2c44 s MET 128 CO 0.00 0.18 -0.00 0.08 0.00 0.00 0.00 175.02 175.28 2c44 s VAL 129 N -1.24 0.08 0.08 5.16 1.01 -0.50 -2.70 120.40 122.29 2c44 s VAL 129 Ca 0.46 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.53 2c44 s VAL 129 Cb -0.30 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 2c44 s VAL 129 CO 0.38 0.06 -0.02 0.00 0.00 0.00 0.00 175.10 175.52 2c44 s ALA 130 N 0.41 3.22 0.26 5.51 0.00 0.04 -4.16 121.76 127.05 2c44 s ALA 130 Ca -0.04 -1.11 0.12 0.00 0.00 0.00 0.00 51.96 50.93 2c44 s ALA 130 Cb -0.06 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 2c44 s ALA 130 CO -0.01 0.68 -0.19 -0.06 0.00 0.00 0.00 175.76 176.18 2c44 s PHE 131 N -1.26 2.32 -0.06 0.00 0.40 -1.17 -1.51 117.98 116.72 2c44 s PHE 131 Ca 0.24 -0.33 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 2c44 s PHE 131 Cb -0.12 -1.03 0.10 0.00 0.51 0.00 0.00 43.02 42.48 2c44 s PHE 131 CO 0.16 0.67 0.85 0.45 0.70 0.00 0.00 175.22 178.05 2c44 s SER 132 N -3.37 -0.46 0.58 1.36 0.15 -1.04 -0.67 113.70 110.25 2c44 s SER 132 Ca 0.28 0.33 0.36 0.00 0.70 0.00 0.00 55.95 57.62 2c44 s SER 132 Cb -0.06 0.42 1.73 0.00 -1.71 0.00 0.00 66.02 66.40 2c44 s SER 132 CO 0.14 -0.55 2.13 -0.55 1.20 0.00 0.00 173.24 175.62 2c44 h ASN 133 N 2.45 0.00 0.00 5.45 -1.07 -1.82 0.43 115.58 121.02 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 1.19 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.44 2c44 h ASN 133 CO 0.34 0.04 0.00 0.00 0.07 0.00 0.00 177.43 177.87 2c44 n TYR 134 N -3.23 0.00 -2.33 4.14 4.19 -1.26 -3.81 117.16 114.86 2c44 n TYR 134 Ca -0.01 0.00 -0.37 0.00 3.31 0.00 0.00 57.90 60.82 2c44 n TYR 134 Cb 0.21 0.00 -0.02 0.00 0.49 0.00 0.00 39.34 40.03 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 3.02 0.64 2.98 0.08 -1.26 -4.71 117.98 118.73 2c44 s PHE 135 Ca 0.00 1.56 -0.12 0.00 0.12 0.00 0.00 56.93 58.49 2c44 s PHE 135 Cb 0.00 -3.33 -0.02 0.00 -0.57 0.00 0.00 43.02 39.10 2c44 s PHE 135 CO 0.00 -1.27 1.05 -0.06 -0.10 0.00 0.00 175.22 174.84 2c44 s PHE 136 N -1.52 3.22 0.33 0.36 0.40 -1.26 -4.82 117.98 114.69 2c44 s PHE 136 Ca 0.60 1.42 0.02 0.00 -0.60 0.00 0.00 56.93 58.37 2c44 s PHE 136 Cb -0.28 -2.87 0.60 0.00 0.51 0.00 0.00 43.02 40.98 2c44 s PHE 136 CO 0.35 -1.02 1.96 0.38 0.70 0.00 0.00 175.22 177.59 2c44 h ASP 137 N -0.23 0.80 0.68 1.36 -0.00 -1.96 0.04 116.42 117.12 2c44 h ASP 137 Ca -0.45 -0.01 -0.19 0.00 -0.00 0.00 0.00 57.03 56.38 2c44 h ASP 137 Cb 1.21 -0.18 -0.02 0.00 -0.00 0.00 0.00 39.33 40.34 2c44 h ASP 137 CO 0.58 0.55 -0.88 0.71 -0.00 0.00 0.00 179.24 180.20 2c44 h THR 138 N 0.93 1.54 -0.22 1.15 1.35 -1.98 -1.04 112.91 114.63 2c44 h THR 138 Ca 0.31 -2.74 -0.07 0.00 -0.55 0.00 0.00 66.41 63.36 2c44 h THR 138 Cb 0.07 2.52 -0.01 0.00 -1.73 0.00 0.00 68.15 69.01 2c44 h THR 138 CO -0.09 0.79 -0.12 0.74 -0.25 0.00 0.00 175.52 176.59 2c44 h THR 139 N 0.07 1.31 -0.70 6.82 2.02 -1.77 -1.14 112.91 119.51 2c44 h THR 139 Ca -0.04 -1.20 -0.02 0.00 0.77 0.00 0.00 66.41 65.92 2c44 h THR 139 Cb 1.53 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 2c44 h THR 139 CO 0.13 0.37 0.35 -0.61 0.37 0.00 0.00 175.52 176.13 2c44 h GLN 140 N 0.17 1.00 0.33 6.66 4.15 -1.03 -1.27 115.11 125.13 2c44 h GLN 140 Ca 0.05 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 2c44 h GLN 140 Cb 0.62 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 2c44 h GLN 140 CO 0.03 0.78 -0.23 0.78 -1.93 0.00 0.00 178.83 178.26 2c44 h GLY 141 N 0.98 -0.58 1.75 2.39 0.00 -0.98 -0.87 103.07 105.76 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 -0.06 0.45 0.00 0.00 0.00 176.54 176.67 2c44 h HIS 142 N -0.55 0.32 0.40 5.60 3.86 -1.11 0.67 115.15 124.34 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 0.47 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2c44 h HIS 142 CO -0.12 0.38 -0.19 0.77 0.86 0.00 0.00 177.93 179.63 2c44 h SER 143 N 0.30 -0.46 -0.67 2.45 0.02 -0.93 -2.14 113.55 112.13 2c44 h SER 143 Ca 0.07 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2c44 h SER 143 Cb 0.30 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 2c44 h SER 143 CO 0.01 -0.18 0.40 1.56 -1.14 0.00 0.00 176.83 177.48 2c44 h GLN 144 N -0.73 0.92 0.00 3.45 4.20 -0.93 0.02 115.11 122.03 2c44 h GLN 144 Ca -0.06 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2c44 h GLN 144 Cb 0.51 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2c44 h GLN 144 CO 0.09 0.65 -0.11 0.82 -0.67 0.00 0.00 178.83 179.61 2c44 h ILE 145 N 0.94 0.66 -0.49 2.54 2.04 -0.77 -0.37 117.51 122.05 2c44 h ILE 145 Ca 0.24 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2c44 h ILE 145 Cb -0.03 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2c44 h ILE 145 CO -0.05 0.11 0.00 0.59 0.00 0.00 0.00 178.15 178.80 2c44 n ASN 146 N -3.80 3.36 -0.29 1.72 3.02 -0.14 -4.91 115.26 114.23 2c44 n ASN 146 Ca -0.02 -2.23 -0.04 0.00 -0.03 0.00 0.00 54.58 52.26 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 1.03 0.67 3.49 7.41 0.00 -0.15 -5.02 105.19 112.62 2c44 n GLY 147 Ca 0.18 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 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 0.81 4.37 0.23 0.00 2.01 -1.10 -2.77 115.64 119.19 2c44 s THR 149 Ca 0.01 1.35 0.11 0.00 0.31 0.00 0.00 61.69 63.47 2c44 s THR 149 Cb -0.14 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 2c44 s THR 149 CO 0.02 -0.44 -0.18 0.68 -0.69 0.00 0.00 174.62 174.01 2c44 s VAL 150 N -2.32 2.66 -0.09 3.82 -7.23 -1.26 -0.78 120.40 115.19 2c44 s VAL 150 Ca 0.61 -2.08 -0.04 0.00 -1.81 0.00 0.00 61.98 58.66 2c44 s VAL 150 Cb -0.10 -2.34 0.05 0.00 0.56 0.00 0.00 36.38 34.55 2c44 s VAL 150 CO 0.20 -0.24 0.18 -0.13 -0.31 0.00 0.00 175.10 174.81 2c44 s ARG 151 N -3.09 0.07 -0.27 4.82 1.81 -0.57 -4.91 118.95 116.82 2c44 s ARG 151 Ca 0.26 0.57 -0.16 0.00 -1.72 0.00 0.00 55.73 54.68 2c44 s ARG 151 Cb -0.07 -0.20 -0.03 0.00 -0.45 0.00 0.00 34.95 34.20 2c44 s ARG 151 CO 0.14 -0.27 0.41 -0.80 -0.68 0.00 0.00 175.30 174.10 2c44 s ASN 152 N 2.08 6.30 -0.94 0.23 0.01 -1.26 -2.48 114.94 118.89 2c44 s ASN 152 Ca 0.00 0.35 -0.01 0.00 -0.71 0.00 0.00 52.86 52.49 2c44 s ASN 152 Cb -0.12 -2.23 0.28 0.00 0.41 0.00 0.00 41.25 39.59 2c44 s ASN 152 CO -0.06 -0.22 1.17 1.33 -1.51 0.00 0.00 177.10 177.81 2c44 n VAL 153 N 5.13 4.18 -2.76 1.60 0.24 0.14 -4.95 118.33 121.91 2c44 n VAL 153 Ca -0.07 -5.60 -0.25 0.00 -2.04 0.00 0.00 64.34 56.37 2c44 n VAL 153 Cb 0.50 -2.15 0.01 0.00 -1.47 0.00 0.00 33.84 30.73 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 -2.44 3.35 0.51 6.34 -0.85 -1.25 -0.41 117.35 122.60 2c44 s TYR 154 Ca 0.33 0.52 -0.10 0.00 -0.52 0.00 0.00 57.07 57.29 2c44 s TYR 154 Cb 0.05 -2.39 -0.05 0.00 0.38 0.00 0.00 41.96 39.95 2c44 s TYR 154 CO 0.03 -0.42 0.89 0.96 -1.52 0.00 0.00 175.55 175.50 2c44 s ILE 155 N -2.71 4.74 0.46 -3.49 -4.36 -1.25 -4.55 121.20 110.05 2c44 s ILE 155 Ca 0.49 0.71 0.23 0.00 -0.26 0.00 0.00 60.65 61.81 2c44 s ILE 155 Cb -0.10 -3.81 0.42 0.00 1.25 0.00 0.00 42.46 40.22 2c44 s ILE 155 CO 0.42 -0.83 1.85 0.07 0.24 0.00 0.00 174.94 176.69 2c44 h LYS 156 N 0.46 0.25 0.00 0.37 2.10 -1.97 -0.79 116.57 116.99 2c44 h LYS 156 Ca -0.46 -0.02 -0.06 0.00 -2.00 0.00 0.00 60.65 58.11 2c44 h LYS 156 Cb 1.19 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.46 2c44 h LYS 156 CO 0.62 0.17 -0.29 0.93 -2.00 0.00 0.00 179.45 178.87 2c44 h GLU 157 N 0.26 0.00 -0.82 0.07 3.07 -1.94 -3.39 114.58 111.82 2c44 h GLU 157 Ca 0.48 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 59.41 2c44 h GLU 157 Cb 1.43 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 29.24 2c44 h GLU 157 CO -0.13 0.29 -0.49 0.00 -1.40 0.00 0.00 179.01 177.28 2c44 n ALA 158 N -2.18 -0.53 -1.11 3.43 0.00 -0.30 -1.72 120.51 118.10 2c44 n ALA 158 Ca 0.03 0.70 -0.11 0.00 0.00 0.00 0.00 53.44 54.05 2c44 n ALA 158 Cb 0.64 -0.10 0.27 0.00 0.00 0.00 0.00 19.45 20.26 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 -4.98 2.65 -3.19 0.00 3.01 -1.26 -4.79 117.46 108.89 2c44 n PHE 159 Ca 0.02 -1.40 -0.46 0.00 1.01 0.00 0.00 57.45 56.62 2c44 n PHE 159 Cb 0.21 -0.77 -0.03 0.00 -0.01 0.00 0.00 39.48 38.89 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 -1.12 6.63 0.00 4.37 -1.08 -0.70 -4.87 116.67 119.90 2c44 s ASP 160 Ca 0.56 -2.33 0.11 0.00 -0.52 0.00 0.00 52.55 50.37 2c44 s ASP 160 Cb 0.45 -2.27 0.53 0.00 -1.46 0.00 0.00 42.92 40.18 2c44 s ASP 160 CO 0.13 -0.78 1.24 0.35 0.52 0.00 0.00 175.17 176.63 2c44 n THR 161 N 4.63 0.77 0.85 1.71 -2.24 -1.26 -1.98 114.28 116.77 2c44 n THR 161 Ca 0.12 0.19 0.11 0.00 -2.27 0.00 0.00 64.05 62.20 2c44 n THR 161 Cb 0.47 -1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 67.65 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 -0.38 -1.08 3.38 3.38 0.00 -1.26 -4.63 105.19 104.60 2c44 n GLY 162 Ca 0.05 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.07 2.34 -0.12 1.61 1.01 -0.84 -5.13 120.40 116.20 2c44 s VAL 163 Ca 0.07 -1.37 -0.09 0.00 0.00 0.00 0.00 61.98 60.58 2c44 s VAL 163 Cb 0.16 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2c44 s VAL 163 CO 0.83 0.33 0.19 0.00 0.00 0.00 0.00 175.10 176.45 2c44 s ARG 164 N -1.39 3.75 -0.09 2.72 3.03 -1.26 -4.86 118.95 120.86 2c44 s ARG 164 Ca 0.13 -0.05 -0.08 0.00 2.03 0.00 0.00 55.73 57.76 2c44 s ARG 164 Cb -0.10 -3.27 0.03 0.00 -1.03 0.00 0.00 34.95 30.58 2c44 s ARG 164 CO 0.03 0.61 0.24 -0.47 -1.13 0.00 0.00 175.30 174.58 2c44 s TYR 165 N -0.58 -0.27 0.33 5.89 5.04 -1.26 -5.08 117.35 121.43 2c44 s TYR 165 Ca 0.15 0.65 0.01 0.00 -2.44 0.00 0.00 57.07 55.43 2c44 s TYR 165 Cb -0.13 0.08 0.57 0.00 0.35 0.00 0.00 41.96 42.84 2c44 s TYR 165 CO 0.04 -0.14 1.99 -0.44 -1.34 0.00 0.00 175.55 175.67 2c44 h ASP 166 N 5.92 0.79 -2.09 4.32 5.19 -1.98 -3.36 116.42 125.21 2c44 h ASP 166 Ca -0.27 -0.03 -0.57 0.00 -0.62 0.00 0.00 57.03 55.54 2c44 h ASP 166 Cb 1.19 -0.20 -0.39 0.00 0.18 0.00 0.00 39.33 40.11 2c44 h ASP 166 CO 0.36 0.58 -1.02 0.49 -3.12 0.00 0.00 179.24 176.54 2c44 n PHE 167 N -4.42 0.14 0.57 4.55 3.01 -1.26 -4.70 117.46 115.36 2c44 n PHE 167 Ca 0.07 -3.62 0.06 0.00 1.01 0.00 0.00 57.45 54.97 2c44 n PHE 167 Cb 0.05 -0.30 0.31 0.00 -0.01 0.00 0.00 39.48 39.52 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 1.53 0.16 0.00 -1.08 5.02 -1.24 -1.87 118.16 120.69 2c44 n LYS 168 Ca 0.23 0.18 0.13 0.00 -2.02 0.00 0.00 58.31 56.83 2c44 n LYS 168 Cb 0.50 -1.50 0.35 0.00 -0.02 0.00 0.00 35.03 34.37 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 -0.23 -0.38 3.57 0.72 0.00 -0.62 -4.40 105.19 103.85 2c44 n GLY 169 Ca 0.06 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.37 -0.08 -4.82 1.61 3.02 -0.78 -4.71 115.26 109.13 2c44 n ASN 170 Ca 0.13 0.62 -0.33 0.00 -0.03 0.00 0.00 54.58 54.97 2c44 n ASN 170 Cb 0.37 -1.35 -0.06 0.00 -0.61 0.00 0.00 39.78 38.13 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 -1.91 3.24 -0.89 3.10 0.40 -1.26 -3.81 117.98 116.85 2c44 s PHE 171 Ca 0.70 1.59 -0.18 0.00 -0.60 0.00 0.00 56.93 58.44 2c44 s PHE 171 Cb -0.33 -2.90 0.14 0.00 0.51 0.00 0.00 43.02 40.44 2c44 s PHE 171 CO 0.53 -0.31 1.06 0.34 0.70 0.00 0.00 175.22 177.54 2c44 s ASP 172 N -2.22 6.60 0.17 1.36 -1.08 0.45 -4.74 116.67 117.21 2c44 s ASP 172 Ca 0.63 -2.04 -0.19 0.00 -0.52 0.00 0.00 52.55 50.43 2c44 s ASP 172 Cb -0.11 -2.37 0.10 0.00 -1.46 0.00 0.00 42.92 39.08 2c44 s ASP 172 CO 0.17 -1.03 