#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 2.83 0.62 5.58 5.65 -1.26 -4.91 115.29 123.81 2c44 s HIS 6 Ca 0.00 0.99 -0.17 0.00 0.25 0.00 0.00 55.06 56.13 2c44 s HIS 6 Cb 0.00 -3.72 -0.02 0.00 -1.18 0.00 0.00 32.58 27.66 2c44 s HIS 6 CO 0.00 -1.51 1.13 -0.51 -0.65 0.00 0.00 174.74 173.20 2c44 s LEU 7 N 3.95 3.52 0.35 8.88 1.43 -1.26 -4.99 118.68 130.55 2c44 s LEU 7 Ca 0.54 2.11 -0.26 0.00 -1.03 0.00 0.00 54.13 55.48 2c44 s LEU 7 Cb -0.17 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.39 2c44 s LEU 7 CO 0.18 -1.54 1.04 -2.16 0.23 0.00 0.00 176.35 174.10 2c44 s PRO 8 N -3.78 4.40 0.06 1.29 0.04 -1.26 -4.94 135.00 130.81 2c44 s PRO 8 Ca 0.70 1.56 -0.33 0.00 0.04 0.00 0.00 61.00 62.97 2c44 s PRO 8 Cb -0.23 -2.80 -0.12 0.00 0.04 0.00 0.00 34.50 31.40 2c44 s PRO 8 CO 0.37 0.06 1.79 0.39 0.04 0.00 0.00 177.00 179.64 2c44 n GLU 9 N 0.46 2.43 -0.77 4.56 4.71 -1.26 -4.83 120.64 125.93 2c44 n GLU 9 Ca 0.02 0.88 -0.09 0.00 -0.01 0.00 0.00 57.16 57.97 2c44 n GLU 9 Cb 0.48 -2.73 -0.03 0.00 -1.01 0.00 0.00 31.44 28.15 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 5.47 1.50 -3.60 3.49 -0.04 -1.26 -4.79 135.00 135.77 2c44 n PRO 10 Ca 0.19 -0.76 -0.07 0.00 -0.04 0.00 0.00 63.50 62.82 2c44 n PRO 10 Cb 0.33 -1.43 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.39 -0.27 -0.06 0.54 -0.12 -1.26 -4.97 117.98 111.44 2c44 s PHE 11 Ca 0.25 0.07 -0.01 0.00 -0.05 0.00 0.00 56.93 57.19 2c44 s PHE 11 Cb 0.15 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 43.09 2c44 s PHE 11 CO -0.02 -0.67 -0.01 1.03 -0.05 0.00 0.00 175.22 175.50 2c44 s ARG 12 N -3.22 2.90 0.01 1.99 0.52 -1.26 -5.08 118.95 114.80 2c44 s ARG 12 Ca 0.08 -0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 54.51 2c44 s ARG 12 Cb -0.01 -2.73 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 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 -0.91 4.15 -0.12 1.52 1.01 -1.26 -4.93 121.20 120.66 2c44 s ILE 13 Ca 0.14 1.52 0.05 0.00 0.00 0.00 0.00 60.65 62.36 2c44 s ILE 13 Cb -0.11 -3.97 -0.11 0.00 0.01 0.00 0.00 42.46 38.28 2c44 s ILE 13 CO 0.04 0.06 -0.05 0.54 0.00 0.00 0.00 174.94 175.53 2c44 n ARG 14 N 4.53 1.20 -4.01 2.79 3.00 -1.26 -5.02 116.66 117.88 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 -1.27 -0.15 0.00 0.00 0.00 0.00 32.46 31.50 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 0.25 0.16 1.55 1.01 -1.26 -5.16 120.40 114.69 2c44 s VAL 15 Ca -0.12 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 61.90 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 0.36 0.12 -0.18 0.27 0.00 0.00 0.00 175.10 175.67 2c44 s ILE 16 N 0.48 1.77 -0.23 2.22 -4.36 -1.26 -5.12 121.20 114.70 2c44 s ILE 16 Ca -0.05 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 58.49 2c44 s ILE 16 Cb -0.08 -1.79 0.05 0.00 1.25 0.00 0.00 42.46 41.89 2c44 s ILE 16 CO -0.01 -0.30 -0.12 -0.70 0.24 0.00 0.00 174.94 174.05 2c44 s GLU 17 N -2.71 2.33 0.53 0.37 2.12 -1.26 -5.12 118.70 114.97 2c44 s GLU 17 Ca 0.14 -1.14 -0.22 0.00 0.36 0.00 0.00 54.97 54.11 2c44 s GLU 17 Cb -0.06 -2.73 -0.05 0.00 0.26 0.00 0.00 34.13 31.55 2c44 s GLU 17 CO 0.06 -0.47 1.36 -2.14 -0.54 0.00 0.00 175.26 173.53 2c44 s PRO 18 N 1.20 3.22 0.09 4.30 0.02 -1.26 -5.04 135.00 137.53 2c44 s PRO 18 Ca -0.05 2.25 0.05 0.00 0.02 0.00 0.00 61.00 63.27 2c44 s PRO 18 Cb -0.18 -2.31 -0.03 0.00 0.02 0.00 0.00 34.50 32.00 2c44 s PRO 18 CO -0.07 -1.13 -0.13 0.14 -0.33 0.00 0.00 177.00 175.48 2c44 s VAL 19 N -1.29 1.12 0.56 3.83 -7.23 -1.26 -5.17 120.40 110.96 2c44 s VAL 19 Ca 0.70 -1.45 0.07 0.00 -1.81 0.00 0.00 61.98 59.49 2c44 s VAL 19 Cb -0.41 -1.21 0.06 0.00 0.56 0.00 0.00 36.38 35.38 2c44 s VAL 19 CO 0.49 -0.33 0.56 -1.59 -0.31 0.00 0.00 175.10 173.92 2c44 s LYS 20 N -2.12 2.26 0.42 4.82 0.00 -1.26 -5.12 119.74 118.74 2c44 s LYS 20 Ca 0.01 -1.89 0.06 0.00 0.00 0.00 0.00 55.97 54.16 2c44 s LYS 20 Cb -0.08 -2.31 -0.07 0.00 0.00 0.00 0.00 37.83 35.38 2c44 s LYS 20 CO 0.02 -0.73 0.03 1.03 0.00 0.00 0.00 175.35 175.69 2c44 s ARG 21 N -4.44 2.01 0.24 1.78 1.81 -1.26 -4.46 118.95 114.63 2c44 s ARG 21 Ca 0.45 -2.12 -0.02 0.00 -1.72 0.00 0.00 55.73 52.32 2c44 s ARG 21 Cb -0.04 -1.66 -0.03 0.00 -0.45 0.00 0.00 34.95 32.77 2c44 s ARG 21 CO 0.28 -0.09 0.24 0.95 -0.68 0.00 0.00 175.30 176.00 2c44 s THR 22 N -2.72 0.00 0.19 0.02 -4.23 -1.26 -5.07 115.64 102.57 2c44 s THR 22 Ca 0.32 -1.86 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 2c44 s THR 22 Cb 0.08 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 2c44 s THR 22 CO 0.17 0.00 0.32 0.42 -0.54 0.00 0.00 174.62 174.99 2c44 s THR 23 N -3.92 5.29 0.20 3.99 -4.23 -1.26 -5.00 115.64 110.71 2c44 s THR 23 Ca 0.36 -0.75 -0.11 0.00 -1.18 0.00 0.00 61.69 60.01 2c44 s THR 23 Cb 0.04 -3.78 0.12 0.00 1.34 0.00 0.00 72.50 70.22 2c44 s THR 23 CO 0.15 -0.18 1.80 -0.09 -0.54 0.00 0.00 174.62 175.76 2c44 h ARG 24 N 1.80 0.60 -0.55 3.99 9.65 -1.95 -1.24 114.38 126.68 2c44 h ARG 24 Ca -0.50 -0.04 0.07 0.00 -1.10 0.00 0.00 59.98 58.42 2c44 h ARG 24 Cb 1.21 -0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 29.59 2c44 h ARG 24 CO 0.66 0.40 0.23 0.00 2.80 0.00 0.00 179.97 184.06 2c44 h ALA 25 N 1.31 0.70 -0.32 2.80 0.00 -1.95 -0.29 119.26 121.51 2c44 h ALA 25 Ca 0.27 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 2c44 h ALA 25 Cb 0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2c44 h ALA 25 CO -0.17 -0.15 0.20 -0.92 0.00 0.00 0.00 179.25 178.21 2c44 h TYR 26 N 0.44 0.42 -0.73 0.00 5.03 -1.73 -2.24 116.97 118.16 2c44 h TYR 26 Ca 0.26 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.57 2c44 h TYR 26 Cb 0.25 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.35 2c44 h TYR 26 CO -0.14 0.30 0.47 0.00 -1.32 0.00 0.00 178.16 177.47 2c44 h ARG 27 N 0.41 0.97 -0.31 1.82 3.08 -0.63 0.40 114.38 120.13 2c44 h ARG 27 Ca 0.12 -0.07 0.07 0.00 0.07 0.00 0.00 59.98 60.16 2c44 h ARG 27 Cb 0.00 -0.21 -0.07 0.00 0.08 0.00 0.00 29.97 29.77 2c44 h ARG 27 CO -0.02 0.66 -0.13 0.93 -1.07 0.00 0.00 179.97 180.34 2c44 h GLU 28 N 0.99 -0.08 -0.13 0.04 5.08 -0.73 0.37 114.58 120.12 2c44 h GLU 28 Ca 0.27 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2c44 h GLU 28 Cb -0.08 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2c44 h GLU 28 CO -0.05 -0.05 0.07 1.05 -1.00 0.00 0.00 179.01 179.02 2c44 h GLU 29 N -0.08 0.19 -0.47 2.33 9.09 -0.92 -2.89 114.58 121.83 2c44 h GLU 29 Ca 0.16 -0.03 0.03 0.00 0.05 0.00 0.00 59.36 59.57 2c44 h GLU 29 Cb 0.32 -0.04 -0.03 0.00 -1.65 0.00 0.00 28.75 27.35 2c44 h GLU 29 CO -0.36 0.23 0.27 0.00 0.05 0.00 0.00 179.01 179.20 2c44 h ALA 30 N 0.95 0.60 -0.08 1.06 0.00 0.02 0.06 119.26 121.87 2c44 h ALA 30 Ca 0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2c44 h ALA 30 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2c44 h ALA 30 CO -0.01 -0.05 -0.15 0.97 0.00 0.00 0.00 179.25 180.01 2c44 h ILE 31 N 0.54 1.16 -0.03 0.00 6.09 -0.28 0.06 117.51 125.05 2c44 h ILE 31 Ca 0.19 -0.71 -0.09 0.00 -1.37 0.00 0.00 64.86 62.88 2c44 h ILE 31 Cb 0.04 1.27 0.01 0.00 0.47 0.00 0.00 36.82 38.61 2c44 h ILE 31 CO -0.10 0.21 -0.33 0.40 -3.07 0.00 0.00 178.15 175.27 2c44 h ILE 32 N 0.12 1.47 -0.25 2.19 5.03 -1.23 -1.00 117.51 123.83 2c44 h ILE 32 Ca 0.02 -1.84 0.07 0.00 -0.12 0.00 0.00 64.86 62.99 2c44 h ILE 32 Cb 0.35 2.52 -0.01 0.00 -3.03 0.00 0.00 36.82 36.66 2c44 h ILE 32 CO 0.02 0.52 0.26 0.07 -0.68 0.00 0.00 178.15 178.34 2c44 h LYS 33 N -0.29 0.00 -0.57 2.37 5.09 -0.27 0.97 116.57 123.87 2c44 h LYS 33 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.71 2c44 h LYS 33 Cb 1.02 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.35 2c44 h LYS 33 CO 0.07 0.00 0.00 -1.13 -2.09 0.00 0.00 179.45 176.30 2c44 n SER 34 N -3.86 3.07 -2.81 7.07 3.41 -0.06 -4.91 113.62 115.54 2c44 n SER 34 Ca 0.03 -2.21 -0.22 0.00 -0.26 0.00 0.00 58.87 56.22 2c44 n SER 34 Cb 0.40 -0.42 0.03 0.00 -0.26 0.00 0.00 64.21 63.95 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 0.96 -0.48 2.45 5.00 0.00 0.33 -1.88 105.19 111.58 2c44 n GLY 35 Ca 0.17 0.08 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 2c44 n GLY 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c44 n MET 36 N -3.75 -1.96 -3.81 1.61 0.00 -0.39 0.78 117.12 109.60 2c44 n MET 36 Ca -0.14 0.95 -0.30 0.00 0.00 0.00 0.00 57.70 58.21 2c44 n MET 36 Cb 0.63 -5.62 -0.15 0.00 0.00 0.00 0.00 33.22 28.08 2c44 n MET 36 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2c44 s ASN 37 N -2.09 3.99 0.48 7.83 3.84 -0.78 -4.76 114.94 123.44 2c44 s ASN 37 Ca 0.02 -1.55 0.31 0.00 0.21 0.00 0.00 52.86 51.85 2c44 s ASN 37 Cb -0.01 -1.00 1.41 0.00 -0.55 0.00 0.00 41.25 41.09 2c44 s ASN 37 CO 0.03 -0.37 1.74 -0.65 -2.79 0.00 0.00 177.10 175.06 2c44 h PRO 38 N 8.01 0.13 -0.19 0.43 0.11 -1.88 0.27 132.00 138.88 2c44 h PRO 38 Ca -0.13 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.03 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 0.09 0.24 0.74 -0.21 0.00 0.00 178.00 179.31 2c44 h PHE 39 N 0.14 0.00 -0.23 0.65 -1.00 -1.89 0.03 116.94 114.63 2c44 h PHE 39 Ca 0.65 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.43 2c44 h PHE 39 Cb 2.22 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.78 2c44 h PHE 39 CO -0.00 0.00 0.00 1.28 -1.61 0.00 0.00 178.31 177.98 2c44 n LEU 40 N -3.65 2.66 -4.83 1.54 4.77 0.93 -4.94 117.00 113.48 2c44 n LEU 40 Ca 0.02 -1.08 -0.33 0.00 -0.03 0.00 0.00 56.01 54.59 2c44 n LEU 40 Cb 0.36 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 2c44 n LEU 40 CO 0.25 0.54 0.67 -0.76 -1.33 0.00 0.00 177.39 176.77 2c44 s LEU 41 N -1.63 3.77 0.30 2.23 1.43 -0.01 -4.85 118.68 119.93 2c44 s LEU 41 Ca 0.35 1.64 -0.27 0.00 -1.03 0.00 0.00 54.13 54.81 2c44 s LEU 41 Cb 0.20 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 