1.64 -0.07 0.52 0.00 0.00 175.17 176.39 2c44 h LEU 173 N 10.14 -0.64 0.18 -1.34 3.38 -1.93 0.34 115.31 125.43 2c44 h LEU 173 Ca 0.11 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2c44 h LEU 173 Cb 1.03 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 2c44 h LEU 173 CO 1.07 -0.22 -0.13 -0.33 0.09 0.00 0.00 178.44 178.92 2c44 h GLU 174 N -0.11 -0.31 -0.76 1.13 5.08 -1.99 -1.89 114.58 115.74 2c44 h GLU 174 Ca 0.20 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.74 2c44 h GLU 174 Cb 0.42 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.63 2c44 h GLU 174 CO -0.48 -0.20 0.26 0.78 -1.00 0.00 0.00 179.01 178.36 2c44 h GLY 175 N -0.32 1.12 0.98 -3.84 0.00 -1.72 0.04 103.07 99.34 2c44 h GLY 175 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2c44 h GLY 175 CO -0.00 -0.16 0.28 -2.00 0.00 0.00 0.00 176.54 174.66 2c44 h LEU 176 N 0.36 0.63 -0.14 3.11 5.85 -0.01 0.18 115.31 125.29 2c44 h LEU 176 Ca 0.43 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 2c44 h LEU 176 Cb 0.70 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2c44 h LEU 176 CO -0.46 0.54 0.01 -0.08 -0.34 0.00 0.00 178.44 178.11 2c44 h GLU 177 N 0.67 0.23 -0.31 1.25 4.81 -0.39 -0.86 114.58 119.98 2c44 h GLU 177 Ca 0.18 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2c44 h GLU 177 Cb 0.05 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2c44 h GLU 177 CO -0.03 0.44 0.19 0.00 -0.73 0.00 0.00 179.01 178.88 2c44 h ARG 178 N -0.01 0.41 -0.53 1.92 3.08 -0.96 -0.83 114.38 117.46 2c44 h ARG 178 Ca 0.04 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.16 2c44 h ARG 178 Cb 0.33 -0.09 -0.08 0.00 0.08 0.00 0.00 29.97 30.20 2c44 h ARG 178 CO 0.00 0.31 0.03 0.78 -1.07 0.00 0.00 179.97 180.03 2c44 h GLY 179 N 0.40 0.58 1.14 0.04 0.00 -0.80 0.37 103.07 104.80 2c44 h GLY 179 Ca 0.11 0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.43 2c44 h GLY 179 CO -0.02 -0.14 0.25 -2.22 0.00 0.00 0.00 176.54 174.42 2c44 h ILE 180 N 0.15 1.25 -0.25 2.60 2.04 -0.68 -1.14 117.51 121.49 2c44 h ILE 180 Ca 0.27 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 2c44 h ILE 180 Cb 0.41 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2c44 h ILE 180 CO -0.42 0.33 0.07 -0.33 0.00 0.00 0.00 178.15 177.80 2c44 h GLU 181 N 1.05 0.39 0.43 2.37 4.39 0.38 0.15 114.58 123.73 2c44 h GLU 181 Ca 0.24 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 2c44 h GLU 181 Cb 0.25 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2c44 h GLU 181 CO -0.01 0.48 -0.36 0.93 -1.16 0.00 0.00 179.01 178.89 2c44 h GLU 182 N 0.23 -0.75 -0.08 2.33 3.07 -0.06 -3.07 114.58 116.25 2c44 h GLU 182 Ca 0.08 0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 58.90 2c44 h GLU 182 Cb 0.26 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 2c44 h GLU 182 CO -0.00 -0.50 -0.38 0.28 -1.40 0.00 0.00 179.01 177.01 2c44 h VAL 183 N -0.78 1.29 -0.12 3.13 2.07 -1.23 -3.49 116.25 117.12 2c44 h VAL 183 Ca -0.04 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.07 2c44 h VAL 183 Cb 0.68 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2c44 h VAL 183 CO -0.02 0.42 0.00 0.61 0.02 0.00 0.00 177.57 178.59 2c44 n GLY 184 N -0.31 0.66 0.55 2.17 0.00 0.52 -4.65 105.19 104.13 2c44 n GLY 184 Ca -0.01 -1.03 0.36 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 -1.83 0.25 132.00 132.17 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 -0.63 1.44 2.35 -1.90 -3.03 115.58 113.81 2c44 h ASN 186 Ca 0.58 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.33 2c44 h ASN 186 Cb 2.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.86 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 -3.05 3.59 -4.22 5.81 3.02 0.89 -3.86 115.26 117.44 2c44 n ASN 187 Ca 0.01 -1.99 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 2c44 n ASN 187 Cb 0.34 -0.42 -0.08 0.00 -0.61 0.00 0.00 39.78 39.01 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 -1.16 4.32 0.38 2.41 1.01 -1.15 -1.41 120.40 124.79 2c44 s VAL 188 Ca 0.44 -1.86 0.19 0.00 0.00 0.00 0.00 61.98 60.76 2c44 s VAL 188 Cb 0.24 -3.83 0.19 0.00 0.00 0.00 0.00 36.38 32.98 2c44 s VAL 188 CO 0.31 -0.80 1.94 1.55 0.00 0.00 0.00 175.10 178.10 2c44 h PRO 189 N 8.38 0.00 -1.47 2.72 0.13 -1.86 -3.45 132.00 136.44 2c44 h PRO 189 Ca -0.19 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 65.21 2c44 h PRO 189 Cb 1.07 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.03 2c44 h PRO 189 CO 0.86 0.24 0.81 1.52 -0.23 0.00 0.00 178.00 181.20 2c44 s TYR 190 N -4.21 -0.11 -0.09 1.56 -0.85 -1.26 -4.32 117.35 108.08 2c44 s TYR 190 Ca -0.03 0.04 0.03 0.00 -0.52 0.00 0.00 57.07 56.60 2c44 s TYR 190 Cb 0.14 0.52 0.01 0.00 0.38 0.00 0.00 41.96 43.01 2c44 s TYR 190 CO 0.66 -0.22 -0.19 0.42 -1.52 0.00 0.00 175.55 174.70 2c44 s ILE 191 N -2.42 1.66 -0.22 -3.49 1.01 -0.52 -3.02 121.20 114.19 2c44 s ILE 191 Ca 0.11 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 2c44 s ILE 191 Cb 0.00 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 2c44 s ILE 191 CO -0.04 0.47 0.03 -0.69 0.00 0.00 0.00 174.94 174.71 2c44 s VAL 192 N 0.52 4.13 -0.42 2.92 1.01 0.15 -0.83 120.40 127.88 2c44 s VAL 192 Ca -0.16 -0.24 -0.16 0.00 0.00 0.00 0.00 61.98 61.42 2c44 s VAL 192 Cb -0.17 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.34 2c44 s VAL 192 CO 0.06 0.39 0.34 0.00 0.00 0.00 0.00 175.10 175.90 2c44 s ALA 193 N 1.24 3.47 -0.69 5.51 0.00 0.26 -3.36 121.76 128.19 2c44 s ALA 193 Ca 0.04 -1.70 -0.21 0.00 0.00 0.00 0.00 51.96 50.09 2c44 s ALA 193 Cb -0.15 -2.95 0.09 0.00 0.00 0.00 0.00 23.12 20.11 2c44 s ALA 193 CO 0.02 -1.52 0.94 0.99 0.00 0.00 0.00 175.76 176.19 2c44 s THR 194 N 1.80 4.49 -0.60 0.00 2.01 -1.26 -0.15 115.64 121.93 2c44 s THR 194 Ca 0.07 -0.68 -0.26 0.00 0.31 0.00 0.00 61.69 61.12 2c44 s THR 194 Cb -0.19 -4.66 -0.03 0.00 0.01 0.00 0.00 72.50 67.63 2c44 s THR 194 CO 0.11 -1.40 1.97 -0.63 -0.69 0.00 0.00 174.62 173.97 2c44 s ILE 195 N 3.57 3.29 0.00 1.82 -1.09 -0.61 -3.02 121.20 125.16 2c44 s ILE 195 Ca 0.22 0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.79 2c44 s ILE 195 Cb -0.16 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 2c44 s ILE 195 CO 0.06 -0.74 0.00 0.41 -1.23 0.00 0.00 174.94 173.44 2c44 n THR 196 N 7.38 -1.26 -2.13 2.92 -1.04 -1.26 -3.80 114.28 115.09 2c44 n THR 196 Ca 0.24 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.82 2c44 n THR 196 Cb 0.52 -1.62 -0.02 0.00 -1.82 0.00 0.00 70.33 67.39 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 0.53 -4.81 113.70 123.68 2c44 s SER 197 Ca 0.00 1.09 -0.33 0.00 0.70 0.00 0.00 55.95 57.42 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 -1.63 1.61 -1.13 1.20 0.00 0.00 173.24 173.29 2c44 h ASN 198 N 12.15 -0.92 0.17 5.45 -0.73 -1.87 0.13 115.58 129.96 2c44 h ASN 198 Ca -0.31 0.06 -0.04 0.00 1.87 0.00 0.00 56.30 57.88 2c44 h ASN 198 Cb 1.15 0.28 -0.01 0.00 0.27 0.00 0.00 38.32 40.01 2c44 h ASN 198 CO 1.06 -0.56 -0.17 0.28 -0.37 0.00 0.00 177.43 177.67 2c44 h SER 199 N -0.87 0.01 0.60 1.15 0.02 -1.90 -0.59 113.55 111.97 2c44 h SER 199 Ca -0.06 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2c44 h SER 199 Cb 0.72 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2c44 h SER 199 CO 0.05 0.19 0.00 0.00 -1.14 0.00 0.00 176.83 175.93 2c44 n ALA 200 N -2.51 1.64 0.00 3.77 0.00 -1.15 -4.81 120.51 117.45 2c44 n ALA 200 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c44 n ALA 200 Cb 0.24 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.38 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 -0.05 1.51 2.82 0.00 0.00 -0.26 -4.55 105.19 104.66 2c44 n GLY 201 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.26 -0.25 3.79 -0.02 0.00 0.41 -4.09 105.19 104.77 2c44 n GLY 202 Ca 0.00 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 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 -5.56 4.43 0.65 1.61 -1.52 -0.99 -1.99 119.66 116.29 2c44 s GLN 203 Ca 0.28 1.00 -0.13 0.00 -1.95 0.00 0.00 55.36 54.56 2c44 s GLN 203 Cb -0.12 -3.25 -0.01 0.00 -0.22 0.00 0.00 33.01 29.40 2c44 s GLN 203 CO 0.35 0.60 1.06 -1.25 -0.25 0.00 0.00 175.29 175.80 2c44 s PRO 204 N -1.14 3.07 -0.17 2.91 0.04 -1.26 -0.35 135.00 138.10 2c44 s PRO 204 Ca 0.33 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.46 2c44 s PRO 204 Cb -0.22 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2c44 s PRO 204 CO 0.24 -1.00 -0.11 0.08 0.04 0.00 0.00 177.00 176.24 2c44 s VAL 205 N -2.74 2.95 0.68 -0.36 1.01 -1.26 -1.59 120.40 119.08 2c44 s VAL 205 Ca 0.61 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.78 2c44 s VAL 205 Cb -0.15 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 33.96 2c44 s VAL 205 CO 0.46 0.49 1.11 -0.94 0.00 0.00 0.00 175.10 176.22 2c44 s SER 206 N 0.94 5.02 0.23 3.32 1.04 -1.26 -4.90 113.70 118.09 2c44 s SER 206 Ca -0.02 1.97 -0.01 0.00 0.48 0.00 0.00 55.95 58.37 2c44 s SER 206 Cb -0.15 -2.55 0.24 0.00 0.10 0.00 0.00 66.02 63.66 2c44 s SER 206 CO -0.01 -1.69 1.62 0.25 0.98 0.00 0.00 173.24 174.39 2c44 h LEU 207 N -0.14 0.62 -0.56 2.42 5.85 -1.97 -2.39 115.31 119.13 2c44 h LEU 207 Ca -0.46 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.00 2c44 h LEU 207 Cb 1.24 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 2c44 h LEU 207 CO 0.54 0.92 0.35 0.00 -0.34 0.00 0.00 178.44 179.90 2c44 h ALA 208 N 1.12 0.72 -0.86 1.25 0.00 -2.00 -1.19 119.26 118.29 2c44 h ALA 208 Ca 0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c44 h ALA 208 Cb 0.84 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2c44 h ALA 208 CO 0.07 0.19 0.54 -0.97 0.00 0.00 0.00 179.25 179.08 2c44 h ASN 209 N 0.76 1.02 -0.65 0.00 -0.73 -1.88 -1.66 115.58 112.43 2c44 h ASN 209 Ca 0.20 -0.05 -0.06 0.00 1.87 0.00 0.00 56.30 58.26 2c44 h ASN 209 Cb -0.03 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.28 2c44 h ASN 209 CO -0.04 0.77 0.17 -0.07 -0.37 0.00 0.00 177.43 177.89 2c44 h LEU 210 N 1.18 0.99 -0.23 0.34 3.38 -0.92 -0.19 115.31 119.86 2c44 h LEU 210 Ca 0.31 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2c44 h LEU 210 Cb -0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 2c44 h LEU 210 CO -0.06 0.96 0.15 0.11 0.09 0.00 0.00 178.44 179.69 2c44 h LYS 211 N 0.97 0.30 -0.34 1.13 1.57 -0.70 0.94 116.57 120.44 2c44 h LYS 211 Ca 0.21 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2c44 h LYS 211 Cb 0.35 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2c44 h LYS 211 CO 0.00 0.21 0.20 0.00 -0.57 0.00 0.00 179.45 179.30 2c44 h ALA 212 N 1.07 0.43 -0.26 3.86 0.00 -1.10 -0.42 119.26 122.84 2c44 h ALA 212 Ca 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c44 h ALA 212 Cb -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2c44 h ALA 212 CO -0.02 -0.07 0.15 1.98 0.00 0.00 0.00 179.25 181.29 2c44 h MET 213 N 0.44 0.36 -0.30 0.00 1.85 -0.76 -1.59 114.93 114.93 2c44 h MET 213 Ca 0.12 -0.04 -0.03 0.00 -0.61 0.00 0.00 59.70 59.15 2c44 h MET 213 Cb 0.01 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.95 2c44 h MET 213 CO -0.02 0.31 0.07 -0.92 -0.40 0.00 0.00 176.91 175.94 2c44 h TYR 214 N 0.32 0.44 -0.54 1.39 3.20 -0.61 -1.00 116.97 120.16 2c44 h TYR 214 Ca 0.09 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 2c44 h TYR 214 Cb 0.05 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2c44 h TYR 214 CO -0.04 0.39 0.18 1.03 -1.64 0.00 0.00 178.16 178.08 2c44 h SER 215 N 0.43 0.78 -0.41 -2.11 0.87 -0.52 0.19 113.55 112.78 2c44 h SER 215 Ca 0.10 -0.20 -0.03 0.00 -1.23 0.00 0.00 61.79 60.43 2c44 h SER 215 Cb 0.18 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 2c44 h SER 215 CO -0.00 0.78 0.12 0.40 -0.53 0.00 0.00 176.83 177.60 2c44 h ILE 216 N 0.75 1.22 -0.70 2.23 2.04 -0.60 -2.04 117.51 120.42 2c44 h ILE 216 Ca 0.18 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 2c44 h ILE 216 Cb 0.27 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2c44 h ILE 216 CO -0.01 0.26 0.36 0.00 0.00 0.00 0.00 178.15 178.76 2c44 h ALA 217 N 0.97 0.90 -0.82 1.87 0.00 -0.80 -2.37 119.26 119.01 2c44 h ALA 217 Ca 0.13 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 217 Cb 0.27 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2c44 h ALA 217 CO -0.00 0.44 0.54 1.57 0.00 0.00 0.00 179.25 181.80 2c44 h LYS 218 N 0.97 1.08 -0.62 0.00 -0.00 -0.46 0.18 116.57 117.72 2c44 h LYS 218 Ca 0.24 -0.07 0.11 0.00 -0.00 0.00 0.00 60.65 60.94 2c44 h LYS 218 Cb 0.08 -0.24 -0.08 0.00 -0.00 0.00 0.00 32.23 31.99 2c44 h LYS 218 CO -0.03 0.72 0.16 -0.22 -0.00 0.00 0.00 179.45 180.08 2c44 h LYS 219 N 1.11 0.29 -0.51 0.07 3.64 -0.84 -0.94 116.57 119.40 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 -0.12 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2c44 h LYS 219 CO -0.06 0.20 0.00 0.66 -2.27 0.00 0.00 179.45 177.97 2c44 n TYR 220 N -5.09 0.67 -3.70 1.91 4.02 -0.94 -4.95 117.16 109.08 2c44 n TYR 220 Ca 0.09 -0.34 -0.24 0.00 -0.01 0.00 0.00 57.90 57.41 2c44 n TYR 220 Cb 0.32 0.00 0.05 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 1.32 -3.28 -4.65 7.72 2.03 0.43 -4.94 116.55 115.18 2c44 n ASP 221 Ca 0.20 -0.73 -0.37 0.00 0.52 0.00 0.00 54.79 54.42 2c44 n ASP 221 Cb 0.54 -4.35 -0.10 0.00 -0.72 0.00 0.00 41.12 36.50 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 -3.45 5.33 0.28 5.18 1.01 -0.04 -5.01 121.20 124.50 2c44 s ILE 222 Ca 0.30 0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.82 2c44 s ILE 222 Cb -0.14 -3.49 -0.12 0.00 0.01 0.00 0.00 42.46 38.71 2c44 s ILE 222 CO 0.79 0.34 1.45 -2.65 0.00 0.00 0.00 174.94 174.87 2c44 n PRO 223 N 4.37 2.31 -3.95 2.79 -0.02 -1.26 -4.62 135.00 134.61 2c44 n PRO 223 Ca -0.15 0.82 -0.35 0.00 -2.02 0.00 0.00 63.50 61.80 2c44 n PRO 223 Cb 0.52 -2.51 -0.14 0.00 -0.02 0.00 0.00 33.50 31.35 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 -0.28 3.03 -0.23 -1.45 1.01 -1.26 -1.44 120.40 119.78 2c44 s VAL 224 Ca 0.64 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.83 2c44 s VAL 224 Cb -0.57 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 2c44 s VAL 224 CO 0.52 0.38 0.07 -0.69 0.00 0.00 0.00 175.10 175.38 2c44 s VAL 225 N 1.41 4.40 -0.53 2.92 1.01 -0.01 -0.83 120.40 128.77 2c44 s VAL 225 Ca 0.04 -0.15 -0.21 0.00 0.00 0.00 0.00 61.98 61.66 2c44 s VAL 225 Cb -0.15 -3.04 0.06 0.00 0.00 0.00 0.00 36.38 33.25 2c44 s VAL 225 CO -0.05 0.37 0.74 -0.32 0.00 0.00 0.00 175.10 175.84 2c44 s MET 226 N 1.31 3.19 -0.36 2.72 1.75 -0.22 -0.58 119.30 127.11 2c44 s MET 226 Ca 0.05 -0.70 -0.29 0.00 -1.25 0.00 0.00 55.69 53.50 2c44 s MET 226 Cb -0.15 -4.10 0.00 0.00 2.84 0.00 0.00 34.83 33.43 2c44 s MET 226 CO 0.03 -1.35 1.46 0.34 -0.65 0.00 0.00 175.02 174.86 2c44 s ASP 227 N 2.82 6.35 -0.24 1.11 -1.08 0.79 -2.06 116.67 124.37 2c44 s ASP 227 Ca 0.20 1.05 0.14 0.00 -0.52 0.00 0.00 52.55 53.42 2c44 s ASP 227 Cb -0.17 -2.54 0.64 0.00 -1.46 0.00 0.00 42.92 39.39 2c44 s ASP 227 CO 0.14 -1.38 1.58 -1.20 0.52 0.00 0.00 175.17 174.84 2c44 n SER 228 N 8.71 4.30 -0.30 -0.34 7.64 -0.53 -1.57 113.62 131.53 2c44 n SER 228 Ca 0.17 -3.14 0.13 0.00 1.01 0.00 0.00 58.87 57.04 2c44 n SER 228 Cb 0.47 -0.63 0.30 0.00 -1.01 0.00 0.00 64.21 63.34 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 2.32 1.42 -1.41 -0.43 0.00 -1.80 -2.65 119.26 116.71 2c44 h ALA 229 Ca 0.09 0.16 -0.55 0.00 0.00 0.00 0.00 54.91 54.61 2c44 h ALA 229 Cb 1.79 0.15 -0.42 0.00 0.00 0.00 0.00 17.79 19.31 2c44 h ALA 229 CO 0.42 -0.34 -0.80 0.54 0.00 0.00 0.00 179.25 179.06 2c44 n ARG 230 N -5.05 3.10 -0.04 0.00 1.74 -1.25 -2.17 116.66 113.00 2c44 n ARG 230 Ca 0.22 -4.31 -0.01 0.00 -0.77 0.00 0.00 57.85 52.97 2c44 n ARG 230 Cb 0.65 -2.10 0.26 0.00 -1.02 0.00 0.00 32.46 30.24 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 0.64 -0.28 -1.55 -0.00 -1.63 -2.84 116.94 113.90 2c44 h PHE 231 Ca 0.24 -0.06 -0.03 0.00 -0.00 0.00 0.00 57.97 58.12 2c44 h PHE 231 Cb 0.98 -0.19 -0.01 0.00 -0.00 0.00 0.00 35.95 36.74 2c44 h PHE 231 CO 0.77 0.59 0.05 0.00 -0.00 0.00 0.00 178.31 179.73 2c44 h ALA 232 N 1.45 0.37 -0.64 12.09 0.00 -1.88 -1.18 119.26 129.47 2c44 h ALA 232 Ca 0.13 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2c44 h ALA 232 Cb 0.32 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2c44 h ALA 232 CO 0.01 0.06 0.22 0.93 0.00 0.00 0.00 179.25 180.46 2c44 h GLU 233 N 0.28 0.97 -0.64 0.00 5.08 -1.89 -1.29 114.58 117.09 2c44 h GLU 233 Ca 0.09 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2c44 h GLU 233 Cb 0.33 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2c44 h GLU 233 CO 0.01 0.82 0.25 -0.97 -1.00 0.00 0.00 179.01 178.12 2c44 h ASN 234 N 0.94 0.88 -0.60 1.42 -1.24 -1.32 -1.60 115.58 114.07 2c44 h ASN 234 Ca 0.21 -0.17 -0.00 0.00 0.71 0.00 0.00 56.30 57.05 2c44 h ASN 234 Cb 0.24 -0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.03 2c44 h ASN 234 CO -0.01 0.82 0.37 0.00 -1.29 0.00 0.00 177.43 177.31 2c44 h ALA 235 N 1.10 1.50 -0.23 1.57 0.00 -0.54 -1.50 119.26 121.16 2c44 h ALA 235 Ca 0.21 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2c44 h ALA 235 Cb 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2c44 h ALA 235 CO -0.02 0.43 0.04 -0.92 0.00 0.00 0.00 179.25 178.78 2c44 h TYR 236 N 0.83 0.41 -0.56 0.00 3.20 -0.50 -1.62 116.97 118.73 2c44 h TYR 236 Ca 0.22 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 2c44 h TYR 236 Cb -0.03 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.10 2c44 h TYR 236 CO 0.00 0.52 0.12 0.74 -1.64 0.00 0.00 178.16 177.90 2c44 h PHE 237 N 0.19 0.92 -0.33 -3.82 0.04 -0.92 -1.16 116.94 111.85 2c44 h PHE 237 Ca 0.07 -0.10 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 2c44 h PHE 237 Cb 0.33 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 2c44 h PHE 237 CO 0.02 0.78 0.19 0.82 -0.60 0.00 0.00 178.31 179.52 2c44 h ILE 238 N 0.84 1.13 -0.18 -0.55 2.04 -1.16 0.26 117.51 119.90 2c44 h ILE 238 Ca 0.18 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2c44 h ILE 238 Cb 0.34 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2c44 h ILE 238 CO 0.00 0.13 0.04 0.50 0.00 0.00 0.00 178.15 178.82 2c44 h LYS 239 N 0.42 0.24 0.00 2.37 3.64 -0.64 0.17 116.57 122.77 2c44 h LYS 239 Ca 0.12 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.31 2c44 h LYS 239 Cb 0.04 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2c44 h LYS 239 CO -0.02 0.23 -1.38 1.96 -2.27 0.00 0.00 179.45 177.97 2c44 h GLN 240 N 0.25 0.00 0.00 1.90 1.08 -0.72 -3.35 115.11 114.27 2c44 h GLN 240 Ca 0.06 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.20 2c44 h GLN 240 Cb 0.10 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 2c44 h GLN 240 CO -0.00 0.29 -1.38 0.54 -0.95 0.00 0.00 178.83 177.33 2c44 n ARG 241 N -2.90 1.65 -3.18 1.46 1.74 0.87 -4.93 116.66 111.37 2c44 n ARG 241 Ca -0.09 -0.03 -0.45 0.00 -0.77 0.00 0.00 57.85 56.51 2c44 n ARG 241 Cb 0.83 -1.16 -0.05 0.00 -1.02 0.00 0.00 32.46 31.06 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 -2.31 3.05 0.17 5.56 2.12 0.58 -4.97 118.70 122.91 2c44 s GLU 242 Ca -0.03 -1.26 -0.07 0.00 0.36 0.00 0.00 54.97 53.98 2c44 s GLU 242 Cb 0.03 -4.21 0.26 0.00 0.26 0.00 0.00 34.13 30.47 2c44 s GLU 242 CO 0.27 -1.36 1.01 0.00 -0.54 0.00 0.00 175.26 174.64 2c44 n ALA 243 N 6.00 0.09 0.10 6.30 0.00 -1.26 -0.52 120.51 131.23 2c44 n ALA 243 Ca -0.10 0.70 0.18 0.00 0.00 0.00 0.00 53.44 54.22 2c44 n ALA 243 Cb 0.43 -0.39 0.74 0.00 0.00 0.00 0.00 19.45 20.23 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 -0.34 0.00 4.81 -1.93 -2.85 114.58 114.27 2c44 h GLU 244 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2c44 h GLU 244 Cb 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2c44 h GLU 244 CO -0.66 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.28 2c44 n TYR 245 N -4.09 0.51 -0.34 0.92 4.01 0.32 -4.68 117.16 113.80 2c44 n TYR 245 Ca 0.06 -0.53 0.20 0.00 -0.16 0.00 0.00 57.90 57.47 2c44 n TYR 245 Cb 0.48 -0.05 0.42 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 2.02 0.47 -0.66 -0.72 6.56 -1.48 -0.80 116.57 121.96 2c44 h LYS 246 Ca 0.00 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 2c44 h LYS 246 Cb 0.79 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.35 2c44 h LYS 246 CO 0.02 0.31 0.00 -0.25 -2.06 0.00 0.00 179.45 177.47 2c44 n ASP 247 N -4.92 4.15 -4.91 0.86 8.00 -1.26 -4.89 116.55 113.57 2c44 n ASP 247 Ca 0.29 -2.26 -0.27 0.00 0.71 0.00 0.00 54.79 53.26 2c44 n ASP 247 Cb 0.84 -0.52 -0.01 0.00 -0.02 0.00 0.00 41.12 41.41 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 -1.55 3.53 0.47 1.24 0.52 -0.31 -5.08 118.94 117.77 2c44 s TRP 248 Ca 0.47 0.71 -0.04 0.00 0.02 0.00 0.00 56.10 57.26 2c44 s TRP 248 Cb 0.28 -2.20 -0.02 0.00 -1.15 0.00 0.00 33.47 30.37 2c44 s TRP 248 CO 0.26 -0.13 0.75 0.95 0.02 0.00 0.00 176.95 178.80 2c44 s THR 249 N -2.56 4.60 0.26 2.01 -4.23 -1.26 -4.89 115.64 109.57 2c44 s THR 249 Ca 0.46 -0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 60.90 2c44 s THR 249 Cb -0.10 -3.74 0.27 0.00 1.34 0.00 0.00 72.50 70.27 2c44 s THR 249 CO 0.40 -0.66 1.89 0.40 -0.54 0.00 0.00 174.62 176.11 2c44 h ILE 250 N 0.27 1.11 -0.42 2.99 1.08 -1.91 -0.02 117.51 120.60 2c44 h ILE 250 Ca -0.47 -0.41 -0.02 0.00 -0.39 0.00 0.00 64.86 63.57 2c44 h ILE 250 Cb 1.22 -0.20 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 2c44 h ILE 250 CO 0.61 0.22 0.20 -0.33 -0.69 0.00 0.00 178.15 178.16 2c44 h GLU 251 N 1.20 0.60 -0.39 2.37 3.07 -1.93 -0.54 114.58 118.97 2c44 h GLU 251 Ca 0.43 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.36 59.15 2c44 h GLU 251 Cb 0.13 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2c44 h GLU 251 CO -0.16 0.52 0.06 1.96 -1.40 0.00 0.00 179.01 179.99 2c44 h GLN 252 N 0.54 0.64 -0.75 2.33 4.20 -1.73 -1.55 115.11 118.79 2c44 h GLN 252 Ca 0.14 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2c44 h GLN 252 Cb 0.12 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2c44 h GLN 252 CO -0.02 0.70 0.34 0.82 -0.67 0.00 0.00 178.83 180.00 2c44 h ILE 253 N 0.49 1.24 -0.08 2.54 2.04 -0.90 -1.59 117.51 121.26 2c44 h ILE 253 Ca 0.12 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 2c44 h ILE 253 Cb 0.37 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 2c44 h ILE 253 CO 0.01 0.29 0.02 0.74 0.00 0.00 0.00 178.15 179.21 2c44 h THR 254 N 1.07 1.19 -0.59 -0.27 2.02 -0.89 0.60 112.91 116.04 2c44 h THR 254 Ca 0.26 -0.57 0.08 0.00 0.77 0.00 0.00 66.41 66.95 2c44 h THR 254 Cb 0.13 1.42 -0.06 0.00 -1.74 0.00 0.00 68.15 67.90 2c44 h THR 254 CO -0.03 0.16 0.25 -0.09 0.37 0.00 0.00 175.52 176.18 2c44 h ARG 255 N -0.08 0.45 0.10 6.66 9.65 -1.05 -1.66 114.38 128.44 2c44 h ARG 255 Ca 0.02 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2c44 