2c44 s LEU 41 CO 0.30 -0.50 0.95 -1.81 0.23 0.00 0.00 176.35 175.52 2c44 s ASP 42 N -2.64 7.40 0.21 2.29 1.01 -1.26 -4.96 116.67 118.72 2c44 s ASP 42 Ca 0.61 1.89 -0.10 0.00 0.71 0.00 0.00 52.55 55.65 2c44 s ASP 42 Cb -0.10 -2.59 0.29 0.00 1.01 0.00 0.00 42.92 41.53 2c44 s ASP 42 CO 0.23 -0.02 1.71 -1.28 0.21 0.00 0.00 175.17 176.01 2c44 h SER 43 N 3.43 0.02 0.26 0.27 0.87 -1.96 -0.04 113.55 116.41 2c44 h SER 43 Ca -0.46 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 2c44 h SER 43 Cb 1.20 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 2c44 h SER 43 CO 0.66 0.02 0.00 -0.62 -0.53 0.00 0.00 176.83 176.36 2c44 n GLU 44 N -5.12 0.00 -0.39 2.24 1.02 -1.26 -1.08 120.64 116.05 2c44 n GLU 44 Ca 0.09 0.37 0.09 0.00 -0.02 0.00 0.00 57.16 57.69 2c44 n GLU 44 Cb 0.32 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.52 2c44 n GLU 44 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2c44 n ASP 45 N -1.50 3.61 -4.14 1.62 8.00 -0.03 -4.78 116.55 119.33 2c44 n ASP 45 Ca 0.02 -2.13 -0.31 0.00 0.71 0.00 0.00 54.79 53.08 2c44 n ASP 45 Cb 0.09 -0.46 -0.17 0.00 -0.02 0.00 0.00 41.12 40.56 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 -1.39 1.84 -0.12 2.53 1.01 -0.24 -4.95 120.40 119.09 2c44 s VAL 46 Ca 0.42 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 2c44 s VAL 46 Cb 0.24 -1.63 -0.11 0.00 0.00 0.00 0.00 36.38 34.87 2c44 s VAL 46 CO 0.26 0.51 0.32 0.15 0.00 0.00 0.00 175.10 176.34 2c44 h PHE 47 N 7.13 0.00 -3.77 5.22 -0.00 -1.43 -3.44 116.94 120.65 2c44 h PHE 47 Ca -0.28 0.00 -0.66 0.00 -0.00 0.00 0.00 57.97 57.03 2c44 h PHE 47 Cb 1.20 0.00 -0.38 0.00 -0.00 0.00 0.00 35.95 36.77 2c44 h PHE 47 CO 0.47 0.46 -0.77 0.42 -0.00 0.00 0.00 178.31 178.89 2c44 s ILE 48 N -1.88 2.13 -0.74 1.41 1.01 -1.16 -4.95 121.20 117.03 2c44 s ILE 48 Ca -0.09 -1.85 -0.21 0.00 0.00 0.00 0.00 60.65 58.49 2c44 s ILE 48 Cb -0.01 -2.38 0.09 0.00 0.01 0.00 0.00 42.46 40.18 2c44 s ILE 48 CO 0.31 -0.25 0.99 -0.62 0.00 0.00 0.00 174.94 175.37 2c44 s ASP 49 N 1.06 6.32 -0.30 3.58 3.68 -1.26 -1.88 116.67 127.87 2c44 s ASP 49 Ca -0.01 -1.37 0.11 0.00 2.13 0.00 0.00 52.55 53.40 2c44 s ASP 49 Cb -0.20 -2.40 0.74 0.00 -1.45 0.00 0.00 42.92 39.62 2c44 s ASP 49 CO -0.07 -1.29 1.77 0.18 0.13 0.00 0.00 175.17 175.89 2c44 n LEU 50 N 7.21 5.86 -0.28 -1.34 4.77 0.14 -4.57 117.00 128.79 2c44 n LEU 50 Ca 0.05 -3.19 0.02 0.00 -0.03 0.00 0.00 56.01 52.86 2c44 n LEU 50 Cb 0.46 -0.72 0.16 0.00 -2.33 0.00 0.00 43.42 40.99 2c44 n LEU 50 CO 0.59 0.79 1.12 0.25 -1.33 0.00 0.00 177.39 178.81 2c44 h LEU 51 N 2.79 0.62 -7.02 2.23 5.85 -1.60 -2.46 115.31 115.72 2c44 h LEU 51 Ca 0.20 0.05 0.16 0.00 0.84 0.00 0.00 57.88 59.14 2c44 h LEU 51 Cb 2.21 -0.07 -0.16 0.00 0.37 0.00 0.00 40.66 43.01 2c44 h LEU 51 CO 0.66 0.36 0.60 0.28 -0.34 0.00 0.00 178.44 179.99 2c44 s THR 52 N -6.04 0.00 -2.63 1.05 -1.32 -1.26 -4.41 115.64 101.03 2c44 s THR 52 Ca -0.12 -0.02 0.24 0.00 -1.21 0.00 0.00 61.69 60.57 2c44 s THR 52 Cb 0.19 -1.05 0.36 0.00 -1.51 0.00 0.00 72.50 70.49 2c44 s THR 52 CO 0.78 0.00 1.37 -0.90 -2.21 0.00 0.00 174.62 173.66 2c44 n ASP 53 N -0.21 3.28 -4.58 8.08 5.75 -1.26 -4.49 116.55 123.13 2c44 n ASP 53 Ca -0.06 -1.99 -0.42 0.00 -0.01 0.00 0.00 54.79 52.32 2c44 n ASP 53 Cb 0.61 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.50 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 -1.65 6.40 -0.71 -1.12 0.15 -1.26 -3.80 113.70 111.72 2c44 s SER 54 Ca 0.36 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.03 2c44 s SER 54 Cb 0.22 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2c44 s SER 54 CO 0.31 -1.54 0.00 0.61 1.20 0.00 0.00 173.24 173.82 2c44 n GLY 55 N 5.11 0.86 0.18 9.45 0.00 0.84 -4.88 105.19 116.74 2c44 n GLY 55 Ca 0.08 -0.40 0.04 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.66 0.00 -2.03 2.61 -2.24 -1.25 -4.53 114.28 104.18 2c44 n THR 56 Ca -0.07 -0.42 -0.26 0.00 -2.27 0.00 0.00 64.05 61.03 2c44 n THR 56 Cb 0.29 1.09 0.17 0.00 -2.10 0.00 0.00 70.33 69.79 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 0.81 -1.00 3.92 3.38 0.00 -1.26 -4.81 105.19 106.24 2c44 n GLY 57 Ca 0.03 -1.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.01 2c44 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c44 s ALA 58 N -3.79 3.29 0.38 4.61 0.00 0.02 -4.86 121.76 121.40 2c44 s ALA 58 Ca 0.69 -0.78 0.07 0.00 0.00 0.00 0.00 51.96 51.95 2c44 s ALA 58 Cb -0.02 -2.58 -0.07 0.00 0.00 0.00 0.00 23.12 20.44 2c44 s ALA 58 CO 0.48 -0.92 -0.01 0.14 0.00 0.00 0.00 175.76 175.45 2c44 s VAL 59 N -3.04 1.95 0.40 0.00 -7.23 -1.26 -4.86 120.40 106.35 2c44 s VAL 59 Ca 0.55 -2.05 0.05 0.00 -1.81 0.00 0.00 61.98 58.72 2c44 s VAL 59 Cb -0.11 -2.87 -0.00 0.00 0.56 0.00 0.00 36.38 33.96 2c44 s VAL 59 CO 0.45 -0.06 0.57 0.42 -0.31 0.00 0.00 175.10 176.16 2c44 s THR 60 N -2.77 3.79 0.19 5.32 -4.23 -1.26 -4.95 115.64 111.74 2c44 s THR 60 Ca 0.34 -0.83 -0.12 0.00 -1.18 0.00 0.00 61.69 59.91 2c44 s THR 60 Cb 0.08 -3.34 0.10 0.00 1.34 0.00 0.00 72.50 70.68 2c44 s THR 60 CO 0.17 -0.17 1.77 1.56 -0.54 0.00 0.00 174.62 177.41 2c44 h GLN 61 N 0.65 0.46 -0.98 3.99 4.20 -2.00 -1.04 115.11 120.39 2c44 h GLN 61 Ca -0.45 -0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.34 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 0.00 178.83 180.39 2c44 h SER 62 N 0.47 0.92 -0.19 1.46 0.02 -1.98 0.27 113.55 114.52 2c44 h SER 62 Ca 0.26 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.18 2c44 h SER 62 Cb 0.22 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 2c44 h SER 62 CO -0.21 0.52 -0.13 0.24 -1.14 0.00 0.00 176.83 176.11 2c44 h MET 63 N 1.00 0.42 -0.49 3.45 2.86 -1.64 0.13 114.93 120.66 2c44 h MET 63 Ca 0.47 -0.20 -0.05 0.00 -2.06 0.00 0.00 59.70 57.86 2c44 h MET 63 Cb 0.42 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 2c44 h MET 63 CO -0.23 0.74 0.11 0.37 1.06 0.00 0.00 176.91 178.96 2c44 h GLN 64 N 0.10 0.75 -0.51 1.72 4.15 -0.54 -1.91 115.11 118.86 2c44 h GLN 64 Ca 0.04 -0.15 -0.07 0.00 0.77 0.00 0.00 58.65 59.24 2c44 h GLN 64 Cb 0.64 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 2c44 h GLN 64 CO 0.03 0.69 0.03 0.00 -1.93 0.00 0.00 178.83 177.65 2c44 h ALA 65 N 1.40 0.68 -0.79 3.38 0.00 -0.33 -2.86 119.26 120.73 2c44 h ALA 65 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2c44 h ALA 65 Cb 0.29 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2c44 h ALA 65 CO -0.00 0.46 0.49 0.00 0.00 0.00 0.00 179.25 180.20 2c44 h ALA 66 N 0.95 1.37 0.00 0.00 0.00 -0.44 -0.91 119.26 120.23 2c44 h ALA 66 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2c44 h ALA 66 Cb 0.48 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2c44 h ALA 66 CO 0.02 0.55 0.07 1.98 0.00 0.00 0.00 179.25 181.87 2c44 h MET 67 N 1.09 0.00 0.00 0.00 -1.53 -1.12 -1.85 114.93 111.52 2c44 h MET 67 Ca 0.29 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.55 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 -0.06 0.00 -0.32 -1.33 0.14 0.00 0.00 176.91 175.35 2c44 n MET 68 N -3.01 0.01 -2.52 0.39 2.81 -0.34 -4.32 117.12 110.14 2c44 n MET 68 Ca -0.03 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.66 2c44 n MET 68 Cb 0.13 -1.51 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 -1.52 2.73 -3.36 0.03 1.85 -0.70 -5.08 116.66 110.62 2c44 n ARG 69 Ca 0.06 -4.10 -0.32 0.00 -1.00 0.00 0.00 57.85 52.49 2c44 n ARG 69 Cb 0.34 -1.94 -0.06 0.00 -1.05 0.00 0.00 32.46 29.75 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 -3.43 2.29 -0.49 2.89 0.00 -1.26 -4.89 107.32 102.44 2c44 s GLY 70 Ca 0.42 -0.20 -0.16 0.00 0.00 0.00 0.00 44.72 44.77 2c44 s GLY 70 CO -0.11 -0.05 0.45 -0.35 0.00 0.00 0.00 173.10 173.04 2c44 s ASP 71 N -2.34 6.16 0.00 1.64 2.15 -1.26 -4.68 116.67 118.35 2c44 s ASP 71 Ca 0.49 -1.33 0.00 0.00 0.43 0.00 0.00 52.55 52.14 2c44 s ASP 71 Cb -0.11 -2.20 0.00 0.00 -0.30 0.00 0.00 42.92 40.31 2c44 s ASP 71 CO 0.20 -0.72 0.56 -0.62 -0.17 0.00 0.00 175.17 174.43 2c44 n GLU 72 N 5.37 0.86 -1.64 4.34 -0.58 -1.26 -4.28 120.64 123.46 2c44 n GLU 72 Ca -0.12 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.23 2c44 n GLU 72 Cb 0.43 -1.30 0.03 0.00 -0.57 0.00 0.00 31.44 30.04 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 -0.11 0.50 0.11 0.62 0.00 -1.26 -4.88 120.51 115.49 2c44 n ALA 73 Ca 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.54 2c44 n ALA 73 Cb 0.15 -2.15 0.06 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 1.21 0.02 -3.88 0.00 3.20 -1.99 -3.42 116.97 112.11 2c44 h TYR 74 Ca -0.47 -0.01 -0.30 0.00 3.14 0.00 0.00 58.73 61.09 2c44 h TYR 74 Cb 1.34 -0.00 -0.28 0.00 1.54 0.00 0.00 36.73 39.33 2c44 h TYR 74 CO 0.42 0.77 -0.74 -1.12 -1.64 0.00 0.00 178.16 175.84 2c44 s SER 75 N -6.81 0.51 -1.63 -2.11 0.01 -1.26 -4.75 113.70 97.66 2c44 s SER 75 Ca -0.01 -0.13 -0.02 0.00 1.31 0.00 0.00 55.95 57.11 2c44 s SER 75 Cb 0.12 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.31 2c44 s SER 75 CO 0.79 0.02 0.25 0.61 0.41 0.00 0.00 173.24 175.31 2c44 n GLY 76 N 2.81 -0.47 3.77 3.44 0.00 -1.26 -4.95 105.19 108.54 2c44 n GLY 76 Ca -0.14 0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.05 3.75 0.28 1.61 2.88 -1.26 -4.87 113.62 113.96 2c44 n SER 77 Ca -0.18 1.22 0.17 0.00 -1.33 0.00 0.00 58.87 58.75 2c44 n SER 77 Cb 0.65 -1.61 0.77 0.00 -0.75 0.00 0.00 64.21 63.27 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 3.05 0.00 -0.10 -1.46 0.11 -1.92 -1.10 114.38 112.96 2c44 h ARG 78 Ca -0.50 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.46 2c44 h ARG 78 Cb 1.24 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.31 2c44 h ARG 78 CO 0.65 0.05 -0.47 0.77 0.10 0.00 0.00 179.97 181.06 2c44 h SER 79 N 0.00 0.26 -0.24 0.08 0.02 -1.89 -1.34 113.55 110.42 2c44 h SER 79 Ca -0.00 