h ARG 255 Cb 0.24 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 2c44 h ARG 255 CO -0.00 0.29 -0.05 1.49 2.80 0.00 0.00 179.97 184.51 2c44 h GLU 256 N 0.46 -0.12 -0.68 0.20 4.57 -1.12 -3.14 114.58 114.75 2c44 h GLU 256 Ca 0.29 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.62 2c44 h GLU 256 Cb 0.31 0.03 -0.11 0.00 -0.16 0.00 0.00 28.75 28.81 2c44 h GLU 256 CO -0.26 0.03 0.07 1.15 -1.18 0.00 0.00 179.01 178.81 2c44 h THR 257 N -0.25 0.47 0.00 0.32 2.02 -0.28 -1.89 112.91 113.30 2c44 h THR 257 Ca -0.01 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2c44 h THR 257 Cb 0.21 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2c44 h THR 257 CO 0.02 0.03 0.00 -1.22 0.37 0.00 0.00 175.52 174.72 2c44 n TYR 258 N -5.25 0.00 0.98 3.16 4.01 -0.68 -2.29 117.16 117.09 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 0.46 0.00 -0.31 0.00 0.00 39.34 39.90 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 -0.69 0.02 -1.75 -0.72 5.02 -0.71 -3.96 118.16 115.37 2c44 n LYS 259 Ca 0.06 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.04 2c44 n LYS 259 Cb 0.03 -1.51 0.05 0.00 -0.02 0.00 0.00 35.03 33.57 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 -1.54 3.08 -3.47 2.13 4.01 -0.97 -4.93 117.16 115.47 2c44 n TYR 260 Ca 0.06 -2.70 -0.11 0.00 -0.16 0.00 0.00 57.90 54.99 2c44 n TYR 260 Cb 0.34 -0.95 -0.02 0.00 -0.31 0.00 0.00 39.34 38.40 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 -3.78 -1.57 -0.05 -0.72 0.00 -1.25 -4.67 121.76 109.72 2c44 s ALA 261 Ca 0.57 0.42 0.21 0.00 0.00 0.00 0.00 51.96 53.15 2c44 s ALA 261 Cb 0.46 0.88 -0.31 0.00 0.00 0.00 0.00 23.12 24.14 2c44 s ALA 261 CO -0.08 -0.80 0.41 -0.25 0.00 0.00 0.00 175.76 175.04 2c44 n ASP 262 N -0.39 0.22 -3.85 0.00 8.00 -0.01 -4.88 116.55 115.64 2c44 n ASP 262 Ca -0.16 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.27 2c44 n ASP 262 Cb 0.64 1.82 -0.02 0.00 -0.02 0.00 0.00 41.12 43.54 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 -3.32 1.75 0.02 -1.24 0.23 -1.08 -1.10 119.30 114.57 2c44 s MET 263 Ca -0.08 -0.98 0.02 0.00 -1.03 0.00 0.00 55.69 53.62 2c44 s MET 263 Cb 0.12 0.60 -0.01 0.00 -1.53 0.00 0.00 34.83 34.01 2c44 s MET 263 CO 0.86 -0.80 -0.08 -0.48 -2.03 0.00 0.00 175.02 172.49 2c44 s LEU 264 N -2.92 2.12 -0.11 0.18 0.05 0.86 -1.06 118.68 117.80 2c44 s LEU 264 Ca 0.11 -0.31 0.02 0.00 0.05 0.00 0.00 54.13 54.00 2c44 s LEU 264 Cb -0.05 -0.32 0.01 0.00 -2.05 0.00 0.00 46.19 43.78 2c44 s LEU 264 CO 0.06 -0.02 -0.16 0.00 -0.55 0.00 0.00 176.35 175.68 2c44 s ALA 265 N -0.65 1.74 -0.00 1.48 0.00 -0.87 -0.96 121.76 122.49 2c44 s ALA 265 Ca -0.02 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2c44 s ALA 265 Cb -0.06 -0.83 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 2c44 s ALA 265 CO 0.00 -0.04 -0.02 1.41 0.00 0.00 0.00 175.76 177.12 2c44 s MET 266 N 0.91 0.16 -0.64 0.00 0.00 0.74 -1.45 119.30 119.02 2c44 s MET 266 Ca -0.08 -0.07 -0.18 0.00 0.00 0.00 0.00 55.69 55.37 2c44 s MET 266 Cb -0.15 -0.16 0.13 0.00 0.00 0.00 0.00 34.83 34.64 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 6.30 0.12 1.11 0.15 -1.26 -0.55 113.70 119.54 2c44 s SER 267 Ca 0.01 -1.74 0.11 0.00 0.70 0.00 0.00 55.95 55.03 2c44 s SER 267 Cb -0.01 -2.28 0.54 0.00 -1.71 0.00 0.00 66.02 62.56 2c44 s SER 267 CO -0.00 -0.98 1.34 0.00 1.20 0.00 0.00 173.24 174.79 2c44 n ALA 268 N 5.80 1.18 0.49 5.45 0.00 0.12 -3.06 120.51 130.49 2c44 n ALA 268 Ca -0.04 0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.49 2c44 n ALA 268 Cb 0.43 -1.17 0.22 0.00 0.00 0.00 0.00 19.45 18.93 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 -1.80 0.24 0.00 0.00 5.02 -1.19 -3.41 118.16 117.02 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 0.08 1.97 4.01 -1.17 -0.12 118.16 121.94 2c44 n LYS 270 Ca 0.06 0.00 0.07 0.00 -0.51 0.00 0.00 58.31 57.92 2c44 n LYS 270 Cb 0.03 0.00 0.51 0.00 -0.51 0.00 0.00 35.03 35.06 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 0.29 0.39 4.39 5.19 -1.64 0.13 116.42 125.17 2c44 h ASP 271 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 2c44 h ASP 271 Cb 0.00 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.44 2c44 h ASP 271 CO 0.00 0.20 0.00 0.00 -3.12 0.00 0.00 179.24 176.32 2c44 n ALA 272 N -2.51 1.57 -1.45 3.45 0.00 -1.22 -4.34 120.51 116.00 2c44 n ALA 272 Ca 0.02 -0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.26 2c44 n ALA 272 Cb 0.13 -1.19 -0.07 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.48 -1.15 -3.89 0.00 2.81 0.46 -4.19 117.12 109.67 2c44 n MET 273 Ca 0.03 1.05 -0.31 0.00 -1.81 0.00 0.00 57.70 56.65 2c44 n MET 273 Cb 0.14 -5.24 -0.04 0.00 -0.71 0.00 0.00 33.22 27.37 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 -2.55 5.37 -0.73 2.03 -7.23 -1.23 -4.56 120.40 111.50 2c44 s VAL 274 Ca 0.00 -0.31 0.21 0.00 -1.81 0.00 0.00 61.98 60.07 2c44 s VAL 274 Cb 0.00 -3.62 0.20 0.00 0.56 0.00 0.00 36.38 33.52 2c44 s VAL 274 CO 0.00 0.15 1.64 -0.81 -0.31 0.00 0.00 175.10 175.77 2c44 n PRO 275 N 0.34 0.12 -3.63 4.82 -0.04 -1.26 -4.08 135.00 131.26 2c44 n PRO 275 Ca -0.05 0.31 -0.13 0.00 -0.04 0.00 0.00 63.50 63.59 2c44 n PRO 275 Cb 0.51 -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 -3.16 0.79 0.00 0.54 -2.45 -1.26 -4.63 119.30 109.13 2c44 s MET 276 Ca 0.06 0.98 0.00 0.00 -1.25 0.00 0.00 55.69 55.48 2c44 s MET 276 Cb 0.10 0.37 0.00 0.00 1.25 0.00 0.00 34.83 36.55 2c44 s MET 276 CO 0.37 -0.10 0.00 0.41 1.05 0.00 0.00 175.02 176.75 2c44 n GLY 277 N 2.79 4.45 3.56 2.11 0.00 0.27 -4.85 105.19 113.52 2c44 n GLY 277 Ca -0.14 -0.97 -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 0.44 -0.03 -0.02 0.00 0.30 -0.70 107.32 107.31 2c44 s GLY 278 Ca 0.00 -0.79 -0.08 0.00 0.00 0.00 0.00 44.72 43.85 2c44 s GLY 278 CO 0.00 -0.59 0.19 1.08 0.00 0.00 0.00 173.10 173.78 2c44 s LEU 279 N -2.99 1.30 -0.23 0.66 1.43 0.28 -2.06 118.68 117.07 2c44 s LEU 279 Ca 0.20 0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2c44 s LEU 279 Cb -0.00 0.78 0.07 0.00 0.03 0.00 0.00 46.19 47.07 2c44 s LEU 279 CO 0.07 -0.26 0.07 -0.22 0.23 0.00 0.00 176.35 176.24 2c44 s LEU 280 N -0.76 1.17 0.06 1.79 2.96 -0.36 -0.18 118.68 123.36 2c44 s LEU 280 Ca -0.08 -1.02 0.05 0.00 -0.22 0.00 0.00 54.13 52.85 2c44 s LEU 280 Cb -0.05 -0.56 -0.03 0.00 0.50 0.00 0.00 46.19 46.06 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 -1.48 2.81 0.09 0.00 -1.94 -0.24 -0.10 119.30 118.45 2c44 s MET 282 Ca -0.00 -0.60 -0.27 0.00 -1.71 0.00 0.00 55.69 53.11 2c44 s MET 282 Cb -0.09 -2.56 -0.13 0.00 2.01 0.00 0.00 34.83 34.05 2c44 s MET 282 CO 0.02 0.58 1.67 -0.22 -0.01 0.00 0.00 175.02 177.06 2c44 h LYS 283 N 5.53 -0.43 0.00 2.03 3.64 -1.42 -2.21 116.57 123.71 2c44 h LYS 283 Ca -0.45 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 58.90 2c44 h LYS 283 Cb 1.17 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 2c44 h LYS 283 CO 0.53 -0.29 0.00 -0.40 -2.27 0.00 0.00 179.45 177.02 2c44 n ASP 284 N -5.32 -0.53 -0.32 4.20 5.68 -1.26 -1.87 116.55 117.13 2c44 n ASP 284 Ca -0.09 -1.56 0.19 0.00 -0.50 0.00 0.00 54.79 52.83 2c44 n ASP 284 Cb 0.23 0.94 0.40 0.00 -1.14 0.00 0.00 41.12 41.54 2c44 n ASP 284 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2c44 h ASP 285 N 0.62 0.40 0.00 -1.12 3.45 -2.00 -0.07 116.42 117.70 2c44 h ASP 285 Ca -0.09 0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.55 2c44 h ASP 285 Cb 0.38 0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 2c44 h ASP 285 CO 0.12 -0.09 0.27 0.77 -1.57 0.00 0.00 179.24 178.74 2c44 h SER 286 N 0.35 0.00 -0.15 6.45 4.64 -2.00 0.32 113.55 123.15 2c44 h SER 286 Ca 0.66 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 2c44 h SER 286 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 2c44 h SER 286 CO -0.59 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 175.86 2c44 n PHE 287 N -2.77 0.42 -0.26 4.77 3.72 -0.04 -4.68 117.46 118.62 2c44 n PHE 287 Ca -0.02 -0.82 0.10 0.00 -0.05 0.00 0.00 57.45 56.67 2c44 n PHE 287 Cb 0.31 -0.18 0.36 0.00 -0.94 0.00 0.00 39.48 39.03 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 0.96 0.84 -0.47 1.38 3.57 -0.38 -1.56 116.94 121.29 2c44 h PHE 288 Ca 0.00 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 2c44 h PHE 288 Cb 1.06 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 2c44 h PHE 288 CO 0.22 0.35 0.15 -0.44 -2.23 0.00 0.00 178.31 176.35 2c44 h ASP 289 N 0.75 0.68 0.31 0.41 3.32 -1.83 -0.94 116.42 119.12 2c44 h ASP 289 Ca 0.42 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 57.18 2c44 h ASP 289 Cb 0.59 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2c44 h ASP 289 CO -0.18 0.71 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.30 2c44 h VAL 290 N 0.62 1.28 0.29 -1.35 -1.51 -1.75 -1.03 116.25 112.81 2c44 h VAL 290 Ca 0.15 -1.36 -0.01 0.00 -1.23 0.00 0.00 66.70 64.25 2c44 h VAL 290 Cb 0.27 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 2c44 h VAL 290 CO -0.00 0.40 -0.14 0.22 -1.23 0.00 0.00 177.57 176.81 2c44 h TYR 291 N 0.09 -0.36 0.00 5.19 5.03 -0.65 0.28 116.97 126.55 2c44 h TYR 291 Ca 0.01 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.25 2c44 h TYR 291 Cb 0.71 0.12 -0.01 0.00 1.55 0.00 0.00 36.73 39.10 2c44 h TYR 291 CO 0.00 -0.21 -0.29 1.79 -1.32 0.00 0.00 178.16 178.14 2c44 h THR 292 N -0.41 0.83 -0.17 1.81 1.35 -1.01 -0.89 112.91 114.43 2c44 h THR 292 Ca -0.04 -1.15 -0.14 0.00 -0.55 0.00 0.00 66.41 64.53 2c44 h THR 292 Cb 0.32 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.43 2c44 h THR 292 CO 0.07 0.28 -0.49 -0.33 -0.25 0.00 0.00 175.52 174.79 2c44 h GLU 293 N 0.00 0.44 0.00 4.72 4.39 -0.68 -2.41 114.58 121.03 2c44 h GLU 293 Ca -0.00 -0.25 -0.13 0.00 0.34 0.00 0.00 59.36 59.32 2c44 h GLU 293 Cb 0.68 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 2c44 h GLU 293 CO 0.04 0.83 -0.61 0.00 -1.16 0.00 0.00 179.01 178.11 2c44 h ARG 295 N 0.00 0.58 -0.30 0.00 3.08 -0.89 0.46 114.38 117.31 2c44 h ARG 295 Ca -0.01 -0.26 -0.07 0.00 0.07 0.00 0.00 59.98 59.72 2c44 h ARG 295 Cb 1.13 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 2c44 h ARG 295 CO 0.08 0.83 -0.08 1.15 -1.07 0.00 0.00 179.97 180.88 2c44 h THR 296 N 0.49 1.28 0.00 2.04 2.02 -1.23 -2.80 112.91 114.71 2c44 h THR 296 Ca 0.06 -1.13 -0.12 0.00 0.77 0.00 0.00 66.41 65.99 2c44 h THR 296 Cb 0.80 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2c44 h THR 296 CO 0.07 0.36 -0.59 0.25 0.37 0.00 0.00 175.52 175.97 2c44 h LEU 297 N 0.36 0.00 -0.69 2.58 5.85 -1.33 -3.15 115.31 118.94 2c44 h LEU 297 Ca 0.08 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 2c44 h LEU 297 Cb 0.57 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2c44 h LEU 297 CO 0.03 0.59 0.13 0.00 -0.34 0.00 0.00 178.44 178.85 2c44 h VAL 299 N 1.05 0.92 0.09 0.00 2.07 -1.44 0.29 116.25 119.23 2c44 h VAL 299 Ca 0.21 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.41 2c44 h VAL 299 Cb 0.42 0.31 0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2c44 h VAL 299 CO 0.01 0.10 -0.54 0.58 0.02 0.00 0.00 177.57 177.75 2c44 h VAL 300 N 0.56 1.60 0.06 2.57 2.07 -1.48 -3.35 116.25 118.27 2c44 h VAL 300 Ca 0.32 -2.43 -0.30 0.00 0.82 0.00 0.00 66.70 65.11 2c44 h VAL 300 Cb 0.49 3.21 -0.03 0.00 -1.52 0.00 0.00 31.29 33.44 2c44 h VAL 300 CO -0.10 0.67 -1.62 1.56 0.02 