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 2c44 h SER 79 Cb 0.42 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 2c44 h SER 79 CO 0.01 0.69 0.07 0.22 -1.14 0.00 0.00 176.83 176.68 2c44 h TYR 80 N 0.19 0.40 -0.13 3.45 3.20 -1.44 -2.00 116.97 120.64 2c44 h TYR 80 Ca 0.01 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.80 2c44 h TYR 80 Cb 0.91 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 2c44 h TYR 80 CO 0.02 0.46 -0.10 1.88 -1.64 0.00 0.00 178.16 178.78 2c44 h TYR 81 N 0.22 0.20 -0.30 -3.82 0.05 -1.32 0.77 116.97 112.78 2c44 h TYR 81 Ca 0.08 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 2c44 h TYR 81 Cb 0.26 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 2c44 h TYR 81 CO 0.01 0.30 0.08 0.00 -1.05 0.00 0.00 178.16 177.50 2c44 h ALA 82 N 1.71 0.39 -0.24 3.88 0.00 -0.89 0.12 119.26 124.23 2c44 h ALA 82 Ca 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2c44 h ALA 82 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2c44 h ALA 82 CO 0.02 0.04 0.09 1.25 0.00 0.00 0.00 179.25 180.65 2c44 h LEU 83 N 0.32 0.33 -0.90 0.00 5.85 -0.65 -2.13 115.31 118.12 2c44 h LEU 83 Ca 0.09 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2c44 h LEU 83 Cb 0.27 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2c44 h LEU 83 CO -0.00 0.41 0.56 0.00 -0.34 0.00 0.00 178.44 179.07 2c44 h ALA 84 N 0.93 1.28 -0.66 1.25 0.00 -0.69 -1.07 119.26 120.29 2c44 h ALA 84 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 84 Cb 0.19 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2c44 h ALA 84 CO -0.01 0.26 0.14 1.49 0.00 0.00 0.00 179.25 181.13 2c44 h GLU 85 N 0.97 1.07 -0.51 0.00 4.57 -0.66 -0.14 114.58 119.88 2c44 h GLU 85 Ca 0.41 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 58.30 2c44 h GLU 85 Cb 0.27 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2c44 h GLU 85 CO -0.21 0.95 0.17 0.77 -1.18 0.00 0.00 179.01 179.51 2c44 h SER 86 N 1.01 0.73 -0.52 1.04 0.02 -0.68 -0.92 113.55 114.24 2c44 h SER 86 Ca 0.21 -0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 2c44 h SER 86 Cb 0.38 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2c44 h SER 86 CO 0.01 0.74 0.25 0.58 -1.14 0.00 0.00 176.83 177.26 2c44 h VAL 87 N 0.69 1.20 -0.73 2.27 2.07 -0.85 0.09 116.25 120.99 2c44 h VAL 87 Ca 0.16 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 2c44 h VAL 87 Cb 0.26 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2c44 h VAL 87 CO -0.01 0.22 0.35 0.11 0.02 0.00 0.00 177.57 178.27 2c44 h LYS 88 N 0.69 1.05 -0.22 1.57 6.56 -0.79 -0.63 116.57 124.80 2c44 h LYS 88 Ca 0.18 -0.15 -0.21 0.00 -1.06 0.00 0.00 60.65 59.41 2c44 h LYS 88 Cb 0.12 -0.19 0.01 0.00 -0.57 0.00 0.00 32.23 31.60 2c44 h LYS 88 CO -0.02 0.82 -0.67 -0.91 -2.06 0.00 0.00 179.45 176.61 2c44 h ASN 89 N 1.02 0.97 0.00 0.86 2.35 -0.91 -1.31 115.58 118.56 2c44 h ASN 89 Ca 0.25 -0.58 -0.02 0.00 -0.55 0.00 0.00 56.30 55.40 2c44 h ASN 89 Cb 0.12 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 2c44 h ASN 89 CO -0.03 1.38 -0.12 0.40 -1.65 0.00 0.00 177.43 177.41 2c44 h ILE 90 N 0.61 1.61 0.00 2.81 2.04 -0.92 -3.39 117.51 120.27 2c44 h ILE 90 Ca -0.02 -2.25 0.00 0.00 1.00 0.00 0.00 64.86 63.59 2c44 h ILE 90 Cb 1.29 3.09 0.00 0.00 -0.74 0.00 0.00 36.82 40.46 2c44 h ILE 90 CO 0.14 0.55 -1.53 0.49 0.00 0.00 0.00 178.15 177.80 2c44 n PHE 91 N -4.60 0.10 -1.07 1.37 3.72 -0.27 -3.93 117.46 112.78 2c44 n PHE 91 Ca -0.11 0.03 -0.02 0.00 -0.05 0.00 0.00 57.45 57.29 2c44 n PHE 91 Cb 0.47 -0.39 -0.01 0.00 -0.94 0.00 0.00 39.48 38.61 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 1.33 0.57 3.74 1.37 0.00 -0.49 -4.82 105.19 106.88 2c44 n GLY 92 Ca -0.01 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 2c44 n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c44 s TYR 93 N -2.07 3.51 -0.29 1.61 1.51 -1.24 -4.91 117.35 115.47 2c44 s TYR 93 Ca 0.00 0.77 0.20 0.00 -1.01 0.00 0.00 57.07 57.03 2c44 s TYR 93 Cb 0.00 -2.43 0.14 0.00 -0.11 0.00 0.00 41.96 39.57 2c44 s TYR 93 CO 0.00 0.26 1.36 -0.56 -1.11 0.00 0.00 175.55 175.50 2c44 h GLN 94 N 6.46 0.00 -5.18 -0.62 3.07 -1.28 -3.26 115.11 114.31 2c44 h GLN 94 Ca -0.42 0.00 -0.66 0.00 0.09 0.00 0.00 58.65 57.65 2c44 h GLN 94 Cb 1.18 0.00 -0.30 0.00 0.08 0.00 0.00 27.48 28.44 2c44 h GLN 94 CO 0.74 0.16 -0.79 0.71 0.09 0.00 0.00 178.83 179.73 2c44 s TYR 95 N -3.15 2.81 -0.03 0.06 2.02 -0.86 -5.02 117.35 113.18 2c44 s TYR 95 Ca 0.04 -1.02 0.05 0.00 -0.37 0.00 0.00 57.07 55.76 2c44 s TYR 95 Cb 0.07 -1.91 -0.01 0.00 -0.40 0.00 0.00 41.96 39.71 2c44 s TYR 95 CO 0.73 -0.47 -0.16 0.99 -1.57 0.00 0.00 175.55 175.06 2c44 s THR 96 N 0.87 1.33 -0.13 -0.71 2.01 -1.26 -1.03 115.64 116.72 2c44 s THR 96 Ca -0.04 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2c44 s THR 96 Cb -0.15 -1.13 0.04 0.00 0.01 0.00 0.00 72.50 71.27 2c44 s THR 96 CO -0.01 0.38 0.01 -0.63 -0.69 0.00 0.00 174.62 173.68 2c44 s ILE 97 N -0.13 0.54 0.44 1.82 1.01 -0.32 -4.99 121.20 119.56 2c44 s ILE 97 Ca 0.01 -0.26 -0.20 0.00 0.00 0.00 0.00 60.65 60.20 2c44 s ILE 97 Cb -0.09 -0.84 -0.10 0.00 0.01 0.00 0.00 42.46 41.44 2c44 s ILE 97 CO 0.01 0.05 0.96 -2.16 0.00 0.00 0.00 174.94 173.80 2c44 s PRO 98 N 1.88 4.17 0.08 2.79 0.04 -1.26 -1.19 135.00 141.51 2c44 s PRO 98 Ca 0.02 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.18 2c44 s PRO 98 Cb -0.15 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 2c44 s PRO 98 CO -0.07 -0.09 -0.06 0.95 0.04 0.00 0.00 177.00 177.78 2c44 s THR 99 N -2.23 0.53 0.38 1.26 -4.23 -0.87 -3.77 115.64 106.71 2c44 s THR 99 Ca 0.62 -1.76 0.10 0.00 -1.18 0.00 0.00 61.69 59.46 2c44 s THR 99 Cb -0.10 -1.46 0.13 0.00 1.34 0.00 0.00 72.50 72.42 2c44 s THR 99 CO 0.16 -0.84 1.88 1.12 -0.54 0.00 0.00 174.62 176.40 2c44 h HIS 100 N 3.25 0.19 -2.06 3.99 2.07 -1.53 0.64 115.15 121.71 2c44 h HIS 100 Ca -0.35 -0.03 0.06 0.00 -2.85 0.00 0.00 60.37 57.21 2c44 h HIS 100 Cb 1.16 -0.05 -0.01 0.00 2.57 0.00 0.00 27.41 31.08 2c44 h HIS 100 CO 0.58 0.39 0.26 0.00 -3.07 0.00 0.00 177.93 176.09 2c44 n GLN 101 N -4.22 0.31 -0.07 5.12 10.64 -1.26 -0.43 117.38 127.48 2c44 n GLN 101 Ca -0.01 -0.70 -0.06 0.00 -1.83 0.00 0.00 57.00 54.40 2c44 n GLN 101 Cb 0.32 0.94 -0.04 0.00 -0.86 0.00 0.00 30.24 30.60 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 0.89 -1.61 2.00 2.61 0.00 -1.77 -0.87 103.07 104.32 2c44 h GLY 102 Ca -0.13 0.82 0.00 0.00 0.00 0.00 0.00 47.33 48.02 2c44 h GLY 102 CO 0.17 -0.49 0.00 -0.96 0.00 0.00 0.00 176.54 175.25 2c44 n ARG 103 N -3.84 0.01 -0.02 4.80 0.00 -1.26 -0.76 116.66 115.59 2c44 n ARG 103 Ca -0.01 0.45 -0.17 0.00 -0.00 0.00 0.00 57.85 58.12 2c44 n ARG 103 Cb 0.14 -1.52 -0.06 0.00 -0.00 0.00 0.00 32.46 31.01 2c44 n ARG 103 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 2c44 h GLY 104 N 0.60 0.85 1.51 2.89 0.00 -1.57 -2.53 103.07 104.83 2c44 h GLY 104 Ca 0.00 -1.20 -0.24 0.00 0.00 0.00 0.00 47.33 45.89 2c44 h GLY 104 CO 0.00 1.07 -1.00 0.00 0.00 0.00 0.00 176.54 176.60 2c44 h ALA 105 N 0.59 0.29 -0.33 3.60 0.00 -0.78 -3.31 119.26 119.32 2c44 h ALA 105 Ca -0.05 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 54.11 2c44 h ALA 105 Cb 1.40 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2c44 h ALA 105 CO 0.16 0.82 0.16 0.93 0.00 0.00 0.00 179.25 181.31 2c44 h GLU 106 N 0.23 0.48 0.00 0.00 5.08 -1.45 -1.59 114.58 117.33 2c44 h GLU 106 Ca -0.10 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2c44 h GLU 106 Cb 1.65 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.82 2c44 h GLU 106 CO 0.18 0.45 0.00 0.00 -1.00 0.00 0.00 179.01 178.63 2c44 n GLN 107 N -4.74 0.13 -0.06 2.33 10.64 -0.95 -2.24 117.38 122.49 2c44 n GLN 107 Ca -0.01 0.16 -0.09 0.00 -1.83 0.00 0.00 57.00 55.23 2c44 n GLN 107 Cb 0.11 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 27.96 2c44 n GLN 107 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 2c44 n ILE 108 N -1.21 1.35 -0.05 -0.39 5.41 -0.77 -4.56 119.36 119.15 2c44 n ILE 108 Ca 0.04 0.12 -0.04 0.00 1.00 0.00 0.00 62.75 63.87 2c44 n ILE 108 Cb 0.05 -2.05 0.19 0.00 -0.71 0.00 0.00 39.64 37.12 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 -0.71 0.69 0.18 1.39 -0.00 -1.30 -2.73 116.97 114.50 2c44 h TYR 109 Ca -0.10 -0.11 0.00 0.00 -0.00 0.00 0.00 58.73 58.52 2c44 h TYR 109 Cb 0.86 -0.18 -0.01 0.00 -0.00 0.00 0.00 36.73 37.39 2c44 h TYR 109 CO -0.25 0.72 -0.17 0.82 -0.00 0.00 0.00 178.16 179.28 2c44 h ILE 110 N 0.59 0.63 -0.47 -0.90 2.04 -1.69 0.34 117.51 118.03 2c44 h ILE 110 Ca 0.11 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.96 2c44 h ILE 110 Cb 0.52 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 2c44 h ILE 110 CO 0.03 0.00 0.28 -0.65 0.00 0.00 0.00 178.15 177.81 2c44 h PRO 111 N -0.37 0.65 0.00 2.37 0.11 -1.79 -1.60 132.00 131.37 2c44 h PRO 111 Ca 0.00 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.06 2c44 h PRO 111 Cb 0.35 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 2c44 h PRO 111 CO -0.04 0.49 -0.07 0.28 -0.21 0.00 0.00 178.00 178.45 2c44 h VAL 112 N 0.63 0.82 -0.71 3.15 2.07 -1.19 -1.75 116.25 119.28 2c44 h VAL 112 Ca 0.17 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.64 2c44 h VAL 112 Cb 0.01 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 2c44 h VAL 112 CO -0.03 0.00 0.26 -0.07 0.02 0.00 0.00 177.57 177.74 2c44 h LEU 113 N -0.12 0.99 0.16 2.57 3.38 -0.23 -1.83 115.31 120.24 2c44 h LEU 113 Ca 0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c44 h LEU 113 Cb 0.15 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2c44 h LEU 113 CO -0.07 0.90 -0.08 0.40 0.09 0.00 0.00 178.44 179.68 2c44 h ILE 114 N 1.04 0.88 -0.78 1.22 2.04 -1.08 -2.49 117.51 118.35 2c44 h ILE 114 Ca 0.24 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 66.00 2c44 h ILE 