0.00 0.00 177.57 178.10 2c44 h GLN 301 N -0.55 0.12 0.00 1.57 1.08 -0.99 -3.45 115.11 112.90 2c44 h GLN 301 Ca -0.09 -0.21 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 2c44 h GLN 301 Cb 1.41 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.91 2c44 h GLN 301 CO 0.10 0.87 -0.97 0.39 -0.95 0.00 0.00 178.83 178.27 2c44 n GLU 302 N -3.28 0.00 -2.18 1.46 -0.58 0.86 -5.08 120.64 111.84 2c44 n GLU 302 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2c44 n GLU 302 Cb 1.04 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 31.15 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 -0.85 3.68 0.62 0.00 -0.20 -3.42 105.19 108.24 2c44 n GLY 303 Ca 0.00 -1.59 -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 2.26 2.19 0.00 1.61 7.35 -1.26 -3.14 117.46 126.47 2c44 n PHE 304 Ca 0.00 0.48 0.00 0.00 -0.76 0.00 0.00 57.45 57.17 2c44 n PHE 304 Cb 0.00 -2.44 0.00 0.00 0.35 0.00 0.00 39.48 37.39 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 1.48 0.00 -0.17 -7.13 -0.04 -1.26 -0.10 135.00 127.78 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 -1.33 0.19 0.00 -0.04 0.00 0.00 33.50 32.65 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 -0.81 0.55 0.00 0.52 -2.24 -1.26 -4.26 114.28 106.77 2c44 n THR 306 Ca 0.00 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 2c44 n THR 306 Cb 0.00 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 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 -3.68 4.78 4.11 -0.79 -4.54 117.16 118.26 2c44 n TYR 307 Ca 0.17 0.00 -0.24 0.00 -0.00 0.00 0.00 57.90 57.83 2c44 n TYR 307 Cb 0.53 0.00 -0.06 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 -0.14 0.78 -7.48 0.00 0.85 -0.22 105.19 99.01 2c44 n GLY 308 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.71 0.77 3.40 -0.02 0.00 -1.22 -1.57 105.19 104.85 2c44 n GLY 309 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 2.50 0.65 0.99 1.43 0.69 -4.47 118.68 120.46 2c44 s LEU 310 Ca 0.00 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 2c44 s LEU 310 Cb 0.00 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 2c44 s LEU 310 CO 0.00 0.31 1.05 -1.83 0.23 0.00 0.00 176.35 176.11 2c44 s GLU 311 N -0.53 3.25 0.19 1.70 -1.05 -1.26 -4.79 118.70 116.21 2c44 s GLU 311 Ca 0.07 0.94 -0.19 0.00 -0.15 0.00 0.00 54.97 55.63 2c44 s GLU 311 Cb -0.11 -2.03 0.15 0.00 -0.44 0.00 0.00 34.13 31.70 2c44 s GLU 311 CO 0.01 -0.85 1.59 0.78 0.95 0.00 0.00 175.26 177.74 2c44 h GLY 312 N -0.30 -0.02 1.03 -3.83 0.00 -1.90 0.35 103.07 98.39 2c44 h GLY 312 Ca -0.45 0.42 0.07 0.00 0.00 0.00 0.00 47.33 47.37 2c44 h GLY 312 CO 0.59 -0.22 0.46 -1.33 0.00 0.00 0.00 176.54 176.04 2c44 h GLY 313 N -0.13 0.90 1.59 4.60 0.00 -1.83 -1.10 103.07 107.09 2c44 h GLY 313 Ca 0.25 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 2c44 h GLY 313 CO -0.71 0.20 0.05 0.00 0.00 0.00 0.00 176.54 176.07 2c44 h ALA 314 N 1.62 1.43 -0.05 3.60 0.00 -1.24 0.11 119.26 124.73 2c44 h ALA 314 Ca 0.31 -0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2c44 h ALA 314 Cb 0.32 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2c44 h ALA 314 CO -0.10 0.41 -0.87 0.52 0.00 0.00 0.00 179.25 179.21 2c44 h MET 315 N 0.51 0.52 -0.53 0.00 2.86 -0.82 -1.47 114.93 116.01 2c44 h MET 315 Ca 0.11 -0.50 -0.06 0.00 -2.06 0.00 0.00 59.70 57.20 2c44 h MET 315 Cb 0.26 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2c44 h MET 315 CO 0.00 1.13 0.10 0.93 1.06 0.00 0.00 176.91 180.13 2c44 h GLU 316 N 0.33 0.86 -0.67 1.72 4.39 -0.88 -0.81 114.58 119.52 2c44 h GLU 316 Ca -0.07 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 2c44 h GLU 316 Cb 1.48 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 30.00 2c44 h GLU 316 CO 0.16 0.83 0.32 -0.09 -1.16 0.00 0.00 179.01 179.07 2c44 h ARG 317 N 0.75 0.98 -0.34 2.33 2.43 -0.75 -2.66 114.38 117.12 2c44 h ARG 317 Ca 0.16 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 2c44 h ARG 317 Cb 0.38 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2c44 h ARG 317 CO 0.01 0.78 -0.30 1.25 -1.51 0.00 0.00 179.97 180.20 2c44 h LEU 318 N 0.94 0.75 -1.96 3.80 5.85 -1.02 0.40 115.31 124.06 2c44 h LEU 318 Ca 0.23 -0.30 0.07 0.00 0.84 0.00 0.00 57.88 58.72 2c44 h LEU 318 Cb 0.13 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2c44 h LEU 318 CO -0.03 1.00 0.19 0.00 -0.34 0.00 0.00 178.44 179.27 2c44 h ALA 319 N 1.05 2.20 0.15 1.25 0.00 -0.82 -1.62 119.26 121.48 2c44 h ALA 319 Ca 0.07 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 319 Cb 0.81 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2c44 h ALA 319 CO 0.07 -0.27 -1.77 0.28 0.00 0.00 0.00 179.25 177.56 2c44 h VAL 320 N 0.05 0.85 -1.00 0.00 2.07 -1.15 -3.38 116.25 113.69 2c44 h VAL 320 Ca 0.13 -2.43 0.06 0.00 0.82 0.00 0.00 66.70 65.27 2c44 h VAL 320 Cb 0.45 2.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.82 2c44 h VAL 320 CO -0.01 0.84 0.64 1.23 0.02 0.00 0.00 177.57 180.30 2c44 h GLY 321 N 0.67 1.50 0.96 2.17 0.00 -0.30 -1.03 103.07 107.04 2c44 h GLY 321 Ca -0.36 -0.48 0.14 0.00 0.00 0.00 0.00 47.33 46.63 2c44 h GLY 321 CO 0.12 0.35 0.39 1.41 0.00 0.00 0.00 176.54 178.82 2c44 h LEU 322 N 1.19 0.13 0.00 3.11 3.38 -1.48 0.13 115.31 121.76 2c44 h LEU 322 Ca 0.42 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.32 2c44 h LEU 322 Cb 0.13 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2c44 h LEU 322 CO -0.16 0.07 -0.54 1.88 0.09 0.00 0.00 178.44 179.77 2c44 h TYR 323 N 0.14 0.00 -0.68 1.13 0.05 -1.45 -3.36 116.97 112.80 2c44 h TYR 323 Ca 0.27 0.00 0.13 0.00 0.05 0.00 0.00 58.73 59.18 2c44 h TYR 323 Cb 0.87 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.57 2c44 h TYR 323 CO -0.00 0.74 0.46 -0.44 -1.05 0.00 0.00 178.16 177.86 2c44 h ASP 324 N -1.00 0.34 0.70 3.88 5.19 -0.98 0.59 116.42 125.15 2c44 h ASP 324 Ca -0.12 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.31 2c44 h ASP 324 Cb 0.80 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.25 2c44 h ASP 324 CO -0.07 0.19 0.00 1.23 -3.12 0.00 0.00 179.24 177.47 2c44 h GLY 325 N 0.37 0.00 -0.57 2.75 0.00 -0.90 -2.86 103.07 101.85 2c44 h GLY 325 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2c44 h GLY 325 CO -0.09 0.00 -0.17 1.03 0.00 0.00 0.00 176.54 177.31 2c44 n MET 326 N -2.43 1.42 -1.68 4.80 2.81 0.20 -4.78 117.12 117.46 2c44 n MET 326 Ca 0.01 -0.98 -0.46 0.00 -1.81 0.00 0.00 57.70 54.47 2c44 n MET 326 Cb 0.22 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.21 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 0.06 3.35 -0.20 7.83 2.85 -1.08 -4.78 115.26 123.30 2c44 n ASN 327 Ca 0.14 1.05 -0.07 0.00 -0.11 0.00 0.00 54.58 55.59 2c44 n ASN 327 Cb 0.41 -1.45 0.03 0.00 1.24 0.00 0.00 39.78 40.01 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 6.83 0.71 -0.78 1.20 5.85 -1.92 -1.18 115.31 126.02 2c44 h LEU 328 Ca -0.45 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.12 2c44 h LEU 328 Cb 1.25 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 2c44 h LEU 328 CO 0.91 0.61 0.34 0.44 -0.34 0.00 0.00 178.44 180.40 2c44 h ASP 329 N 0.76 1.05 0.80 1.25 3.45 -1.99 -1.23 116.42 120.51 2c44 h ASP 329 Ca 0.20 -0.16 -0.04 0.00 0.43 0.00 0.00 57.03 57.46 2c44 h ASP 329 Cb 0.07 -0.27 0.01 0.00 -0.56 0.00 0.00 39.33 38.57 2c44 h ASP 329 CO -0.03 0.92 -0.39 -0.25 -1.57 0.00 0.00 179.24 177.92 2c44 h TRP 330 N 1.12 -1.00 -0.74 4.55 -0.00 -1.87 -1.76 115.95 116.24 2c44 h TRP 330 Ca 0.26 -0.02 0.11 0.00 -0.00 0.00 0.00 58.89 59.24 2c44 h TRP 330 Cb 0.18 0.33 -0.08 0.00 -0.00 0.00 0.00 29.16 29.59 2c44 h TRP 330 CO 0.02 -0.62 0.35 -0.07 -0.00 0.00 0.00 178.44 178.11 2c44 h LEU 331 N -1.09 0.41 -0.68 0.65 3.38 -1.09 0.73 115.31 117.62 2c44 h LEU 331 Ca -0.11 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2c44 h LEU 331 Cb 0.83 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 2c44 h LEU 331 CO 0.18 0.21 0.44 0.00 0.09 0.00 0.00 178.44 179.36 2c44 h ALA 332 N 1.48 0.87 0.38 1.53 0.00 -1.14 -1.44 119.26 120.94 2c44 h ALA 332 Ca 0.38 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 2c44 h ALA 332 Cb 0.48 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2c44 h ALA 332 CO -0.32 0.31 -0.18 -0.92 0.00 0.00 0.00 179.25 178.13 2c44 h TYR 333 N 0.93 -0.47 -0.22 0.00 3.20 -0.28 -1.17 116.97 118.96 2c44 h TYR 333 Ca 0.25 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.17 2c44 h TYR 333 Cb -0.09 0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.27 2c44 h TYR 333 CO -0.02 -0.17 -0.26 -0.09 -1.64 0.00 0.00 178.16 175.97 2c44 h ARG 334 N -0.75 -0.27 0.00 1.82 1.12 -0.80 -0.95 114.38 114.55 2c44 h ARG 334 Ca -0.05 0.02 -0.06 0.00 -1.11 0.00 0.00 59.98 58.78 2c44 h ARG 334 Cb 0.51 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.53 2c44 h ARG 334 CO 0.09 -0.18 -0.29 0.82 -3.11 0.00 0.00 179.97 177.30 2c44 h ILE 335 N -0.28 1.05 -0.11 1.20 2.04 -1.32 -2.45 117.51 117.64 2c44 h ILE 335 Ca 0.13 -1.04 -0.15 0.00 1.00 0.00 0.00 64.86 64.80 2c44 h ILE 335 Cb 0.48 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 2c44 h ILE 335 CO -0.39 0.28 -0.57 0.00 0.00 0.00 0.00 178.15 177.48 2c44 h ALA 336 N 1.71 0.83 -0.43 1.87 0.00 -0.28 -1.85 119.26 121.11 2c44 h ALA 336 Ca -0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.34 2c44 h ALA 336 Cb 0.57 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2c44 h ALA 336 CO 0.04 0.70 0.10 0.37 0.00 0.00 0.00 179.25 180.46 2c44 h GLN 337 N 0.26 0.69 -0.57 0.00 4.15 -0.73 -0.34 115.11 118.57 2c44 h GLN 337 Ca 0.00 -0.17 -0.03 0.00 0.77 0.00 0.00 58.65 59.23 2c44 h GLN 337 Cb 1.07 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.65 2c44 h GLN 337 CO 0.09 0.70 0.25 0.28 -1.93 0.00 0.00 178.83 178.23 2c44 h VAL 338 N 0.55 1.21 -0.67 2.39 2.07 -1.40 -1.87 116.25 118.55 2c44 h VAL 338 Ca 0.13 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.07 2c44 h VAL 338 Cb 0.32 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 2c44 h VAL 338 CO 0.00 0.25 0.39 -0.61 0.02 0.00 0.00 177.57 177.62 2c44 h GLN 339 N 0.78 0.71 -0.40 1.57 5.75 -1.03 -0.43 115.11 122.06 2c44 h GLN 339 Ca 0.19 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.69 2c44 h GLN 339 Cb 0.16 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 2c44 h GLN 339 CO -0.02 0.47 0.17 -0.92 -2.65 0.00 0.00 178.83 175.88 2c44 h TYR 340 N 0.73 0.30 -0.35 3.99 3.20 -0.46 0.13 116.97 124.51 2c44 h TYR 340 Ca 0.29 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 2c44 h TYR 340 Cb 0.12 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2c44 h TYR 340 CO -0.07 0.14 0.12 1.25 -1.64 0.00 0.00 178.16 177.96 2c44 h LEU 341 N 0.34 0.51 -0.49 2.82 5.85 -0.79 -0.57 115.31 122.98 2c44 h LEU 341 Ca 0.18 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2c44 h LEU 341 Cb 0.13 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2c44 h LEU 341 CO -0.16 0.57 0.28 0.58 -0.34 0.00 0.00 178.44 179.37 2c44 h VAL 342 N 0.42 1.17 -0.30 1.05 2.07 -0.67 -0.81 116.25 119.17 2c44 h VAL 342 Ca 0.11 -0.41 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 2c44 h VAL 342 Cb 0.24 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2c44 h VAL 342 CO -0.00 0.17 -0.20 0.44 0.02 0.00 0.00 177.57 178.00 2c44 h ASP 343 N 0.66 0.55 -0.39 0.57 3.32 -0.62 -0.98 116.42 119.52 2c44 h ASP 343 Ca 0.17 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 2c44 h ASP 343 Cb 0.03 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2c44 h ASP 343 CO -0.03 0.75 0.10 1.23 -1.72 0.00 0.00 179.24 179.57 2c44 h GLY 344 N 0.99 0.66 0.91 2.75 0.00 -0.65 -0.97 103.07 106.75 2c44 h GLY 344 Ca 0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2c44 h GLY 344 CO 0.04 0.38 0.06 1.41 0.00 0.00 0.00 176.54 178.44 2c44 h LEU 345 N 0.48 0.53 -1.95 3.11 3.38 -0.95 -2.41 115.31 117.49 2c44 h LEU 345 Ca 0.12 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c44 h LEU 345 Cb 0.29 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2c44 h LEU 345 CO -0.00 0.64 -0.03 -0.08 0.09 0.00 0.00 178.44 179.06 2c44 h GLU 346 N 0.39 0.00 0.00 1.13 4.57 -1.04 -1.25 114.58 118.38 2c44 h GLU 346 Ca 0.10 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 2c44 h GLU 346 Cb 0.33 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.92 2c44 h GLU 346 CO 0.00 0.03 -0.15 1.49 -1.18 0.00 0.00 179.01 179.21 2c44 h GLU 347 N 0.00 0.00 -0.70 1.92 4.81 -0.67 -2.65 114.58 117.30 2c44 h GLU 347 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2c44 h GLU 347 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2c44 h GLU 347 CO 0.00 0.15 0.00 0.44 -0.73 0.00 0.00 179.01 178.88 2c44 n ILE 348 N -3.24 1.48 -0.53 2.32 -5.35 -0.71 -4.94 119.36 108.40 2c44 n ILE 348 Ca 0.01 -1.11 0.00 0.00 -0.27 0.00 0.00 62.75 61.38 2c44 n ILE 348 Cb 0.44 0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 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 1.38 0.70 3.31 3.28 0.00 -1.00 -5.01 105.19 107.85 2c44 n GLY 349 Ca 0.26 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 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 4.70 0.23 1.61 1.01 -0.56 -5.00 120.40 120.39 2c44 s VAL 350 Ca 0.00 -1.36 -0.30 0.00 0.00 0.00 0.00 61.98 60.31 2c44 s VAL 350 Cb 0.00 -3.90 -0.10 0.00 0.00 0.00 0.00 36.38 32.38 2c44 s VAL 350 CO 0.00 -0.63 1.42 -0.69 0.00 0.00 0.00 175.10 175.20 2c44 s VAL 351 N 1.51 2.79 0.23 2.92 1.01 -1.26 -3.23 120.40 124.37 2c44 s VAL 351 Ca 0.04 0.65 0.03 0.00 0.00 0.00 0.00 61.98 62.70 2c44 s VAL 351 Cb -0.25 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 2c44 s VAL 351 CO 0.03 0.10 0.03 0.00 0.00 0.00 0.00 175.10 175.26 2c44 s GLN 353 N -3.92 3.15 0.45 0.00 2.00 -0.32 -4.80 119.66 116.22 2c44 s GLN 353 Ca 0.30 1.53 -0.25 0.00 -2.00 0.00 0.00 55.36 54.95 2c44 s GLN 353 Cb 0.06 -1.98 -0.09 0.00 0.80 0.00 0.00 33.01 31.80 2c44 s GLN 353 CO 0.09 -1.00 1.37 0.00 -0.50 0.00 0.00 175.29 175.25 2c44 n GLN 354 N -1.71 2.09 -1.66 1.67 10.64 -1.26 -4.65 117.38 122.50 2c44 n GLN 354 Ca 0.11 0.75 -0.59 0.00 -1.83 0.00 0.00 57.00 55.43 2c44 n GLN 354 Cb 0.51 -2.53 -0.08 0.00 -0.86 0.00 0.00 30.24 27.28 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 -0.27 -1.20 -2.18 2.61 0.00 -1.26 -4.95 120.51 113.26 2c44 n ALA 355 Ca 0.06 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2c44 n ALA 355 Cb 0.41 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.82 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 3.37 2.67 0.12 0.00 0.00 -1.26 -5.00 105.19 105.10 2c44 n GLY 356 Ca 0.25 -1.95 -0.17 0.00 0.00 0.00 0.00 46.02 44.15 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 0.22 -0.17 -0.02 0.00 -1.63 -3.43 103.07 98.03 2c44 h GLY 357 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2c44 h GLY 357 CO 0.00 0.49 -0.07 -2.39 0.00 0.00 0.00 176.54 174.57 2c44 n HIS 358 N -3.35 0.00 -3.56 5.60 1.44 -1.26 -4.56 115.22 109.52 2c44 n HIS 358 Ca -0.26 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.38 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 -0.73 -1.85 -0.19 1.59 0.00 -1.26 -1.50 121.76 117.81 2c44 s ALA 359 Ca 0.03 0.94 -0.14 0.00 0.00 0.00 0.00 51.96 52.78 2c44 s ALA 359 Cb 0.03 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.48 2c44 s ALA 359 CO 0.08 -0.75 0.33 0.00 0.00 0.00 0.00 175.76 175.42 2c44 s ALA 360 N -3.02 3.57 -0.42 0.00 0.00 -1.04 -4.21 121.76 116.65 2c44 s ALA 360 Ca 0.07 -0.56 -0.09 0.00 0.00 0.00 0.00 51.96 51.38 2c44 s ALA 360 Cb -0.01 -2.51 0.08 0.00 0.00 0.00 0.00 23.12 20.68 2c44 s ALA 360 CO -0.06 -0.16 0.26 -0.06 0.00 0.00 0.00 175.76 175.74 2c44 s PHE 361 N 1.00 3.33 0.16 0.00 0.40 -1.26 -0.55 117.98 121.06 2c44 s PHE 361 Ca 0.16 -1.49 -0.30 0.00 -0.60 0.00 0.00 56.93 54.71 2c44 s PHE 361 Cb -0.14 -2.94 -0.07 0.00 0.51 0.00 0.00 43.02 40.38 2c44 s PHE 361 CO 0.06 -0.84 1.05 0.08 0.70 0.00 0.00 175.22 176.27 2c44 s VAL 362 N 1.44 4.08 -1.01 -0.44 1.01 0.32 -1.18 120.40 124.62 2c44 s VAL 362 Ca 0.03 1.79 -0.19 0.00 0.00 0.00 0.00 61.98 63.61 2c44 s VAL 362 Cb -0.23 -4.14 0.11 0.00 0.00 0.00 0.00 36.38 32.12 2c44 s VAL 362 CO 0.02 0.31 1.29 -0.62 0.00 0.00 0.00 175.10 176.10 2c44 s ASP 363 N -0.15 6.66 0.40 3.32 3.68 -0.51 -0.23 116.67 129.84 2c44 s ASP 363 Ca 0.48 -2.02 0.09 0.00 2.13 0.00 0.00 52.55 53.23 2c44 s ASP 363 Cb -0.27 -2.46 0.87 0.00 -1.45 0.00 0.00 42.92 39.61 2c44 s ASP 363 CO 0.33 -1.15 1.98 0.00 0.13 0.00 0.00 175.17 176.46 2c44 h ALA 364 N 8.82 1.82 -0.23 3.66 0.00 -1.29 -1.27 119.26 130.77 2c44 h ALA 364 Ca 0.21 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2c44 h ALA 364 Cb 0.99 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2c44 h ALA 364 CO 1.23 0.08 0.00 0.78 0.00 0.00 0.00 179.25 181.34 2c44 h GLY 365 N 0.59 0.22 1.80 0.00 0.00 -1.80 0.49 103.07 104.37 2c44 h GLY 365 Ca 0.27 0.02 -0.14 0.00 0.00 0.00 0.00 47.33 47.48 2c44 h GLY 365 CO -0.08 -0.04 -0.59 0.50 0.00 0.00 0.00 176.54 176.33 2c44 h LYS 366 N 0.08 0.21 0.02 4.80 1.57 -1.69 -2.89 116.57 118.66 2c44 h LYS 366 Ca 0.11 -0.14 -0.21 0.00 -1.87 0.00 0.00 60.65 58.53 2c44 h LYS 366 Cb 0.13 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2c44 h LYS 366 CO -0.18 0.74 -0.96 1.25 -0.57 0.00 0.00 179.45 179.73 2c44 h LEU 367 N 0.16 0.25 -6.04 2.94 5.85 -0.80 -3.37 115.31 114.30 2c44 h LEU 367 Ca -0.00 -0.22 -0.58 0.00 0.84 0.00 0.00 57.88 57.91 2c44 h LEU 367 Cb 1.08 -0.08 -0.41 0.00 0.37 0.00 0.00 40.66 41.62 2c44 h LEU 367 CO 0.09 1.07 -0.75 0.18 -0.34 0.00 0.00 178.44 178.69 2c44 n LEU 368 N -3.59 2.82 0.31 2.25 4.77 0.17 -4.79 117.00 118.94 2c44 n LEU 368 Ca -0.04 -5.27 0.21 0.00 -0.03 0.00 0.00 56.01 50.88 2c44 n LEU 368 Cb 0.86 -0.27 1.06 0.00 -2.33 0.00 0.00 43.42 42.74 2c44 n LEU 368 CO 0.49 2.10 1.12 1.55 -1.33 0.00 0.00 177.39 181.32 2c44 h PRO 369 N 3.96 0.00 0.00 3.23 0.13 -1.68 -2.76 132.00 134.87 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 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2c44 h PRO 369 CO 0.73 0.00 0.00 1.12 -0.23 0.00 0.00 178.00 179.62 2c44 h HIS 370 N 0.00 0.00 -3.54 1.56 2.07 -1.92 -3.44 115.15 109.88 2c44 h HIS 370 Ca 0.00 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.91 2c44 h HIS 370 Cb 0.11 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 29.96 2c44 h HIS 370 CO 0.00 0.00 -0.33 0.42 -3.07 0.00 0.00 177.93 174.95 2c44 s ILE 371 N -3.17 5.26 0.39 6.12 1.01 -1.04 -5.05 121.20 124.72 2c44 s ILE 371 Ca 0.09 0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.96 2c44 s ILE 371 Cb 0.11 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 2c44 s ILE 371 CO 0.56 0.28 1.11 -2.16 0.00 0.00 0.00 174.94 174.73 2c44 s PRO 372 N 1.26 4.16 0.33 2.79 0.04 -1.26 -4.78 135.00 137.53 2c44 s PRO 372 Ca 0.14 1.68 0.12 0.00 0.04 0.00 0.00 61.00 62.98 2c44 s PRO 372 Cb -0.14 -2.66 0.99 0.00 0.04 0.00 0.00 34.50 32.72 2c44 s PRO 372 CO 0.07 -0.19 1.70 0.00 0.04 0.00 0.00 177.00 178.61 2c44 h ALA 373 N 2.68 1.87 -0.07 8.56 0.00 -1.97 0.72 119.26 131.05 2c44 h ALA 373 Ca -0.48 0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.61 2c44 h ALA 373 Cb 1.22 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2c44 h ALA 373 CO 0.63 -0.42 0.24 0.38 0.00 0.00 0.00 179.25 180.07 2c44 h ASP 374 N 0.45 0.00 -0.66 0.00 2.03 -1.97 0.42 116.42 116.70 2c44 h ASP 374 Ca 0.69 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.99 2c44 h ASP 374 Cb 1.45 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.95 2c44 h ASP 374 CO -0.54 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.67 2c44 n GLN 375 N -3.19 3.31 -3.53 4.15 6.02 0.25 -4.94 117.38 119.46 2c44 n GLN 375 Ca -0.01 -2.77 -0.18 0.00 -0.01 0.00 0.00 57.00 54.04 2c44 n GLN 375 Cb 0.31 -1.74 0.01 0.00 1.02 0.00 0.00 30.24 29.84 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 1.25 -2.33 -0.10 1.08 3.01 0.14 -0.98 117.46 119.53 2c44 n PHE 376 Ca 0.25 0.85 0.09 0.00 1.01 0.00 0.00 57.45 59.65 2c44 n PHE 376 Cb 0.77 -3.36 0.44 0.00 -0.01 0.00 0.00 39.48 37.33 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 -0.39 0.52 -0.09 -1.08 0.13 -1.79 -1.77 132.00 127.53 2c44 h PRO 377 Ca -0.43 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 2c44 h PRO 377 Cb 1.26 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2c44 h PRO 377 CO 0.37 0.35 -0.35 0.00 -0.23 0.00 0.00 178.00 178.14 2c44 h ALA 378 N 1.68 1.25 -0.10 -0.56 0.00 -1.88 -0.69 119.26 118.95 2c44 h ALA 378 Ca 0.27 -0.36 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 378 Cb 0.38 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2c44 h ALA 378 CO -0.08 0.52 -0.74 1.96 0.00 0.00 0.00 179.25 180.91 2c44 h GLN 379 N 0.16 0.51 -0.46 0.00 1.08 -1.69 -1.60 115.11 113.11 2c44 h GLN 379 Ca 0.02 -0.41 -0.05 0.00 -1.45 0.00 0.00 58.65 56.75 2c44 h GLN 379 Cb 0.70 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.20 2c44 h GLN 379 CO 0.05 1.04 0.07 0.00 -0.95 0.00 0.00 178.83 179.05 2c44 h ALA 380 N 0.84 0.60 -0.81 3.87 0.00 -1.07 -2.11 119.26 120.58 2c44 h ALA 380 Ca -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 380 Cb 1.33 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 2c44 h ALA 380 CO 0.13 0.33 0.44 1.25 0.00 0.00 0.00 179.25 181.41 2c44 h LEU 381 N 0.62 1.00 -0.26 0.00 5.85 -1.05 -1.02 115.31 120.46 2c44 h LEU 381 Ca 0.14 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2c44 h LEU 381 Cb 0.39 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2c44 h LEU 381 CO 0.01 0.81 0.15 0.00 -0.34 0.00 0.00 178.44 179.07 2c44 h ALA 382 N 1.35 0.33 -0.39 1.25 0.00 -0.91 0.44 119.26 121.34 2c44 h ALA 382 Ca 0.29 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2c44 h ALA 382 Cb 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2c44 h ALA 382 CO -0.05 -0.15 0.04 0.00 0.00 0.00 0.00 179.25 179.09 2c44 h GLU 384 N 0.58 0.02 -0.60 0.00 4.57 -0.66 -1.55 114.58 116.94 2c44 h GLU 384 Ca 0.13 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.36 2c44 h GLU 384 Cb 0.31 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.85 2c44 h GLU 384 CO 0.01 0.29 0.30 1.25 -1.18 0.00 0.00 179.01 179.68 2c44 h LEU 385 N -0.25 0.42 0.14 1.64 5.85 -0.61 -0.98 115.31 121.52 2c44 h LEU 385 Ca 0.00 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2c44 h LEU 385 Cb 0.28 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 2c44 h LEU 385 CO 0.00 0.27 -0.08 0.22 -0.34 0.00 0.00 178.44 178.52 2c44 h TYR 386 N 0.56 -0.19 -0.49 1.25 3.20 -1.14 -2.10 116.97 118.06 2c44 h TYR 386 Ca 0.27 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.24 2c44 h TYR 386 Cb 0.21 0.07 -0.09 0.00 1.54 0.00 0.00 36.73 38.46 2c44 h TYR 386 CO -0.10 -0.12 -0.10 0.87 -1.64 0.00 0.00 178.16 177.07 2c44 h LYS 387 N -0.20 0.02 0.10 1.82 1.57 -0.84 0.22 