114 Cb 0.24 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 2c44 h ILE 114 CO -0.01 0.04 0.51 0.11 0.00 0.00 0.00 178.15 178.79 2c44 h LYS 115 N -0.30 0.78 0.50 2.37 1.57 -1.17 -2.07 116.57 118.25 2c44 h LYS 115 Ca -0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2c44 h LYS 115 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2c44 h LYS 115 CO 0.04 0.52 -0.36 -0.22 -0.57 0.00 0.00 179.45 178.85 2c44 h LYS 116 N 0.80 -0.81 0.00 3.15 3.64 -0.91 0.52 116.57 122.97 2c44 h LYS 116 Ca 0.34 0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.74 2c44 h LYS 116 Cb 0.29 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2c44 h LYS 116 CO -0.12 -0.54 -0.15 -0.09 -2.27 0.00 0.00 179.45 176.28 2c44 h ARG 117 N -0.84 0.00 0.36 1.90 2.43 -1.26 0.74 114.38 117.72 2c44 h ARG 117 Ca -0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2c44 h ARG 117 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2c44 h ARG 117 CO 0.02 0.15 -0.17 1.49 -1.51 0.00 0.00 179.97 179.95 2c44 h GLU 118 N 0.00 -0.47 0.00 0.20 4.81 -0.80 0.15 114.58 118.47 2c44 h GLU 118 Ca -0.00 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 2c44 h GLU 118 Cb 0.39 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 2c44 h GLU 118 CO 0.02 -0.16 -0.26 1.96 -0.73 0.00 0.00 179.01 179.84 2c44 h GLN 119 N -0.80 0.00 0.03 1.92 4.20 -0.54 -2.19 115.11 117.72 2c44 h GLN 119 Ca -0.05 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.28 2c44 h GLN 119 Cb 0.52 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.25 2c44 h GLN 119 CO 0.08 0.26 -2.36 0.39 -0.67 0.00 0.00 178.83 176.53 2c44 n GLU 120 N -3.77 0.67 -0.00 1.46 1.02 0.22 -4.66 120.64 115.57 2c44 n GLU 120 Ca -0.01 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 2c44 n GLU 120 Cb 0.36 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 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 -3.27 2.66 -3.09 3.49 5.02 0.47 -5.00 118.16 118.45 2c44 n LYS 121 Ca -0.42 -1.43 -0.13 0.00 -2.02 0.00 0.00 58.31 54.31 2c44 n LYS 121 Cb 1.01 -1.01 0.04 0.00 -0.02 0.00 0.00 35.03 35.06 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 -0.43 0.16 3.73 0.72 0.00 -0.82 -4.90 105.19 103.64 2c44 n GLY 122 Ca 0.00 -0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.91 4.98 -4.21 0.99 0.00 -0.92 -4.92 117.00 110.02 2c44 n LEU 123 Ca 0.00 1.02 -0.37 0.00 0.00 0.00 0.00 56.01 56.66 2c44 n LEU 123 Cb 0.53 -1.55 -0.12 0.00 0.00 0.00 0.00 43.42 42.28 2c44 n LEU 123 CO 0.35 -0.63 -0.24 1.51 0.00 0.00 0.00 177.39 178.38 2c44 s ASP 124 N -0.78 5.23 0.47 1.96 -4.77 -1.26 -4.67 116.67 112.85 2c44 s ASP 124 Ca 0.68 -1.45 0.29 0.00 -3.30 0.00 0.00 52.55 48.76 2c44 s ASP 124 Cb -0.44 -1.83 1.36 0.00 -1.09 0.00 0.00 42.92 40.91 2c44 s ASP 124 CO 0.52 -0.39 1.76 0.03 0.70 0.00 0.00 175.17 177.79 2c44 h ARG 125 N 8.14 0.17 0.00 2.11 3.08 -1.94 0.30 114.38 126.24 2c44 h ARG 125 Ca -0.20 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.84 2c44 h ARG 125 Cb 1.07 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2c44 h ARG 125 CO 0.63 0.11 0.00 -1.13 -1.07 0.00 0.00 179.97 178.51 2c44 n SER 126 N -4.42 0.46 -0.01 7.04 3.41 -1.26 -3.39 113.62 115.44 2c44 n SER 126 Ca 0.27 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 2c44 n SER 126 Cb 1.14 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 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 -1.97 1.70 -2.50 4.33 4.01 0.93 -5.09 118.16 119.57 2c44 n LYS 127 Ca 0.04 -1.13 -0.39 0.00 -0.51 0.00 0.00 58.31 56.32 2c44 n LYS 127 Cb 0.29 -0.81 -0.04 0.00 -0.51 0.00 0.00 35.03 33.96 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 -0.64 4.50 -0.01 1.97 0.00 -0.46 -4.92 119.30 119.73 2c44 s MET 128 Ca 0.01 1.71 0.00 0.00 0.00 0.00 0.00 55.69 57.41 2c44 s MET 128 Cb 0.01 -3.00 0.01 0.00 0.00 0.00 0.00 34.83 31.85 2c44 s MET 128 CO 0.00 0.11 0.01 0.08 0.00 0.00 0.00 175.02 175.23 2c44 s VAL 129 N -1.31 -0.02 0.09 5.16 1.01 -0.48 -2.72 120.40 122.14 2c44 s VAL 129 Ca 0.48 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.60 2c44 s VAL 129 Cb -0.29 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 2c44 s VAL 129 CO 0.37 0.04 -0.01 0.00 0.00 0.00 0.00 175.10 175.50 2c44 s ALA 130 N 0.46 3.26 0.24 5.51 0.00 0.09 -4.15 121.76 127.17 2c44 s ALA 130 Ca -0.04 -1.13 0.11 0.00 0.00 0.00 0.00 51.96 50.90 2c44 s ALA 130 Cb -0.06 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 2c44 s ALA 130 CO -0.01 0.69 -0.21 -0.06 0.00 0.00 0.00 175.76 176.17 2c44 s PHE 131 N -1.31 2.25 -0.03 0.00 0.40 -1.17 -1.56 117.98 116.56 2c44 s PHE 131 Ca 0.25 -0.36 -0.29 0.00 -0.60 0.00 0.00 56.93 55.94 2c44 s PHE 131 Cb -0.12 -1.03 0.09 0.00 0.51 0.00 0.00 43.02 42.48 2c44 s PHE 131 CO 0.18 0.61 0.81 0.45 0.70 0.00 0.00 175.22 177.97 2c44 s SER 132 N -3.17 -0.49 0.55 1.36 0.15 -1.08 -0.66 113.70 110.37 2c44 s SER 132 Ca 0.26 0.32 0.33 0.00 0.70 0.00 0.00 55.95 57.56 2c44 s SER 132 Cb -0.06 0.44 1.59 0.00 -1.71 0.00 0.00 66.02 66.28 2c44 s SER 132 CO 0.12 -0.60 2.09 -0.55 1.20 0.00 0.00 173.24 175.50 2c44 h ASN 133 N 2.45 0.00 0.00 5.45 -1.07 -1.82 0.66 115.58 121.25 2c44 h ASN 133 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.12 2c44 h ASN 133 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 2c44 h ASN 133 CO 0.35 0.07 0.00 0.00 0.07 0.00 0.00 177.43 177.91 2c44 n TYR 134 N -3.34 0.00 -2.31 4.14 4.19 -1.26 -3.78 117.16 114.80 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 0.24 0.00 -0.02 0.00 0.49 0.00 0.00 39.34 40.05 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 3.00 0.72 2.98 0.08 -1.26 -4.71 117.98 118.79 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 -3.35 0.03 0.00 -0.57 0.00 0.00 43.02 39.13 2c44 s PHE 135 CO 0.00 -1.32 1.08 -0.06 -0.10 0.00 0.00 175.22 174.82 2c44 s PHE 136 N -1.51 2.78 0.22 0.36 0.40 -1.26 -4.81 117.98 114.15 2c44 s PHE 136 Ca 0.60 1.51 -0.09 0.00 -0.60 0.00 0.00 56.93 58.36 2c44 s PHE 136 Cb -0.28 -3.01 0.24 0.00 0.51 0.00 0.00 43.02 40.47 2c44 s PHE 136 CO 0.35 -1.56 1.84 0.38 0.70 0.00 0.00 175.22 176.93 2c44 h ASP 137 N -0.74 0.70 0.70 1.36 3.04 -1.96 -0.63 116.42 118.89 2c44 h ASP 137 Ca -0.44 0.01 -0.18 0.00 -3.24 0.00 0.00 57.03 53.18 2c44 h ASP 137 Cb 1.23 -0.14 -0.02 0.00 -1.04 0.00 0.00 39.33 39.36 2c44 h ASP 137 CO 0.54 0.47 -0.83 0.71 -2.04 0.00 0.00 179.24 178.09 2c44 h THR 138 N 0.84 1.54 -0.22 1.15 1.35 -1.98 -1.66 112.91 113.92 2c44 h THR 138 Ca 0.31 -2.67 -0.06 0.00 -0.55 0.00 0.00 66.41 63.43 2c44 h THR 138 Cb 0.10 2.46 -0.01 0.00 -1.73 0.00 0.00 68.15 68.98 2c44 h THR 138 CO -0.14 0.77 -0.10 0.74 -0.25 0.00 0.00 175.52 176.54 2c44 h THR 139 N 0.05 1.30 -0.64 6.82 2.02 -1.82 -1.22 112.91 119.42 2c44 h THR 139 Ca -0.02 -1.16 -0.01 0.00 0.77 0.00 0.00 66.41 65.99 2c44 h THR 139 Cb 1.44 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 69.42 2c44 h THR 139 CO 0.12 0.35 0.36 -0.61 0.37 0.00 0.00 175.52 176.11 2c44 h GLN 140 N 0.16 0.89 0.34 6.66 4.15 -1.14 -1.28 115.11 124.89 2c44 h GLN 140 Ca 0.05 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 2c44 h GLN 140 Cb 0.59 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 2c44 h GLN 140 CO 0.03 0.67 -0.28 0.78 -1.93 0.00 0.00 178.83 178.10 2c44 h GLY 141 N 0.87 -0.67 1.68 2.39 0.00 -1.12 -0.92 103.07 105.30 2c44 h GLY 141 Ca 0.23 0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.84 2c44 h GLY 141 CO -0.04 -0.26 0.02 0.45 0.00 0.00 0.00 176.54 176.72 2c44 h HIS 142 N -0.63 0.41 0.47 5.60 3.86 -1.12 0.10 115.15 123.83 2c44 h HIS 142 Ca -0.02 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.14 2c44 h HIS 142 Cb 0.56 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2c44 h HIS 142 CO -0.15 0.40 -0.23 0.77 0.86 0.00 0.00 177.93 179.58 2c44 h SER 143 N 0.40 -0.54 -0.68 2.45 0.02 -0.94 -2.05 113.55 112.20 2c44 h SER 143 Ca 0.09 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2c44 h SER 143 Cb 0.23 0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 2c44 h SER 143 CO 0.00 -0.27 0.42 1.56 -1.14 0.00 0.00 176.83 177.40 2c44 h GLN 144 N -0.79 0.94 0.00 3.45 4.20 -0.91 -0.01 115.11 121.99 2c44 h GLN 144 Ca -0.06 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 2c44 h GLN 144 Cb 0.55 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 2c44 h GLN 144 CO 0.11 0.66 -0.11 0.82 -0.67 0.00 0.00 178.83 179.64 2c44 h ILE 145 N 0.95 0.70 -0.46 2.54 2.04 -0.69 -0.13 117.51 122.47 2c44 h ILE 145 Ca 0.25 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2c44 h ILE 145 Cb -0.04 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2c44 h ILE 145 CO -0.05 0.10 0.00 0.59 0.00 0.00 0.00 178.15 178.80 2c44 n ASN 146 N -3.87 3.18 -0.35 1.72 3.02 -0.16 -4.91 115.26 113.90 2c44 n ASN 146 Ca -0.02 -2.21 -0.05 0.00 -0.03 0.00 0.00 54.58 52.27 2c44 n ASN 146 Cb 0.20 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 38.92 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 1.00 0.73 3.49 7.41 0.00 -0.06 -5.02 105.19 112.73 2c44 n GLY 147 Ca 0.17 -0.65 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 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 0.76 4.40 0.22 0.00 2.01 -1.10 -2.73 115.64 119.19 2c44 s THR 149 Ca 0.00 1.40 0.11 0.00 0.31 0.00 0.00 61.69 63.51 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 -0.42 -0.19 0.68 -0.69 0.00 0.00 174.62 174.03 2c44 s VAL 150 N -2.29 2.62 -0.11 3.82 -7.23 -1.26 -0.73 120.40 115.21 2c44 s VAL 150 Ca 0.61 -2.04 -0.04 0.00 -1.81 0.00 0.00 61.98 58.71 2c44 s VAL 150 Cb -0.10 -2.31 0.06 0.00 0.56 0.00 0.00 36.38 34.60 2c44 s VAL 150 CO 0.18 -0.20 0.21 -0.13 -0.31 0.00 0.00 175.10 174.86 2c44 s ARG 151 N -2.96 0.10 -0.26 4.82 0.52 -0.60 -4.91 118.95 115.66 2c44 s ARG 151 Ca 0.24 0.63 -0.19 0.00 -0.52 0.00 0.00 55.73 55.90 2c44 s ARG 