116.57 119.27 2c44 h LYS 387 Ca -0.02 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2c44 h LYS 387 Cb 0.16 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2c44 h LYS 387 CO 0.02 0.01 -0.11 0.28 -0.57 0.00 0.00 179.45 179.09 2c44 h VAL 388 N 0.02 0.75 0.00 0.50 2.07 -0.90 -3.40 116.25 115.29 2c44 h VAL 388 Ca 0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.76 2c44 h VAL 388 Cb 0.36 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2c44 h VAL 388 CO -0.49 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.10 2c44 n ALA 389 N -2.30 1.03 -1.26 1.67 0.00 -0.82 -5.00 120.51 113.84 2c44 n ALA 389 Ca -0.07 -0.43 -0.00 0.00 0.00 0.00 0.00 53.44 52.94 2c44 n ALA 389 Cb 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -0.08 0.40 3.76 0.00 0.00 0.76 -4.81 105.19 105.22 2c44 n GLY 390 Ca 0.00 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.02 5.41 -0.15 -0.61 1.01 -1.26 -1.42 121.20 122.17 2c44 s ILE 391 Ca 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.87 2c44 s ILE 391 Cb 0.00 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2c44 s ILE 391 CO 0.00 0.47 -0.03 -0.60 0.00 0.00 0.00 174.94 174.78 2c44 s ARG 392 N 0.06 3.62 0.29 2.79 3.52 -0.74 -3.01 118.95 125.48 2c44 s ARG 392 Ca 0.11 -0.50 0.03 0.00 -0.13 0.00 0.00 55.73 55.24 2c44 s ARG 392 Cb -0.12 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.33 2c44 s ARG 392 CO 0.00 0.29 0.18 0.00 -0.81 0.00 0.00 175.30 174.96 2c44 s ALA 393 N 0.24 1.80 0.19 6.12 0.00 -1.26 0.10 121.76 128.94 2c44 s ALA 393 Ca -0.02 -1.80 0.10 0.00 0.00 0.00 0.00 51.96 50.24 2c44 s ALA 393 Cb -0.14 1.25 -0.04 0.00 0.00 0.00 0.00 23.12 24.19 2c44 s ALA 393 CO 0.03 -0.55 -0.22 0.14 0.00 0.00 0.00 175.76 175.16 2c44 s VAL 394 N -3.68 2.15 -0.01 0.00 -7.23 -1.14 -4.80 120.40 105.68 2c44 s VAL 394 Ca 0.37 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.47 2c44 s VAL 394 Cb 0.05 -2.02 -0.05 0.00 0.56 0.00 0.00 36.38 34.92 2c44 s VAL 394 CO 0.18 -0.21 0.26 -1.83 -0.31 0.00 0.00 175.10 173.19 2c44 s GLU 395 N -2.76 3.58 -0.57 4.82 4.04 -1.26 0.07 118.70 126.63 2c44 s GLU 395 Ca 0.19 -0.05 0.06 0.00 0.04 0.00 0.00 54.97 55.21 2c44 s GLU 395 Cb -0.07 -3.11 0.22 0.00 0.02 0.00 0.00 34.13 31.19 2c44 s GLU 395 CO 0.09 0.67 0.57 -0.89 -1.84 0.00 0.00 175.26 173.86 2c44 n ILE 396 N 1.29 0.94 0.00 1.83 2.08 0.13 -4.68 119.36 120.96 2c44 n ILE 396 Ca -0.13 -4.59 0.00 0.00 0.56 0.00 0.00 62.75 58.60 2c44 n ILE 396 Cb 0.53 -2.02 0.00 0.00 -0.75 0.00 0.00 39.64 37.40 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 1.55 4.74 0.25 7.39 0.00 -1.26 -1.99 105.19 115.88 2c44 n GLY 397 Ca 0.25 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.68 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 0.61 -0.39 1.61 0.02 -1.85 -1.98 113.55 111.58 2c44 h SER 398 Ca 0.00 -0.20 0.05 0.00 -0.84 0.00 0.00 61.79 60.80 2c44 h SER 398 Cb 0.00 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.33 2c44 h SER 398 CO 0.00 0.82 0.13 0.15 -1.14 0.00 0.00 176.83 176.79 2c44 h PHE 399 N 0.55 0.23 -0.03 3.45 -0.00 -1.94 -2.93 116.94 116.28 2c44 h PHE 399 Ca 0.08 0.02 -0.25 0.00 -0.00 0.00 0.00 57.97 57.83 2c44 h PHE 399 Cb 0.65 -0.05 0.01 0.00 -0.00 0.00 0.00 35.95 36.57 2c44 h PHE 399 CO 0.03 0.09 -0.97 1.25 -0.00 0.00 0.00 178.31 178.71 2c44 h LEU 400 N 0.29 0.81 -1.51 0.59 6.46 -1.82 -3.30 115.31 116.83 2c44 h LEU 400 Ca 0.18 -0.63 0.11 0.00 -0.12 0.00 0.00 57.88 57.42 2c44 h LEU 400 Cb 0.16 -0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 39.80 2c44 h LEU 400 CO -0.19 1.43 0.47 0.25 -0.62 0.00 0.00 178.44 179.78 2c44 h LEU 401 N 0.37 0.48 0.00 2.25 5.85 -1.21 -3.46 115.31 119.60 2c44 h LEU 401 Ca -0.10 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2c44 h LEU 401 Cb 1.61 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.56 2c44 h LEU 401 CO 0.19 0.28 0.00 0.61 -0.34 0.00 0.00 178.44 179.18 2c44 n GLY 402 N -1.49 -1.82 3.79 3.75 0.00 -1.12 -4.90 105.19 103.39 2c44 n GLY 402 Ca 0.12 -1.50 -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 2.75 -0.22 1.61 0.52 -1.26 -1.67 118.95 120.68 2c44 s ARG 403 Ca 0.00 -1.18 -0.29 0.00 -0.52 0.00 0.00 55.73 53.74 2c44 s ARG 403 Cb 0.00 -2.45 -0.03 0.00 0.52 0.00 0.00 34.95 32.99 2c44 s ARG 403 CO 0.00 0.34 1.60 0.34 0.02 0.00 0.00 175.30 177.60 2c44 s ASP 404 N -3.83 6.41 0.45 0.23 -1.08 0.13 -4.77 116.67 114.21 2c44 s ASP 404 Ca 0.34 1.63 0.24 0.00 -0.52 0.00 0.00 52.55 54.23 2c44 s ASP 404 Cb -0.07 -2.53 1.30 0.00 -1.46 0.00 0.00 42.92 40.15 2c44 s ASP 404 CO 0.24 -1.23 1.70 1.55 0.52 0.00 0.00 175.17 177.94 2c44 h PRO 405 N 10.59 0.00 0.00 4.34 0.13 -1.96 0.97 132.00 146.08 2c44 h PRO 405 Ca -0.33 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.50 2c44 h PRO 405 Cb 1.15 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.24 2c44 h PRO 405 CO 1.00 0.00 -1.89 1.63 -0.23 0.00 0.00 178.00 178.51 2c44 n LYS 406 N -2.44 0.56 -0.01 0.86 4.01 -1.26 -4.62 118.16 115.26 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 -1.53 -0.08 0.00 -0.51 0.00 0.00 35.03 33.12 2c44 n LYS 406 CO 0.00 0.00 0.00 1.15 -1.11 0.00 0.00 177.40 177.44 2c44 h THR 407 N -1.00 1.31 0.00 -0.18 2.02 -1.90 -3.47 112.91 109.69 2c44 h THR 407 Ca -0.45 -1.97 0.00 0.00 0.77 0.00 0.00 66.41 64.75 2c44 h THR 407 Cb 1.37 2.12 0.00 0.00 -1.74 0.00 0.00 68.15 69.90 2c44 h THR 407 CO -0.27 0.61 0.00 0.61 0.37 0.00 0.00 175.52 176.84 2c44 n GLY 408 N 0.78 0.73 3.93 2.16 0.00 0.33 -4.98 105.19 108.14 2c44 n GLY 408 Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 2c44 n GLY 408 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c44 s LYS 409 N -0.55 3.48 0.11 1.61 0.00 -1.26 -4.68 119.74 118.45 2c44 s LYS 409 Ca 0.00 -0.44 -0.34 0.00 0.00 0.00 0.00 55.97 55.19 2c44 s LYS 409 Cb 0.00 -2.91 -0.14 0.00 0.00 0.00 0.00 37.83 34.78 2c44 s LYS 409 CO 0.00 0.47 1.62 0.94 0.00 0.00 0.00 175.35 178.38 2c44 n GLN 410 N -0.48 2.08 -2.33 1.78 -0.06 -1.26 0.21 117.38 117.33 2c44 n GLN 410 Ca -0.06 0.75 -0.38 0.00 -2.00 0.00 0.00 57.00 55.31 2c44 n GLN 410 Cb 0.53 -2.53 -0.02 0.00 -4.06 0.00 0.00 30.24 24.16 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 1.50 4.23 0.31 1.69 1.43 -0.67 -4.78 118.68 122.38 2c44 s LEU 411 Ca 0.82 2.33 -0.29 0.00 -1.03 0.00 0.00 54.13 55.95 2c44 s LEU 411 Cb -0.70 -3.98 -0.10 0.00 0.03 0.00 0.00 46.19 41.43 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 -2.22 4.47 -0.11 1.29 0.04 -1.26 -4.92 135.00 132.30 2c44 s PRO 412 Ca 0.56 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.66 2c44 s PRO 412 Cb -0.30 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 2c44 s PRO 412 CO 0.38 -0.02 -0.19 0.00 0.04 0.00 0.00 177.00 177.21 2c44 h PRO 414 N 6.58 0.00 -1.67 0.00 0.13 -1.97 -3.45 132.00 131.63 2c44 h PRO 414 Ca -0.24 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.94 2c44 h PRO 414 Cb 1.22 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.11 2c44 h PRO 414 CO 0.50 0.08 0.43 0.00 -0.23 0.00 0.00 178.00 178.78 2c44 s ALA 415 N -3.94 -1.92 -0.60 -0.56 0.00 -1.26 -4.95 121.76 108.53 2c44 s ALA 415 Ca -0.01 1.70 -0.09 0.00 0.00 0.00 0.00 51.96 53.56 2c44 s ALA 415 Cb 0.11 -0.93 0.16 0.00 0.00 0.00 0.00 23.12 22.46 2c44 s ALA 415 CO 0.55 -0.29 0.48 -1.21 0.00 0.00 0.00 175.76 175.29 2c44 s GLU 416 N -0.50 2.79 -0.02 0.00 0.41 -1.26 -4.28 118.70 115.84 2c44 s GLU 416 Ca -0.01 -2.16 0.01 0.00 -0.41 0.00 0.00 54.97 52.40 2c44 s GLU 416 Cb -0.02 -4.00 -0.03 0.00 -1.78 0.00 0.00 34.13 28.29 2c44 s GLU 416 CO -0.00 -1.22 -0.01 -0.51 -0.49 0.00 0.00 175.26 173.03 2c44 s LEU 417 N 0.66 3.47 -0.29 1.80 1.43 -0.84 -0.80 118.68 124.11 2c44 s LEU 417 Ca 0.12 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.15 2c44 s LEU 417 Cb -0.21 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 2c44 s LEU 417 CO -0.03 0.31 0.10 -0.22 0.23 0.00 0.00 176.35 176.74 2c44 s LEU 418 N -1.34 3.83 -0.38 1.79 2.96 0.68 0.23 118.68 126.46 2c44 s LEU 418 Ca 0.17 -0.53 -0.17 0.00 -0.22 0.00 0.00 54.13 53.38 2c44 s LEU 418 Cb -0.11 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.65 2c44 s LEU 418 CO 0.08 -0.16 0.47 -0.60 -1.32 0.00 0.00 176.35 174.82 2c44 s ARG 419 N 1.57 3.42 -1.21 1.98 3.52 0.11 -0.52 118.95 127.81 2c44 s ARG 419 Ca 0.04 -0.42 -0.13 0.00 -0.13 0.00 0.00 55.73 55.09 2c44 s ARG 419 Cb -0.17 -3.87 0.19 0.00 -1.56 0.00 0.00 34.95 29.54 2c44 s ARG 419 CO 0.04 -0.71 1.45 1.28 -0.81 0.00 0.00 175.30 176.55 2c44 n LEU 420 N 5.66 5.43 -4.69 -0.88 4.32 0.29 -2.90 117.00 124.23 2c44 n LEU 420 Ca -0.06 -4.56 -0.42 0.00 -0.02 0.00 0.00 56.01 50.95 2c44 n LEU 420 Cb 0.48 -1.58 -0.03 0.00 -1.62 0.00 0.00 43.42 40.67 2c44 n LEU 420 CO 0.45 0.88 1.19 -0.89 -1.22 0.00 0.00 177.39 177.80 2c44 s THR 421 N 1.04 3.46 -0.43 -5.08 2.01 -0.93 -2.49 115.64 113.23 2c44 s THR 421 Ca 0.41 0.88 -0.14 0.00 0.31 0.00 0.00 61.69 63.15 2c44 s THR 421 Cb -0.02 -3.57 0.05 0.00 0.01 0.00 0.00 72.50 68.97 2c44 s THR 421 CO -0.00 0.00 0.31 -0.63 -0.69 0.00 0.00 174.62 173.61 2c44 s ILE 422 N 2.40 4.99 0.46 1.82 -1.09 -0.56 -4.33 121.20 124.89 2c44 s ILE 422 Ca 0.67 -0.93 -0.25 0.00 -2.23 0.00 0.00 60.65 57.91 2c44 s ILE 422 Cb -0.35 -3.89 -0.08 0.00 -1.58 0.00 0.00 42.46 36.57 2c44 s ILE 422 CO 0.29 -0.42 1.43 -2.84 -1.23 0.00 0.00 174.94 172.17 2c44 s PRO 423 N 1.61 3.62 0.16 2.79 0.02 -1.26 -4.76 135.00 137.18 2c44 s PRO 423 Ca 0.04 2.42 -0.32 0.00 0.02 0.00 0.00 61.00 63.17 2c44 s PRO 423 Cb -0.21 -2.61 -0.10 0.00 0.02 0.00 0.00 34.50 31.59 2c44 s PRO 423 CO 0.07 -0.87 1.55 1.03 -0.33 0.00 0.00 177.00 178.45 2c44 s ARG 424 N -2.50 4.23 -1.59 5.54 0.52 -1.26 -3.36 118.95 120.52 2c44 s ARG 424 Ca 0.62 2.33 -0.11 0.00 -0.52 0.00 0.00 55.73 58.05 2c44 s ARG 424 Cb -0.44 -3.16 0.09 0.00 0.52 0.00 0.00 34.95 31.96 2c44 s ARG 424 CO 0.56 -0.59 0.61 0.00 0.02 0.00 0.00 175.30 175.90 2c44 n ALA 425 N 3.96 -1.57 -0.04 2.13 0.00 -1.26 -0.78 120.51 122.95 2c44 n ALA 425 Ca 0.14 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.39 2c44 n ALA 425 Cb 0.39 -2.62 -0.04 0.00 0.00 0.00 0.00 19.45 17.18 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 0.47 -4.29 0.00 -1.04 -1.21 -4.29 114.28 99.51 2c44 n THR 426 Ca -0.09 -0.16 -0.23 0.00 -2.04 0.00 0.00 64.05 61.53 2c44 n THR 426 Cb 0.57 -0.99 -0.07 0.00 -1.82 0.00 0.00 70.33 68.02 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 -2.16 2.67 0.56 -1.42 2.02 -1.26 -5.07 117.35 112.68 2c44 s TYR 427 Ca -0.11 -0.26 0.07 0.00 -0.37 0.00 0.00 57.07 56.40 2c44 s TYR 427 Cb 0.03 -1.25 0.07 0.00 -0.40 0.00 0.00 41.96 40.41 2c44 s TYR 427 CO 0.18 0.59 0.59 0.25 -1.57 0.00 0.00 175.55 175.59 2c44 n THR 428 N -0.91 0.00 0.09 -0.71 -2.24 -1.26 -4.98 114.28 104.27 2c44 n THR 428 Ca -0.06 -2.03 0.03 0.00 -2.27 0.00 0.00 64.05 59.72 2c44 n THR 428 Cb 0.59 -0.27 0.40 0.00 -2.10 0.00 0.00 70.33 68.96 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 0.32 -0.63 -0.78 4.15 -1.99 -1.75 115.11 114.43 2c44 h GLN 429 Ca -0.31 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 59.02 2c44 h GLN 429 Cb 1.24 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.85 2c44 h GLN 429 CO 0.46 0.37 0.23 1.15 -1.93 0.00 0.00 178.83 179.11 2c44 h THR 430 N 0.32 1.23 -0.48 2.39 2.02 -1.99 -0.55 112.91 115.85 2c44 h THR 430 Ca 0.07 -0.75 -0.10 0.00 0.77 0.00 0.00 66.41 66.41 2c44 h