151 Cb -0.07 -0.22 -0.02 0.00 0.52 0.00 0.00 34.95 35.16 2c44 s ARG 151 CO 0.13 -0.32 0.57 -0.80 0.02 0.00 0.00 175.30 174.90 2c44 s ASN 152 N 2.36 6.50 -0.93 0.23 0.01 -1.26 -2.63 114.94 119.22 2c44 s ASN 152 Ca 0.02 0.60 -0.01 0.00 -0.71 0.00 0.00 52.86 52.77 2c44 s ASN 152 Cb -0.12 -2.31 0.28 0.00 0.41 0.00 0.00 41.25 39.51 2c44 s ASN 152 CO -0.08 -0.33 1.18 1.33 -1.51 0.00 0.00 177.10 177.69 2c44 n VAL 153 N 5.18 4.19 -2.70 1.60 0.24 0.22 -4.96 118.33 122.11 2c44 n VAL 153 Ca -0.02 -5.62 -0.26 0.00 -2.04 0.00 0.00 64.34 56.40 2c44 n VAL 153 Cb 0.49 -2.14 0.01 0.00 -1.47 0.00 0.00 33.84 30.74 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 -2.49 3.35 0.52 6.34 -0.85 -1.25 -0.51 117.35 122.47 2c44 s TYR 154 Ca 0.33 0.56 -0.10 0.00 -0.52 0.00 0.00 57.07 57.34 2c44 s TYR 154 Cb 0.06 -2.43 -0.05 0.00 0.38 0.00 0.00 41.96 39.92 2c44 s TYR 154 CO 0.04 -0.46 0.90 0.96 -1.52 0.00 0.00 175.55 175.46 2c44 s ILE 155 N -2.75 4.77 0.43 -3.49 -4.36 -1.25 -4.55 121.20 110.00 2c44 s ILE 155 Ca 0.49 0.65 0.19 0.00 -0.26 0.00 0.00 60.65 61.73 2c44 s ILE 155 Cb -0.10 -3.83 0.40 0.00 1.25 0.00 0.00 42.46 40.18 2c44 s ILE 155 CO 0.42 -0.88 1.83 0.07 0.24 0.00 0.00 174.94 176.62 2c44 h LYS 156 N 0.29 0.35 0.00 0.37 2.10 -1.97 -1.10 116.57 116.61 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 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 32.44 2c44 h LYS 156 CO 0.62 0.23 -0.26 0.93 -2.00 0.00 0.00 179.45 178.97 2c44 h GLU 157 N 0.36 0.00 -0.86 0.07 3.07 -1.95 -3.39 114.58 111.89 2c44 h GLU 157 Ca 0.50 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 59.44 2c44 h GLU 157 Cb 1.33 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 29.13 2c44 h GLU 157 CO -0.19 0.26 -0.50 0.00 -1.40 0.00 0.00 179.01 177.18 2c44 n ALA 158 N -2.18 -0.54 -1.10 3.43 0.00 -0.42 -1.76 120.51 117.95 2c44 n ALA 158 Ca 0.02 0.74 -0.09 0.00 0.00 0.00 0.00 53.44 54.11 2c44 n ALA 158 Cb 0.60 -0.13 0.28 0.00 0.00 0.00 0.00 19.45 20.19 2c44 n ALA 158 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2c44 n PHE 159 N -5.09 2.48 -3.18 0.00 3.01 -1.26 -4.79 117.46 108.63 2c44 n PHE 159 Ca 0.02 -1.33 -0.46 0.00 1.01 0.00 0.00 57.45 56.69 2c44 n PHE 159 Cb 0.23 -0.72 -0.03 0.00 -0.01 0.00 0.00 39.48 38.95 2c44 n PHE 159 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2c44 s ASP 160 N -1.18 6.58 0.00 4.37 -1.08 -0.72 -4.86 116.67 119.78 2c44 s ASP 160 Ca 0.55 -2.22 0.12 0.00 -0.52 0.00 0.00 52.55 50.47 2c44 s ASP 160 Cb 0.45 -2.28 0.58 0.00 -1.46 0.00 0.00 42.92 40.21 2c44 s ASP 160 CO 0.12 -0.83 1.29 0.35 0.52 0.00 0.00 175.17 176.62 2c44 n THR 161 N 4.77 0.74 0.76 1.71 -2.24 -1.26 -2.03 114.28 116.73 2c44 n THR 161 Ca 0.11 0.18 0.11 0.00 -2.27 0.00 0.00 64.05 62.18 2c44 n THR 161 Cb 0.46 -0.99 -0.02 0.00 -2.10 0.00 0.00 70.33 67.68 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 -0.29 -1.10 3.41 3.38 0.00 -1.26 -4.63 105.19 104.69 2c44 n GLY 162 Ca 0.05 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.11 2.48 -0.05 1.61 1.01 -0.86 -5.13 120.40 116.35 2c44 s VAL 163 Ca 0.06 -1.38 -0.10 0.00 0.00 0.00 0.00 61.98 60.56 2c44 s VAL 163 Cb 0.16 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 2c44 s VAL 163 CO 0.83 0.29 0.28 0.00 0.00 0.00 0.00 175.10 176.49 2c44 s ARG 164 N -1.53 3.67 -0.15 2.72 3.03 -1.26 -4.86 118.95 120.58 2c44 s ARG 164 Ca 0.14 0.12 -0.13 0.00 2.03 0.00 0.00 55.73 57.89 2c44 s ARG 164 Cb -0.10 -3.19 0.04 0.00 -1.03 0.00 0.00 34.95 30.67 2c44 s ARG 164 CO 0.05 0.72 0.39 -0.47 -1.13 0.00 0.00 175.30 174.86 2c44 s TYR 165 N -1.09 -0.45 0.34 5.89 5.04 -1.26 -5.08 117.35 120.75 2c44 s TYR 165 Ca 0.21 1.08 0.02 0.00 -2.44 0.00 0.00 57.07 55.93 2c44 s TYR 165 Cb -0.14 0.16 0.61 0.00 0.35 0.00 0.00 41.96 42.94 2c44 s TYR 165 CO 0.10 -0.23 2.00 -0.44 -1.34 0.00 0.00 175.55 175.64 2c44 h ASP 166 N 5.77 0.75 -2.10 4.32 5.19 -1.98 -3.36 116.42 125.01 2c44 h ASP 166 Ca -0.28 -0.02 -0.57 0.00 -0.62 0.00 0.00 57.03 55.53 2c44 h ASP 166 Cb 1.18 -0.19 -0.39 0.00 0.18 0.00 0.00 39.33 40.11 2c44 h ASP 166 CO 0.27 0.55 -1.03 0.49 -3.12 0.00 0.00 179.24 176.40 2c44 n PHE 167 N -4.43 -0.02 0.58 4.55 3.01 -1.26 -4.70 117.46 115.20 2c44 n PHE 167 Ca 0.07 -3.59 0.06 0.00 1.01 0.00 0.00 57.45 55.00 2c44 n PHE 167 Cb 0.05 -0.27 0.31 0.00 -0.01 0.00 0.00 39.48 39.56 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 1.61 0.17 0.00 -1.08 5.02 -1.24 -1.90 118.16 120.74 2c44 n LYS 168 Ca 0.23 0.17 0.13 0.00 -2.02 0.00 0.00 58.31 56.83 2c44 n LYS 168 Cb 0.51 -1.50 0.37 0.00 -0.02 0.00 0.00 35.03 34.39 2c44 n LYS 168 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c44 n GLY 169 N -0.22 -0.20 3.62 0.72 0.00 -0.51 -4.42 105.19 104.19 2c44 n GLY 169 Ca 0.06 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.13 0.55 -4.81 1.61 3.02 -0.80 -4.70 115.26 110.01 2c44 n ASN 170 Ca 0.14 0.67 -0.34 0.00 -0.03 0.00 0.00 54.58 55.03 2c44 n ASN 170 Cb 0.38 -1.41 -0.06 0.00 -0.61 0.00 0.00 39.78 38.08 2c44 n ASN 170 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2c44 s PHE 171 N -1.80 3.24 -0.88 3.10 0.40 -1.26 -3.79 117.98 116.98 2c44 s PHE 171 Ca 0.74 1.61 -0.19 0.00 -0.60 0.00 0.00 56.93 58.49 2c44 s PHE 171 Cb -0.35 -2.93 0.13 0.00 0.51 0.00 0.00 43.02 40.38 2c44 s PHE 171 CO 0.50 -0.32 1.07 0.34 0.70 0.00 0.00 175.22 177.51 2c44 s ASP 172 N -2.05 6.57 0.18 1.36 -1.08 0.33 -4.76 116.67 117.22 2c44 s ASP 172 Ca 0.62 -1.95 -0.17 0.00 -0.52 0.00 0.00 52.55 50.53 2c44 s ASP 172 Cb -0.12 -2.39 0.12 0.00 -1.46 0.00 0.00 42.92 39.07 2c44 s ASP 172 CO 0.16 -1.07 1.65 -0.07 0.52 0.00 0.00 175.17 176.36 2c44 h LEU 173 N 10.33 -0.54 -0.14 -1.34 3.38 -1.93 0.27 115.31 125.34 2c44 h LEU 173 Ca 0.09 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 2c44 h LEU 173 Cb 1.03 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2c44 h LEU 173 CO 1.09 -0.19 0.08 -0.33 0.09 0.00 0.00 178.44 179.18 2c44 h GLU 174 N -0.06 0.20 -0.75 1.13 5.08 -1.99 -2.00 114.58 116.18 2c44 h GLU 174 Ca 0.21 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.67 2c44 h GLU 174 Cb 0.38 -0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.51 2c44 h GLU 174 CO -0.48 0.21 0.35 0.78 -1.00 0.00 0.00 179.01 178.87 2c44 h GLY 175 N 0.13 1.16 0.98 -3.84 0.00 -1.72 0.24 103.07 100.01 2c44 h GLY 175 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2c44 h GLY 175 CO -0.01 -0.03 0.26 -2.00 0.00 0.00 0.00 176.54 174.76 2c44 h LEU 176 N 0.54 0.56 0.10 3.11 5.85 -0.17 0.38 115.31 125.67 2c44 h LEU 176 Ca 0.40 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 2c44 h LEU 176 Cb 0.53 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.42 2c44 h LEU 176 CO -0.34 0.48 -0.05 -0.08 -0.34 0.00 0.00 178.44 178.11 2c44 h GLU 177 N 0.60 -0.13 -0.85 1.25 4.81 -0.59 -0.77 114.58 118.90 2c44 h GLU 177 Ca 0.16 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2c44 h GLU 177 Cb 0.04 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 2c44 h GLU 177 CO -0.03 0.15 0.56 0.00 -0.73 0.00 0.00 179.01 178.97 2c44 h ARG 178 N -0.40 1.11 -0.50 1.92 3.08 -0.94 -0.49 114.38 118.16 2c44 h ARG 178 Ca -0.01 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.02 2c44 h ARG 178 Cb 0.33 -0.25 -0.05 0.00 0.08 0.00 0.00 29.97 30.09 2c44 h ARG 178 CO 0.02 0.74 0.23 0.78 -1.07 0.00 0.00 179.97 180.67 2c44 h GLY 179 N 1.15 0.69 0.94 0.04 0.00 -0.75 0.56 103.07 105.69 2c44 h GLY 179 Ca 0.32 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.45 2c44 h GLY 179 CO -0.07 0.08 0.08 -2.22 0.00 0.00 0.00 176.54 174.40 2c44 h ILE 180 N 0.45 1.24 -0.42 2.60 2.04 -0.61 -1.50 117.51 121.31 2c44 h ILE 180 Ca 0.22 -0.85 0.02 0.00 1.00 0.00 0.00 64.86 65.25 2c44 h ILE 180 Cb 0.17 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2c44 h ILE 180 CO -0.18 0.29 0.25 -0.33 0.00 0.00 0.00 178.15 178.18 2c44 h GLU 181 N 0.52 0.49 0.01 2.37 5.08 -0.64 0.18 114.58 122.59 2c44 h GLU 181 Ca 0.12 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2c44 h GLU 181 Cb 0.35 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2c44 h GLU 181 CO 0.01 0.32 -0.01 1.05 -1.00 0.00 0.00 179.01 179.38 2c44 h GLU 182 N 0.50 -0.01 -0.94 2.33 9.09 -0.73 -3.05 114.58 121.77 2c44 h GLU 182 Ca 0.16 0.00 0.25 0.00 0.05 0.00 0.00 59.36 59.83 2c44 h GLU 182 Cb 0.00 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.05 2c44 h GLU 182 CO -0.07 -0.01 0.65 0.28 0.05 0.00 0.00 179.01 179.91 2c44 h VAL 183 N -0.02 0.57 -0.14 -1.06 2.07 -1.29 -3.47 116.25 112.91 2c44 h VAL 183 Ca -0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2c44 h VAL 183 Cb 0.01 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2c44 h VAL 183 CO 0.00 0.03 0.00 0.61 0.02 0.00 0.00 177.57 178.23 2c44 n GLY 184 N -1.63 0.58 0.57 2.17 0.00 0.61 -4.64 105.19 102.84 2c44 n GLY 184 Ca 0.20 -1.01 0.38 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.81 0.29 132.00 132.22 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 -0.66 1.44 2.35 -1.90 -3.04 115.58 113.77 2c44 h ASN 186 Ca 0.62 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.37 2c44 h ASN 186 Cb 2.64 0.00 0.00 0.00 0.05 0.00 0.00 38.32 41.01 2c44 h ASN 186 CO -0.01 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.36 2c44 n ASN 187 N -2.99 3.63 -4.21 5.81 3.02 0.10 -3.89 115.26 116.73 2c44 n ASN 187 Ca 0.01 -2.00 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 2c44 n ASN 187 Cb 0.34 -0.44 -0.08 0.00 -0.61 0.00 0.00 39.78 38.99 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 -1.12 4.20 0.34 2.41 1.01 -1.15 -1.38 120.40 124.72 2c44 s VAL 188 Ca 0.45 -1.83 0.20 0.00 0.00 0.00 0.00 61.98 60.81 2c44 s VAL 188 Cb 0.24 -3.77 0.20 0.00 0.00 0.00 0.00 36.38 33.04 2c44 s VAL 188 CO 0.31 -0.78 1.92 1.55 0.00 0.00 0.00 175.10 178.10 2c44 h PRO 189 N 8.41 0.00 -1.42 2.72 0.13 -1.86 -3.45 132.00 136.52 2c44 h PRO 189 Ca -0.20 0.00 0.28 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 0.85 0.25 0.83 1.52 -0.23 0.00 0.00 178.00 181.23 2c44 s TYR 190 N -4.10 -0.10 -0.08 1.56 -0.85 -1.26 -4.32 117.35 108.20 2c44 s TYR 190 Ca -0.02 0.04 0.03 0.00 -0.52 0.00 0.00 57.07 56.60 2c44 s TYR 190 Cb 0.13 0.52 0.01 0.00 0.38 0.00 0.00 41.96 43.00 2c44 s TYR 190 CO 0.65 -0.20 -0.19 0.42 -1.52 0.00 0.00 175.55 174.72 2c44 s ILE 191 N -2.38 1.65 -0.22 -3.49 1.01 -0.53 -3.04 121.20 114.21 2c44 s ILE 191 Ca 0.11 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 2c44 s ILE 191 Cb 0.00 -1.45 -0.02 0.00 0.01 0.00 0.00 42.46 41.00 2c44 s ILE 191 CO -0.04 0.47 0.02 -0.69 0.00 0.00 0.00 174.94 174.69 2c44 s VAL 192 N 0.46 3.99 -0.41 2.92 1.01 0.17 -0.81 120.40 127.72 2c44 s VAL 192 Ca -0.16 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.37 2c44 s VAL 192 Cb -0.17 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.41 2c44 s VAL 192 CO 0.07 0.40 0.34 0.00 0.00 0.00 0.00 175.10 175.91 2c44 s ALA 193 N 1.27 3.46 -0.67 5.51 0.00 0.35 -3.39 121.76 128.28 2c44 s ALA 193 Ca 0.04 -1.64 -0.21 0.00 0.00 0.00 0.00 51.96 50.15 2c44 s ALA 193 Cb -0.15 -2.94 0.09 0.00 0.00 0.00 0.00 23.12 20.12 2c44 s ALA 193 CO 0.01 -1.49 0.92 0.99 0.00 0.00 0.00 175.76 176.20 2c44 s THR 194 N 1.84 4.49 -0.63 0.00 2.01 -1.26 -0.22 115.64 121.87 2c44 s THR 194 Ca 0.07 -0.66 -0.26 0.00 0.31 0.00 0.00 61.69 61.15 2c44 s THR 194 Cb -0.18 -4.65 -0.04 0.00 0.01 0.00 0.00 72.50 67.64 2c44 s THR 194 CO 0.11 -1.38 1.99 -0.63 -0.69 0.00 0.00 174.62 174.02 2c44 s ILE 195 N 3.56 3.29 0.00 1.82 -1.09 -0.56 -3.05 121.20 125.18 2c44 s ILE 195 Ca 0.21 0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.72 2c44 s ILE 195 Cb -0.17 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 36.96 2c44 s ILE 195 CO 0.07 -0.72 0.00 0.41 -1.23 0.00 0.00 174.94 173.47 2c44 n THR 196 N 7.48 -1.09 -2.14 2.92 -1.04 -1.26 -3.78 114.28 115.37 2c44 n THR 196 Ca 0.26 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.85 2c44 n THR 196 Cb 0.52 -1.40 -0.03 0.00 -1.82 0.00 0.00 70.33 67.60 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 5.99 0.09 8.00 0.15 0.56 -4.81 113.70 123.68 2c44 s SER 197 Ca 0.00 0.98 -0.32 0.00 0.70 0.00 0.00 55.95 57.31 2c44 s SER 197 Cb 0.00 -2.53 -0.15 0.00 -1.71 0.00 0.00 66.02 61.63 2c44 s SER 197 CO 0.00 -1.69 1.61 -1.13 1.20 0.00 0.00 173.24 173.23 2c44 h ASN 198 N 12.25 -0.95 0.22 5.45 -0.73 -1.87 0.13 115.58 130.08 2c44 h ASN 198 Ca -0.30 0.07 -0.05 0.00 1.87 0.00 0.00 56.30 57.89 2c44 h ASN 198 Cb 1.14 0.31 -0.01 0.00 0.27 0.00 0.00 38.32 40.03 2c44 h ASN 198 CO 1.08 -0.52 -0.22 0.28 -0.37 0.00 0.00 177.43 177.68 2c44 h SER 199 N -0.79 0.00 0.60 1.15 0.02 -1.90 -0.78 113.55 111.84 2c44 h SER 199 Ca -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2c44 h SER 199 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 2c44 h SER 199 CO -0.02 0.22 0.00 0.00 -1.14 0.00 0.00 176.83 175.89 2c44 n ALA 200 N -2.50 1.63 0.00 3.77 0.00 -1.14 -4.81 120.51 117.46 2c44 n ALA 200 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2c44 n ALA 200 Cb 0.28 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 -0.08 1.53 2.79 0.00 0.00 -0.33 -4.55 105.19 104.54 2c44 n GLY 201 Ca 0.02 0.00 -0.17 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 -0.23 3.79 -0.02 0.00 0.40 -4.06 105.19 104.81 2c44 n GLY 202 Ca 0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2c44 n GLY 202 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c44 s GLN 203 N -5.54 4.42 0.68 1.61 -1.52 -0.98 -2.07 119.66 116.26 2c44 s GLN 203 Ca 0.28 0.98 -0.12 0.00 -1.95 0.00 0.00 55.36 54.55 2c44 s GLN 203 Cb -0.12 -3.25 0.00 0.00 -0.22 0.00 0.00 33.01 29.42 2c44 s GLN 203 CO 0.34 0.59 1.07 -1.25 -0.25 0.00 0.00 175.29 175.79 2c44 s PRO 204 N -1.11 2.92 -0.17 2.91 0.04 -1.26 -0.33 135.00 138.00 2c44 s PRO 204 Ca 0.33 1.06 -0.00 0.00 0.04 0.00 0.00 61.00 62.43 2c44 s PRO 204 Cb -0.22 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.34 2c44 s PRO 204 CO 0.23 -1.12 -0.14 0.08 0.04 0.00 0.00 177.00 176.10 2c44 s VAL 205 N -2.86 2.75 0.67 -0.36 1.01 -1.26 -1.42 120.40 118.93 2c44 s VAL 205 Ca 0.60 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 2c44 s VAL 205 Cb -0.15 -2.18 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2c44 s VAL 205 CO 0.50 0.50 1.11 -0.94 0.00 0.00 0.00 175.10 176.28 2c44 s SER 206 N 0.97 5.03 0.24 3.32 1.04 -1.26 -4.90 113.70 118.14 2c44 s SER 206 Ca -0.02 2.01 -0.00 0.00 0.48 0.00 0.00 55.95 58.42 2c44 s SER 206 Cb -0.15 -2.55 0.28 0.00 0.10 0.00 0.00 66.02 63.70 2c44 s SER 206 CO -0.02 -1.69 1.64 0.25 0.98 0.00 0.00 173.24 174.40 2c44 h LEU 207 N -0.04 0.56 -0.59 2.42 5.85 -1.97 -2.38 115.31 119.17 2c44 h LEU 207 Ca -0.47 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.02 2c44 h LEU 207 Cb 1.25 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 2c44 h LEU 207 CO 0.54 0.86 0.35 0.00 -0.34 0.00 0.00 178.44 179.84 2c44 h ALA 208 N 1.17 0.75 -0.81 1.25 0.00 -2.00 -1.19 119.26 118.44 2c44 h ALA 208 Ca 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2c44 h ALA 208 Cb 0.81 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 2c44 h ALA 208 CO 0.07 0.25 0.48 -0.97 0.00 0.00 0.00 179.25 179.08 2c44 h ASN 209 N 0.80 0.98 -0.61 0.00 -0.73 -1.88 -1.63 115.58 112.52 2c44 h ASN 209 Ca 0.21 -0.07 -0.05 0.00 1.87 0.00 0.00 56.30 58.26 2c44 h ASN 209 Cb 0.00 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.32 2c44 h ASN 209 CO -0.04 0.76 0.19 -0.07 -0.37 0.00 0.00 177.43 177.90 2c44 h LEU 210 N 1.12 0.89 -0.29 0.34 3.38 -0.91 -0.09 115.31 119.73 2c44 h LEU 210 Ca 0.29 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2c44 h LEU 210 Cb -0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2c44 h LEU 210 CO -0.05 0.86 0.19 0.11 0.09 0.00 0.00 178.44 179.64 2c44 h LYS 211 N 0.87 0.39 -0.30 1.13 1.57 -0.75 0.13 116.57 119.59 2c44 h LYS 211 Ca 0.20 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2c44 h LYS 211 Cb 0.29 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2c44 h LYS 211 CO -0.01 0.26 0.17 0.00 -0.57 0.00 0.00 179.45 179.31 2c44 h ALA 212 N 1.11 0.39 -0.23 3.86 0.00 -1.08 -0.80 119.26 122.50 2c44 h ALA 212 Ca 0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c44 h ALA 212 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2c44 h ALA 212 CO -0.02 -0.10 0.14 1.98 0.00 0.00 0.00 179.25 181.25 2c44 h MET 213 N 0.38 0.32 -0.29 0.00 1.85 -0.73 -1.69 114.93 114.76 2c44 h MET 213 Ca 0.11 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 59.15 2c44 h MET 213 Cb 0.04 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.99 2c44 h MET 213 CO -0.02 0.27 0.09 -0.92 -0.40 0.00 0.00 176.91 175.93 2c44 h TYR 214 N 0.28 0.41 -0.49 1.39 3.20 -0.59 -0.86 116.97 120.31 2c44 h TYR 214 Ca 0.08 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 2c44 h TYR 214 Cb 0.04 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2c44 h TYR 214 CO -0.04 0.35 0.16 1.03 -1.64 0.00 0.00 178.16 178.02 2c44 h SER 215 N 0.41 0.71 -0.45 -2.11 0.87 -0.58 0.19 113.55 112.60 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 0.13 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 2c44 h SER 215 CO -0.01 0.72 0.17 0.40 -0.53 0.00 0.00 176.83 177.59 2c44 h ILE 216 N 0.66 1.21 -0.65 2.23 2.04 -0.57 -2.01 117.51 120.42 2c44 h ILE 216 Ca 0.16 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 2c44 h ILE 216 Cb 0.26 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2c44 h ILE 216 CO -0.01 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.73 2c44 h ALA 217 N 1.02 0.84 -0.87 1.87 0.00 -0.77 -2.31 119.26 119.03 2c44 h ALA 217 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c44 h ALA 217 Cb 0.21 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2c44 h ALA 217 CO -0.01 0.37 0.55 1.57 0.00 0.00 0.00 179.25 181.73 2c44 h LYS 218 N 0.89 1.16 -0.63 0.00 -0.00 -0.45 0.11 116.57 117.66 2c44 h LYS 218 Ca 0.23 -0.09 0.11 0.00 -0.00 0.00 0.00 60.65 60.90 2c44 h LYS 218 Cb 0.07 -0.25 -0.08 0.00 -0.00 0.00 0.00 32.23 31.96 2c44 h LYS 218 CO -0.03 0.79 0.18 -0.22 -0.00 0.00 0.00 179.45 180.17 2c44 h LYS 219 N 1.19 0.32 -0.58 0.07 3.64 -0.80 -1.01 116.57 119.40 2c44 h LYS 219 Ca 0.32 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 2c44 h LYS 219 Cb -0.10 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2c44 h LYS 219 CO -0.06 0.21 0.00 0.66 -2.27 0.00 0.00 179.45 177.99 2c44 n TYR 220 N -5.07 0.77 -3.72 1.91 4.02 -0.95 -4.95 117.16 109.16 2c44 n TYR 220 Ca 0.10 -0.38 -0.24 0.00 -0.01 0.00 0.00 57.90 57.36 2c44 n TYR 220 Cb 0.32 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.69 2c44 n TYR 220 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2c44 n ASP 221 N 1.40 -3.03 -4.65 7.72 2.03 0.17 -4.94 116.55 115.25 2c44 n ASP 221 Ca 0.21 -0.75 -0.36 0.00 0.52 0.00 0.00 54.79 54.41 2c44 n ASP 221 Cb 0.56 -4.25 -0.10 0.00 -0.72 0.00 0.00 41.12 36.62 2c44 n ASP 221 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2c44 s ILE 222 N -3.48 5.27 0.28 5.18 1.01 -0.02 -5.01 121.20 124.43 2c44 s ILE 222 Ca 0.28 0.15 -0.30 0.00 0.00 0.00 0.00 60.65 60.78 2c44 s ILE 222 Cb -0.14 -3.46 -0.12 0.00 0.01 0.00 0.00 42.46 38.75 2c44 s ILE 222 CO 0.80 0.35 1.51 -2.65 0.00 0.00 0.00 174.94 174.95 2c44 n PRO 223 N 4.31 2.42 -3.92 2.79 -0.02 -1.26 -4.61 135.00 134.71 2c44 n PRO 223 Ca -0.15 0.86 -0.35 0.00 -2.02 0.00 0.00 63.50 61.84 2c44 n PRO 223 Cb 0.52 -2.59 -0.14 0.00 -0.02 0.00 0.00 33.50 31.27 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 -0.08 3.24 -0.22 -1.45 1.01 -1.26 -1.45 120.40 120.18 2c44 s VAL 224 Ca 0.65 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.98 