THR 430 Cb 0.25 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2c44 h THR 430 CO 0.01 0.29 -0.08 0.45 0.37 0.00 0.00 175.52 176.56 2c44 h HIS 431 N 0.91 1.00 -0.37 3.16 3.86 -1.72 -0.60 115.15 121.39 2c44 h HIS 431 Ca 0.21 -0.20 0.04 0.00 -1.16 0.00 0.00 60.37 59.26 2c44 h HIS 431 Cb 0.21 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 2c44 h HIS 431 CO 0.02 0.97 0.13 0.52 0.86 0.00 0.00 177.93 180.42 2c44 h MET 432 N 0.74 0.27 -0.64 2.45 2.07 -0.76 0.14 114.93 119.20 2c44 h MET 432 Ca 0.12 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.73 2c44 h MET 432 Cb 0.62 -0.06 -0.03 0.00 -1.87 0.00 0.00 31.60 30.26 2c44 h MET 432 CO 0.04 0.18 0.36 -0.44 1.07 0.00 0.00 176.91 178.12 2c44 h ASP 433 N 0.28 0.78 -0.58 1.22 3.45 -0.91 -0.35 116.42 120.30 2c44 h ASP 433 Ca 0.17 -0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.55 2c44 h ASP 433 Cb 0.15 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.70 2c44 h ASP 433 CO -0.18 0.62 0.24 0.15 -1.57 0.00 0.00 179.24 178.50 2c44 h PHE 434 N 0.89 0.88 -0.29 4.55 3.57 0.52 -0.10 116.94 126.96 2c44 h PHE 434 Ca 0.23 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2c44 h PHE 434 Cb 0.01 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 2c44 h PHE 434 CO 0.00 0.70 0.10 0.82 -2.23 0.00 0.00 178.31 177.71 2c44 h ILE 435 N 0.80 1.19 -0.78 1.41 2.04 0.06 -1.18 117.51 121.05 2c44 h ILE 435 Ca 0.19 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 2c44 h ILE 435 Cb 0.19 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2c44 h ILE 435 CO -0.02 0.20 0.49 0.40 0.00 0.00 0.00 178.15 179.22 2c44 h ILE 436 N 0.31 1.22 -0.84 -0.67 2.04 -0.81 -1.62 117.51 117.13 2c44 h ILE 436 Ca 0.09 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 2c44 h ILE 436 Cb 0.21 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 2c44 h ILE 436 CO -0.01 0.22 0.42 -0.08 0.00 0.00 0.00 178.15 178.71 2c44 h GLU 437 N 1.07 1.20 -0.51 2.37 4.57 -0.77 -2.25 114.58 120.26 2c44 h GLU 437 Ca 0.28 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 2c44 h GLU 437 Cb -0.06 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.28 2c44 h GLU 437 CO -0.06 0.91 0.32 0.00 -1.18 0.00 0.00 179.01 179.01 2c44 h ALA 438 N 1.23 0.65 0.00 2.92 0.00 -0.49 -2.09 119.26 121.47 2c44 h ALA 438 Ca 0.29 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2c44 h ALA 438 Cb 0.09 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2c44 h ALA 438 CO -0.04 0.11 -0.02 0.74 0.00 0.00 0.00 179.25 180.04 2c44 h PHE 439 N 0.69 0.00 -0.75 0.00 0.04 -0.73 -1.15 116.94 115.04 2c44 h PHE 439 Ca 0.18 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.96 2c44 h PHE 439 Cb -0.05 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.06 2c44 h PHE 439 CO -0.03 0.02 0.48 0.87 -0.60 0.00 0.00 178.31 179.05 2c44 h LYS 440 N 0.00 1.00 -0.26 1.51 1.57 -1.09 0.25 116.57 119.56 2c44 h LYS 440 Ca -0.00 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.56 2c44 h LYS 440 Cb 0.13 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 2c44 h LYS 440 CO 0.00 0.68 -0.41 0.45 -0.57 0.00 0.00 179.45 179.60 2c44 h HIS 441 N 1.02 0.91 -0.52 -1.35 3.86 -1.30 -2.20 115.15 115.57 2c44 h HIS 441 Ca 0.27 -0.31 0.04 0.00 -1.16 0.00 0.00 60.37 59.21 2c44 h HIS 441 Cb -0.09 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.16 2c44 h HIS 441 CO -0.02 1.09 0.27 0.28 0.86 0.00 0.00 177.93 180.42 2c44 h VAL 442 N 0.46 0.98 -0.33 2.45 2.07 -1.04 -2.23 116.25 118.61 2c44 h VAL 442 Ca 0.02 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2c44 h VAL 442 Cb 1.01 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 2c44 h VAL 442 CO 0.09 0.10 0.16 0.50 0.02 0.00 0.00 177.57 178.44 2c44 h LYS 443 N 0.54 0.47 0.00 1.57 3.64 -0.95 -1.33 116.57 120.50 2c44 h LYS 443 Ca 0.22 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2c44 h LYS 443 Cb 0.11 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2c44 h LYS 443 CO -0.14 0.42 0.00 0.39 -2.27 0.00 0.00 179.45 177.85 2c44 n GLU 444 N -4.76 0.06 0.00 1.90 1.02 -0.83 -1.33 120.64 116.70 2c44 n GLU 444 Ca -0.01 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 2c44 n GLU 444 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 2c44 n GLU 444 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2c44 n ASN 445 N -1.20 0.89 -0.21 1.62 5.15 -0.71 -4.89 115.26 115.90 2c44 n ASN 445 Ca 0.02 -1.36 -0.12 0.00 -0.60 0.00 0.00 54.58 52.51 2c44 n ASN 445 Cb 0.02 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.19 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 0.00 -0.64 -0.15 5.20 0.00 -0.13 -1.41 119.26 122.13 2c44 h ALA 446 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2c44 h ALA 446 Cb 0.58 1.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 2c44 h ALA 446 CO 0.00 -0.99 0.49 0.77 0.00 0.00 0.00 179.25 179.52 2c44 h SER 447 N -0.28 0.00 -0.29 0.00 0.02 -1.87 -1.17 113.55 109.97 2c44 h SER 447 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2c44 h SER 447 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2c44 h SER 447 CO -0.69 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 175.59 2c44 n ASN 448 N -3.06 3.32 -4.69 3.07 3.02 -0.53 -4.94 115.26 111.45 2c44 n ASN 448 Ca 0.02 -1.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 2c44 n ASN 448 Cb 0.58 -0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.54 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 -1.64 4.81 0.49 2.41 1.01 -0.44 -5.03 121.20 122.80 2c44 s ILE 449 Ca 0.36 2.05 -0.08 0.00 0.00 0.00 0.00 60.65 62.97 2c44 s ILE 449 Cb 0.22 -4.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 2c44 s ILE 449 CO 0.31 0.06 0.83 -1.59 0.00 0.00 0.00 174.94 174.55 2c44 s LYS 450 N 1.67 3.63 0.86 2.79 0.00 -1.26 -4.92 119.74 122.51 2c44 s LYS 450 Ca 0.49 0.40 -0.13 0.00 0.00 0.00 0.00 55.97 56.73 2c44 s LYS 450 Cb -0.19 -2.32 0.12 0.00 0.00 0.00 0.00 37.83 35.45 2c44 s LYS 450 CO 0.21 -0.23 1.23 0.20 0.00 0.00 0.00 175.35 176.76 2c44 s GLY 451 N -3.82 1.66 0.28 0.59 0.00 -1.26 -4.71 107.32 100.06 2c44 s GLY 451 Ca 0.50 -0.86 0.08 0.00 0.00 0.00 0.00 44.72 44.44 2c44 s GLY 451 CO 0.42 -0.27 -0.09 1.08 0.00 0.00 0.00 173.10 174.24 2c44 s LEU 452 N -5.69 2.55 -0.10 0.66 1.43 -0.15 -2.53 118.68 114.85 2c44 s LEU 452 Ca 0.66 -1.15 -0.22 0.00 -1.03 0.00 0.00 54.13 52.40 2c44 s LEU 452 Cb -0.08 -0.76 0.05 0.00 0.03 0.00 0.00 46.19 45.43 2c44 s LEU 452 CO 0.50 -0.25 0.52 0.28 0.23 0.00 0.00 176.35 177.64 2c44 s THR 453 N -2.88 0.02 0.65 5.49 -1.32 -1.07 -4.48 115.64 112.05 2c44 s THR 453 Ca 0.29 -0.13 -0.18 0.00 -1.21 0.00 0.00 61.69 60.46 2c44 s THR 453 Cb 0.02 -0.80 -0.01 0.00 -1.51 0.00 0.00 72.50 70.20 2c44 s THR 453 CO 0.12 -0.07 1.17 0.49 -2.21 0.00 0.00 174.62 174.12 2c44 n PHE 454 N 1.77 1.46 0.00 9.09 3.01 -1.26 -0.33 117.46 131.19 2c44 n PHE 454 Ca -0.17 0.42 0.00 0.00 1.01 0.00 0.00 57.45 58.70 2c44 n PHE 454 Cb 0.56 -2.20 0.00 0.00 -0.01 0.00 0.00 39.48 37.83 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 -2.01 0.00 -3.44 4.37 -2.24 -0.35 -4.69 114.28 105.92 2c44 n THR 455 Ca 0.15 -0.04 0.01 0.00 -2.27 0.00 0.00 64.05 61.90 2c44 n THR 455 Cb 0.48 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 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 -0.41 -1.37 -0.15 4.78 5.04 -1.05 -4.97 117.35 119.22 2c44 s TYR 456 Ca 0.00 1.99 -0.01 0.00 -2.44 0.00 0.00 57.07 56.61 2c44 s TYR 456 Cb 0.00 0.68 0.04 0.00 0.35 0.00 0.00 41.96 43.03 2c44 s TYR 456 CO 0.00 -0.71 -0.03 -2.00 -1.34 0.00 0.00 175.55 171.47 2c44 s GLU 457 N 2.86 1.20 0.84 4.97 2.12 -1.26 -1.57 118.70 127.85 2c44 s GLU 457 Ca 0.04 -0.40 -0.10 0.00 0.36 0.00 0.00 54.97 54.86 2c44 s GLU 457 Cb -0.13 -1.86 0.10 0.00 0.26 0.00 0.00 34.13 32.50 2c44 s GLU 457 CO -0.19 -0.44 1.12 -2.14 -0.54 0.00 0.00 175.26 173.07 2c44 s PRO 458 N 1.72 1.66 0.27 4.30 0.02 -1.26 -4.95 135.00 136.75 2c44 s PRO 458 Ca 0.01 1.36 0.15 0.00 0.02 0.00 0.00 61.00 62.55 2c44 s PRO 458 Cb -0.15 -1.81 0.06 0.00 0.02 0.00 0.00 34.50 32.61 2c44 s PRO 458 CO -0.07 -2.12 1.42 1.57 -0.33 0.00 0.00 177.00 177.46 2c44 h LYS 459 N -1.47 0.00 -5.50 5.54 -0.00 -2.00 -3.40 116.57 109.74 2c44 h LYS 459 Ca -0.43 0.00 -0.51 0.00 -0.00 0.00 0.00 60.65 59.70 2c44 h LYS 459 Cb 1.25 0.00 -0.29 0.00 -0.00 0.00 0.00 32.23 33.19 2c44 h LYS 459 CO 0.47 0.49 -0.82 0.54 -0.00 0.00 0.00 179.45 180.13 2c44 s VAL 460 N -2.96 1.26 -1.62 0.07 0.11 -1.26 -4.81 120.40 111.19 2c44 s VAL 460 Ca 0.04 -0.73 -0.10 0.00 -2.93 0.00 0.00 61.98 58.26 2c44 s VAL 460 Cb 0.08 -1.06 0.09 0.00 -1.53 0.00 0.00 36.38 33.96 2c44 s VAL 460 CO 0.75 0.32 0.45 0.18 -3.33 0.00 0.00 175.10 173.47 2c44 n LEU 461 N 2.58 -1.50 -0.32 2.54 4.77 -1.26 -4.83 117.00 118.98 2c44 n LEU 461 Ca -0.15 -1.12 0.18 0.00 -0.03 0.00 0.00 56.01 54.89 2c44 n LEU 461 Cb 0.54 -1.91 0.38 0.00 -2.33 0.00 0.00 43.42 40.10 2c44 n LEU 461 CO 0.24 0.34 1.04 0.08 -1.33 0.00 0.00 177.39 177.77 2c44 h ARG 462 N -1.55 0.30 -0.20 3.23 0.11 -1.87 -2.88 114.38 111.52 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 0.74 0.20 0.32 1.12 0.10 0.00 0.00 179.97 182.45 2c44 h HIS 463 N 0.31 0.00 -0.11 4.08 2.07 -1.88 -1.85 115.15 117.77 2c44 h HIS 463 Ca 0.64 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.98 2c44 h HIS 463 Cb 1.35 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.33 2c44 h HIS 463 CO -0.12 0.00 -0.68 0.74 -3.07 0.00 0.00 177.93 174.80 2c44 h PHE 464 N 0.00 0.60 0.00 6.12 -1.00 -1.88 -3.38 116.94 117.39 2c44 h PHE 464 Ca 0.10 -0.25 0.00 0.00 2.81 0.00 0.00 57.97 60.63 2c44 h PHE 464 Cb 0.74 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.20 2c44 h PHE 464 CO 0.00 0.99 -0.06 0.25 -1.61 0.00 0.00 178.31 177.88 2c44 n THR 465 N -3.88 0.51 -1.51 -1.55 -2.24 -1.07 -4.68 114.28 99.86 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 0.68 0.66 0.06 0.00 -2.10 0.00 0.00 70.33 69.63 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 -0.60 2.54 -0.00 6.98 0.00 -0.72 -4.91 121.76 125.05 2c44 s ALA 466 Ca 0.03 0.08 0.05 0.00 0.00 0.00 0.00 51.96 52.11 2c44 s ALA 466 Cb 0.02 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.95 2c44 s ALA 466 CO 0.00 -1.40 -0.16 0.15 0.00 0.00 0.00 175.76 174.36 2c44 s LYS 467 N -5.03 1.24 0.27 0.00 1.02 -0.61 -4.73 119.74 111.89 2c44 s LYS 467 Ca 0.59 -0.61 0.05 0.00 0.02 0.00 0.00 55.97 56.02 2c44 s LYS 467 Cb -0.15 -1.21 -0.06 0.00 -0.52 0.00 0.00 37.83 35.89 2c44 s LYS 467 CO 0.55 0.33 -0.03 -0.51 -0.92 0.00 0.00 175.35 174.76 2c44 s LEU 468 N -0.52 2.38 0.00 3.17 1.02 0.15 -1.21 118.68 123.67 2c44 s LEU 468 Ca 0.06 -1.21 0.03 0.00 0.02 0.00 0.00 54.13 53.02 2c44 s LEU 468 Cb -0.06 -0.51 -0.01 0.00 0.02 0.00 0.00 46.19 45.63 2c44 s LEU 468 CO -0.00 -0.41 0.10 2.29 0.02 0.00 0.00 176.35 178.34 2c44 n LYS 469 N -0.54 0.69 0.00 1.70 0.00 0.55 -4.05 118.16 116.51 2c44 n LYS 469 Ca -0.05 -3.10 0.00 0.00 -0.00 0.00 0.00 58.31 55.15 2c44 n LYS 469 Cb 0.64 1.47 0.00 0.00 -0.00 0.00 0.00 35.03 37.14 2c44 n LYS 469 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2c44 n GLU 470 N -0.89 0.00 0.00 -1.58 2.13 -1.26 -2.61 120.64 116.43 2c44 n GLU 470 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 2c44 n GLU 470 Cb 0.55 -0.09 0.00 0.00 0.27 0.00 0.00 31.44 32.17 2c44 n GLU 470 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05