2c44 s VAL 224 Cb -0.56 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2c44 s VAL 224 CO 0.50 0.40 0.05 -0.69 0.00 0.00 0.00 175.10 175.35 2c44 s VAL 225 N 1.45 4.26 -0.54 2.92 1.01 0.01 -0.93 120.40 128.58 2c44 s VAL 225 Ca 0.05 -0.20 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 2c44 s VAL 225 Cb -0.14 -2.96 0.06 0.00 0.00 0.00 0.00 36.38 33.33 2c44 s VAL 225 CO -0.04 0.39 0.75 -0.32 0.00 0.00 0.00 175.10 175.87 2c44 s MET 226 N 1.21 3.18 -0.38 2.72 1.75 -0.15 -0.50 119.30 127.13 2c44 s MET 226 Ca 0.04 -0.74 -0.29 0.00 -1.25 0.00 0.00 55.69 53.46 2c44 s MET 226 Cb -0.14 -4.11 0.00 0.00 2.84 0.00 0.00 34.83 33.42 2c44 s MET 226 CO 0.03 -1.36 1.45 0.34 -0.65 0.00 0.00 175.02 174.82 2c44 s ASP 227 N 2.87 6.34 -0.23 1.11 -1.08 0.70 -2.03 116.67 124.36 2c44 s ASP 227 Ca 0.20 0.98 0.14 0.00 -0.52 0.00 0.00 52.55 53.35 2c44 s ASP 227 Cb -0.17 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.40 2c44 s ASP 227 CO 0.13 -1.40 1.59 -1.20 0.52 0.00 0.00 175.17 174.81 2c44 n SER 228 N 8.76 4.50 -0.31 -0.34 7.64 -0.61 -1.50 113.62 131.77 2c44 n SER 228 Ca 0.17 -3.08 0.14 0.00 1.01 0.00 0.00 58.87 57.11 2c44 n SER 228 Cb 0.47 -0.63 0.32 0.00 -1.01 0.00 0.00 64.21 63.37 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 2.53 1.45 -1.38 -0.43 0.00 -1.80 -2.57 119.26 117.06 2c44 h ALA 229 Ca 0.06 0.17 -0.55 0.00 0.00 0.00 0.00 54.91 54.59 2c44 h ALA 229 Cb 1.76 0.17 -0.42 0.00 0.00 0.00 0.00 17.79 19.31 2c44 h ALA 229 CO 0.40 -0.38 -0.80 0.54 0.00 0.00 0.00 179.25 179.01 2c44 n ARG 230 N -5.07 3.14 -0.02 0.00 1.74 -1.25 -2.16 116.66 113.04 2c44 n ARG 230 Ca 0.23 -4.32 -0.00 0.00 -0.77 0.00 0.00 57.85 52.99 2c44 n ARG 230 Cb 0.69 -2.12 0.30 0.00 -1.02 0.00 0.00 32.46 30.30 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 2.60 0.57 -0.28 -1.55 -0.00 -1.61 -2.79 116.94 113.88 2c44 h PHE 231 Ca 0.25 -0.05 -0.04 0.00 -0.00 0.00 0.00 57.97 58.13 2c44 h PHE 231 Cb 1.00 -0.17 -0.01 0.00 -0.00 0.00 0.00 35.95 36.77 2c44 h PHE 231 CO 0.78 0.54 0.01 0.00 -0.00 0.00 0.00 178.31 179.64 2c44 h ALA 232 N 1.51 0.38 -0.63 12.09 0.00 -1.88 -1.23 119.26 129.49 2c44 h ALA 232 Ca 0.12 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2c44 h ALA 232 Cb 0.29 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2c44 h ALA 232 CO 0.01 0.11 0.21 0.93 0.00 0.00 0.00 179.25 180.50 2c44 h GLU 233 N 0.29 0.96 -0.63 0.00 5.08 -1.88 -1.07 114.58 117.32 2c44 h GLU 233 Ca 0.08 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2c44 h GLU 233 Cb 0.41 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2c44 h GLU 233 CO 0.01 0.82 0.28 -0.97 -1.00 0.00 0.00 179.01 178.15 2c44 h ASN 234 N 0.93 0.84 -0.61 1.42 -1.24 -1.33 -1.49 115.58 114.09 2c44 h ASN 234 Ca 0.21 -0.15 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 2c44 h ASN 234 Cb 0.25 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.06 2c44 h ASN 234 CO -0.01 0.76 0.38 0.00 -1.29 0.00 0.00 177.43 177.26 2c44 h ALA 235 N 1.12 1.50 -0.24 1.57 0.00 -0.53 -1.43 119.26 121.25 2c44 h ALA 235 Ca 0.21 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2c44 h ALA 235 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2c44 h ALA 235 CO -0.02 0.44 0.05 -0.92 0.00 0.00 0.00 179.25 178.80 2c44 h TYR 236 N 0.85 0.42 -0.57 0.00 3.20 -0.42 -1.63 116.97 118.81 2c44 h TYR 236 Ca 0.22 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 2c44 h TYR 236 Cb -0.04 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.09 2c44 h TYR 236 CO 0.00 0.50 0.12 0.74 -1.64 0.00 0.00 178.16 177.89 2c44 h PHE 237 N 0.21 0.93 -0.49 -3.82 0.04 -0.90 -1.16 116.94 111.75 2c44 h PHE 237 Ca 0.07 -0.10 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 2c44 h PHE 237 Cb 0.31 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 2c44 h PHE 237 CO 0.02 0.79 0.27 0.82 -0.60 0.00 0.00 178.31 179.61 2c44 h ILE 238 N 0.86 1.17 -0.17 -0.55 2.04 -1.14 0.21 117.51 119.93 2c44 h ILE 238 Ca 0.18 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 2c44 h ILE 238 Cb 0.34 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2c44 h ILE 238 CO 0.00 0.18 -0.05 0.50 0.00 0.00 0.00 178.15 178.77 2c44 h LYS 239 N 0.65 0.26 0.00 2.37 3.64 -0.64 0.12 116.57 122.97 2c44 h LYS 239 Ca 0.17 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.35 2c44 h LYS 239 Cb 0.04 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2c44 h LYS 239 CO -0.03 0.33 -1.34 1.96 -2.27 0.00 0.00 179.45 178.11 2c44 h GLN 240 N 0.25 0.00 0.00 1.90 1.08 -0.71 -3.35 115.11 114.29 2c44 h GLN 240 Ca 0.06 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.17 2c44 h GLN 240 Cb 0.26 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 2c44 h GLN 240 CO 0.01 0.30 -1.42 0.54 -0.95 0.00 0.00 178.83 177.30 2c44 n ARG 241 N -2.91 2.05 -3.11 1.46 1.74 0.70 -4.92 116.66 111.66 2c44 n ARG 241 Ca -0.09 -0.02 -0.44 0.00 -0.77 0.00 0.00 57.85 56.53 2c44 n ARG 241 Cb 0.83 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 31.04 2c44 n ARG 241 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2c44 s GLU 242 N -2.27 3.07 0.17 5.56 2.12 0.40 -4.96 118.70 122.79 2c44 s GLU 242 Ca -0.03 -1.18 -0.05 0.00 0.36 0.00 0.00 54.97 54.06 2c44 s GLU 242 Cb 0.03 -4.22 0.28 0.00 0.26 0.00 0.00 34.13 30.48 2c44 s GLU 242 CO 0.29 -1.46 0.98 0.00 -0.54 0.00 0.00 175.26 174.52 2c44 n ALA 243 N 6.34 0.13 0.07 6.30 0.00 -1.26 -0.55 120.51 131.54 2c44 n ALA 243 Ca -0.08 0.68 0.19 0.00 0.00 0.00 0.00 53.44 54.23 2c44 n ALA 243 Cb 0.43 -0.40 0.71 0.00 0.00 0.00 0.00 19.45 20.19 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 -0.33 0.00 4.81 -1.93 -2.81 114.58 114.31 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 -0.64 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.30 2c44 n TYR 245 N -4.23 0.47 -0.34 0.92 4.01 0.29 -4.69 117.16 113.58 2c44 n TYR 245 Ca 0.07 -0.52 0.21 0.00 -0.16 0.00 0.00 57.90 57.51 2c44 n TYR 245 Cb 0.52 -0.04 0.45 0.00 -0.31 0.00 0.00 39.34 39.95 2c44 n TYR 245 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2c44 h LYS 246 N 1.95 0.44 -0.66 -0.72 6.56 -1.46 -0.58 116.57 122.10 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 0.76 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 32.32 2c44 h LYS 246 CO 0.01 0.29 0.00 -0.25 -2.06 0.00 0.00 179.45 177.44 2c44 n ASP 247 N -4.87 4.33 -4.91 0.86 8.00 -1.26 -4.90 116.55 113.81 2c44 n ASP 247 Ca 0.28 -2.31 -0.28 0.00 0.71 0.00 0.00 54.79 53.19 2c44 n ASP 247 Cb 0.87 -0.54 -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 -1.64 3.52 0.48 1.24 0.52 -0.23 -5.09 118.94 117.74 2c44 s TRP 248 Ca 0.48 0.74 -0.04 0.00 0.02 0.00 0.00 56.10 57.30 2c44 s TRP 248 Cb 0.29 -2.21 -0.03 0.00 -1.15 0.00 0.00 33.47 30.37 2c44 s TRP 248 CO 0.25 -0.08 0.76 0.95 0.02 0.00 0.00 176.95 178.86 2c44 s THR 249 N -2.46 4.69 0.27 2.01 -4.23 -1.26 -4.89 115.64 109.76 2c44 s THR 249 Ca 0.46 0.03 -0.02 0.00 -1.18 0.00 0.00 61.69 60.98 2c44 s THR 249 Cb -0.10 -3.78 0.27 0.00 1.34 0.00 0.00 72.50 70.23 2c44 s THR 249 CO 0.38 -0.72 1.87 0.40 -0.54 0.00 0.00 174.62 176.01 2c44 h ILE 250 N 0.25 1.06 -0.47 2.99 1.08 -1.91 0.09 117.51 120.60 2c44 h ILE 250 Ca -0.47 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 2c44 h ILE 250 Cb 1.22 -0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 34.77 2c44 h ILE 250 CO 0.61 0.21 0.20 -0.33 -0.69 0.00 0.00 178.15 178.15 2c44 h GLU 251 N 1.14 0.69 -0.41 2.37 3.07 -1.93 -0.48 114.58 119.03 2c44 h GLU 251 Ca 0.44 -0.12 -0.06 0.00 -0.50 0.00 0.00 59.36 59.12 2c44 h GLU 251 Cb 0.21 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 2c44 h GLU 251 CO -0.18 0.61 0.02 1.96 -1.40 0.00 0.00 179.01 180.02 2c44 h GLN 252 N 0.62 0.71 -0.78 2.33 4.20 -1.71 -1.66 115.11 118.81 2c44 h GLN 252 Ca 0.16 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 2c44 h GLN 252 Cb 0.16 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 2c44 h GLN 252 CO -0.02 0.78 0.34 0.82 -0.67 0.00 0.00 178.83 180.08 2c44 h ILE 253 N 0.55 1.25 -0.16 2.54 2.04 -0.87 -1.61 117.51 121.26 2c44 h ILE 253 Ca 0.12 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 2c44 h ILE 253 Cb 0.44 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2c44 h ILE 253 CO 0.02 0.32 0.05 0.74 0.00 0.00 0.00 178.15 179.27 2c44 h THR 254 N 1.13 1.19 -0.64 -0.27 2.02 -0.91 0.82 112.91 116.25 2c44 h THR 254 Ca 0.27 -0.58 0.07 0.00 0.77 0.00 0.00 66.41 66.93 2c44 h THR 254 Cb 0.18 1.28 -0.06 0.00 -1.74 0.00 0.00 68.15 67.81 2c44 h THR 254 CO -0.03 0.18 0.32 -0.09 0.37 0.00 0.00 175.52 176.27 2c44 h ARG 255 N 0.07 0.57 0.09 6.66 9.65 -1.10 -1.67 114.38 128.66 2c44 h ARG 255 Ca 0.05 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2c44 h ARG 255 Cb 0.23 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 2c44 h ARG 255 CO -0.00 0.38 -0.04 1.49 2.80 0.00 0.00 179.97 184.59 2c44 h GLU 256 N 0.59 -0.12 -0.67 0.20 4.57 -1.07 -3.13 114.58 114.95 2c44 h GLU 256 Ca 0.30 0.01 0.14 0.00 -1.18 0.00 0.00 59.36 58.63 2c44 h GLU 256 Cb 0.25 0.03 -0.11 0.00 -0.16 0.00 0.00 28.75 28.76 2c44 h GLU 256 CO -0.22 0.05 0.06 1.15 -1.18 0.00 0.00 179.01 178.87 2c44 h THR 257 N -0.27 0.49 0.00 0.32 2.02 -0.33 -1.83 112.91 113.30 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 0.22 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 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 -5.24 0.00 0.89 3.16 4.01 -0.67 -2.31 117.16 117.00 2c44 n TYR 258 Ca 0.11 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.98 2c44 n TYR 258 Cb 0.40 0.00 0.43 0.00 -0.31 0.00 0.00 39.34 39.86 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 -0.66 0.08 -1.76 -0.72 5.02 -0.69 -3.95 118.16 115.48 2c44 n LYS 259 Ca 0.05 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.07 2c44 n LYS 259 Cb 0.02 -1.57 0.05 0.00 -0.02 0.00 0.00 35.03 33.51 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 -1.70 3.08 -3.45 2.13 4.01 -0.98 -4.93 117.16 115.33 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 0.37 -0.96 -0.02 0.00 -0.31 0.00 0.00 39.34 38.42 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 -3.79 -1.59 -0.05 -0.72 0.00 -1.25 -4.67 121.76 109.68 2c44 s ALA 261 Ca 0.57 0.46 0.21 0.00 0.00 0.00 0.00 51.96 53.20 2c44 s ALA 261 Cb 0.46 0.86 -0.31 0.00 0.00 0.00 0.00 23.12 24.13 2c44 s ALA 261 CO -0.10 -0.78 0.40 -0.25 0.00 0.00 0.00 175.76 175.03 2c44 n ASP 262 N -0.38 0.20 -3.79 0.00 8.00 -0.11 -4.88 116.55 115.58 2c44 n ASP 262 Ca -0.16 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.27 2c44 n ASP 262 Cb 0.64 1.81 -0.02 0.00 -0.02 0.00 0.00 41.12 43.53 2c44 n ASP 262 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c44 s MET 263 N -3.31 1.70 0.02 -1.24 0.23 -1.07 -0.99 119.30 114.64 2c44 s MET 263 Ca -0.08 -0.91 0.03 0.00 -1.03 0.00 0.00 55.69 53.70 2c44 s MET 263 Cb 0.12 0.60 -0.02 0.00 -1.53 0.00 0.00 34.83 34.01 2c44 s MET 263 CO 0.86 -0.78 -0.09 -0.48 -2.03 0.00 0.00 175.02 172.51 2c44 s LEU 264 N -2.90 2.13 -0.11 0.18 0.05 0.94 -0.97 118.68 118.00 2c44 s LEU 264 Ca 0.10 -0.34 0.01 0.00 0.05 0.00 0.00 54.13 53.95 2c44 s LEU 264 Cb -0.05 -0.34 0.02 0.00 -2.05 0.00 0.00 46.19 43.76 2c44 s LEU 264 CO 0.04 -0.02 -0.14 0.00 -0.55 0.00 0.00 176.35 175.67 2c44 s ALA 265 N -0.72 1.63 0.00 1.48 0.00 -0.86 -0.86 121.76 122.44 2c44 s ALA 265 Ca -0.02 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.25 2c44 s ALA 265 Cb -0.06 -0.83 -0.00 0.00 0.00 0.00 0.00 23.12 22.22 2c44 s ALA 265 CO 0.00 -0.11 -0.03 1.41 0.00 0.00 0.00 175.76 177.03 2c44 s MET 266 N 1.06 0.24 -0.61 0.00 0.00 0.72 -1.57 119.30 119.12 2c44 s MET 266 Ca -0.05 -0.14 -0.17 0.00 0.00 0.00 0.00 55.69 55.33 2c44 s MET 266 Cb -0.15 -0.20 0.14 0.00 0.00 0.00 0.00 34.83 34.61 2c44 s MET 266 CO -0.02 0.05 0.63 0.45 0.00 0.00 0.00 175.02 176.13 2c44 s SER 267 N -0.17 6.29 0.09 1.11 0.15 -1.26 -0.49 113.70 119.41 2c44 s SER 267 Ca 0.00 -1.82 0.10 0.00 0.70 0.00 0.00 55.95 54.92 2c44 s SER 267 Cb -0.02 -2.25 0.46 0.00 -1.71 0.00 0.00 66.02 62.51 2c44 s SER 267 CO -0.00 -0.90 1.30 0.00 1.20 0.00 0.00 173.24 174.83 2c44 n ALA 268 N 5.44 1.20 0.55 5.45 0.00 0.06 -3.10 120.51 130.11 2c44 n ALA 268 Ca -0.07 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.45 2c44 n ALA 268 Cb 0.42 -1.15 0.22 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.73 0.27 0.00 0.00 5.02 -1.20 -3.40 118.16 117.13 2c44 n LYS 269 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2c44 n LYS 269 Cb 0.06 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 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 -0.92 0.00 0.03 1.97 4.01 -1.18 -0.11 118.16 121.95 2c44 n LYS 270 Ca 0.06 0.00 0.10 0.00 -0.51 0.00 0.00 58.31 57.96 2c44 n LYS 270 Cb 0.03 0.00 0.54 0.00 -0.51 0.00 0.00 35.03 35.08 2c44 n LYS 270 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2c44 h ASP 271 N 0.00 0.26 0.40 4.39 5.19 -1.65 0.18 116.42 125.20 2c44 h ASP 271 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2c44 h ASP 271 Cb 0.00 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2c44 h ASP 271 CO 0.00 0.17 0.00 0.00 -3.12 0.00 0.00 179.24 176.29 2c44 n ALA 272 N -2.53 1.67 -1.50 3.45 0.00 -1.22 -4.34 120.51 116.03 2c44 n ALA 272 Ca 0.05 -0.05 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 2c44 n ALA 272 Cb 0.25 -1.22 -0.07 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.44 -1.21 -3.86 0.00 2.81 0.64 -4.19 117.12 109.88 2c44 n MET 273 Ca 0.04 1.11 -0.31 0.00 -1.81 0.00 0.00 57.70 56.73 2c44 n MET 273 Cb 0.14 -5.35 -0.04 0.00 -0.71 0.00 0.00 33.22 27.26 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 -2.64 5.34 -0.75 2.03 -7.23 -1.22 -4.56 120.40 111.37 2c44 s VAL 274 Ca 0.00 -0.27 0.21 0.00 -1.81 0.00 0.00 61.98 60.11 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 0.14 1.64 -0.81 -0.31 0.00 0.00 175.10 175.76 2c44 n PRO 275 N 0.32 0.11 -3.63 4.82 -0.04 -1.26 -4.08 135.00 131.24 2c44 n PRO 275 Ca -0.05 0.30 -0.13 0.00 -0.04 0.00 0.00 63.50 63.58 2c44 n PRO 275 Cb 0.51 -1.69 -0.07 0.00 -0.04 0.00 0.00 33.50 32.21 2c44 n PRO 275 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2c44 s MET 276 N -3.15 0.79 0.00 0.54 -2.45 -1.26 -4.63 119.30 109.14 2c44 s MET 276 Ca 0.07 0.98 0.00 0.00 -1.25 0.00 0.00 55.69 55.49 2c44 s MET 276 Cb 0.10 0.36 0.00 0.00 1.25 0.00 0.00 34.83 36.54 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 2.84 4.45 3.55 2.11 0.00 0.43 -4.86 105.19 113.72 2c44 n GLY 277 Ca -0.15 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 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 0.43 -0.02 -0.02 0.00 0.22 -0.76 107.32 107.16 2c44 s GLY 278 Ca 0.00 -0.78 -0.07 0.00 0.00 0.00 0.00 44.72 43.88 2c44 s GLY 278 CO 0.00 -0.59 0.15 1.08 0.00 0.00 0.00 173.10 173.74 2c44 s LEU 279 N -2.99 1.49 -0.24 0.66 1.43 0.35 -2.05 118.68 117.33 2c44 s LEU 279 Ca 0.20 -0.00 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2c44 s LEU 279 Cb -0.00 0.63 0.08 0.00 0.03 0.00 0.00 46.19 46.92 2c44 s LEU 279 CO 0.06 -0.25 0.08 -0.22 0.23 0.00 0.00 176.35 176.25 2c44 s LEU 280 N -0.81 1.22 0.06 1.79 2.96 -0.33 -0.20 118.68 123.36 2c44 s LEU 280 Ca -0.09 -1.12 0.06 0.00 -0.22 0.00 0.00 54.13 52.75 2c44 s LEU 280 Cb -0.05 -0.57 -0.03 0.00 0.50 0.00 0.00 46.19 46.04 2c44 s LEU 280 CO 0.01 -0.37 -0.16 0.00 -1.32 0.00 0.00 176.35 174.51 2c44 s MET 282 N -1.45 2.80 0.09 0.00 -1.94 -0.19 -0.04 119.30 118.56 2c44 s MET 282 Ca 0.02 -0.60 -0.28 0.00 -1.71 0.00 0.00 55.69 53.11 2c44 s MET 282 Cb -0.09 -2.55 -0.15 0.00 2.01 0.00 0.00 34.83 34.05 2c44 s MET 282 CO 0.02 0.58 1.66 -0.22 -0.01 0.00 0.00 175.02 177.06 2c44 h LYS 283 N 5.52 -0.49 0.00 2.03 3.64 -1.37 -2.26 116.57 123.63 2c44 h LYS 283 Ca -0.45 0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 58.87 2c44 h LYS 283 Cb 1.17 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 2c44 h LYS 283 CO 0.53 -0.33 -0.02 -0.40 -2.27 0.00 0.00 179.45 176.96 2c44 n ASP 284 N -5.33 -0.76 -0.22 4.20 5.68 -1.26 -1.86 116.55 116.99 2c44 n ASP 284 Ca -0.10 -1.86 0.26 0.00 -0.50 0.00 0.00 54.79 52.60 2c44 n ASP 284 Cb 0.24 1.37 0.66 0.00 -1.14 0.00 0.00 41.12 42.25 2c44 n ASP 284 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2c44 h ASP 285 N 0.94 0.13 0.00 -1.12 -0.00 -2.00 -0.13 116.42 114.24 2c44 h ASP 285 Ca -0.14 0.02 0.00 0.00 -0.00 0.00 0.00 57.03 56.91 2c44 h ASP 285 Cb 0.57 -0.01 0.00 0.00 -0.00 0.00 0.00 39.33 39.89 2c44 h ASP 285 CO 0.18 0.04 0.01 0.77 -0.00 0.00 0.00 179.24 180.25 2c44 h SER 286 N 0.13 0.00 -0.15 4.15 4.64 -2.00 0.15 113.55 120.47 2c44 h SER 286 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2c44 h SER 286 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 2c44 h SER 286 CO -0.07 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.38 2c44 n PHE 287 N -2.74 0.43 -0.28 4.77 3.72 -0.06 -4.68 117.46 118.61 2c44 n PHE 287 Ca -0.02 -0.83 0.09 0.00 -0.05 0.00 0.00 57.45 56.64 2c44 n PHE 287 Cb 0.07 -0.19 0.33 0.00 -0.94 0.00 0.00 39.48 38.75 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 0.97 0.90 -0.47 1.38 3.57 -0.98 -1.58 116.94 120.72 2c44 h PHE 288 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2c44 h PHE 288 Cb 1.08 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 2c44 h PHE 288 CO 0.22 0.38 0.19 -0.44 -2.23 0.00 0.00 178.31 176.43 2c44 h ASP 289 N 0.80 0.65 0.28 0.41 3.32 -1.83 -0.77 116.42 119.29 2c44 h ASP 289 Ca 0.43 -0.17 -0.09 0.00 0.02 0.00 0.00 57.03 57.22 2c44 h ASP 289 Cb 0.55 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2c44 h ASP 289 CO -0.19 0.65 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.24 2c44 h VAL 290 N 0.62 1.28 0.27 -1.35 -1.51 -1.75 -1.19 116.25 112.63 2c44 h VAL 290 Ca 0.16 -1.35 -0.01 0.00 -1.23 0.00 0.00 66.70 64.26 2c44 h VAL 290 Cb 0.20 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 2c44 h VAL 290 CO -0.01 0.40 -0.13 0.22 -1.23 0.00 0.00 177.57 176.81 2c44 h TYR 291 N 0.11 -0.34 0.00 5.19 5.03 -0.63 0.25 116.97 126.57 2c44 h TYR 291 Ca 0.01 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.26 2c44 h TYR 291 Cb 0.70 0.11 -0.01 0.00 1.55 0.00 0.00 36.73 39.09 2c44 h TYR 291 CO 0.01 -0.19 -0.26 1.79 -1.32 0.00 0.00 178.16 178.18 2c44 h THR 292 N -0.40 0.80 -0.15 1.81 1.35 -0.98 -0.92 112.91 114.42 2c44 h THR 292 Ca -0.04 -1.07 -0.14 0.00 -0.55 0.00 0.00 66.41 64.60 2c44 h THR 292 Cb 0.31 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2c44 h THR 292 CO 0.06 0.26 -0.53 -0.33 -0.25 0.00 0.00 175.52 174.73 2c44 h GLU 293 N 0.00 0.41 0.00 4.72 4.39 -0.71 -2.40 114.58 120.99 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 0.64 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 2c44 h GLU 293 CO 0.03 0.84 -0.61 0.00 -1.16 0.00 0.00 179.01 178.11 2c44 h ARG 295 N 0.00 0.63 -0.34 0.00 3.08 -0.90 0.79 114.38 117.64 2c44 h ARG 295 Ca -0.01 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 59.70 2c44 h ARG 295 Cb 1.15 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2c44 h ARG 295 CO 0.08 0.85 -0.09 1.15 -1.07 0.00 0.00 179.97 180.89 2c44 h THR 296 N 0.54 1.28 0.00 2.04 2.02 -1.20 -2.75 112.91 114.84 2c44 h THR 296 Ca 0.07 -1.15 -0.11 0.00 0.77 0.00 0.00 66.41 65.99 2c44 h THR 296 Cb 0.78 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 2c44 h THR 296 CO 0.06 0.37 -0.52 0.25 0.37 0.00 0.00 175.52 176.06 2c44 h LEU 297 N 0.44 0.00 -0.63 2.58 5.85 -1.33 -3.17 115.31 119.05 2c44 h LEU 297 Ca 0.08 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 2c44 h LEU 297 Cb 0.59 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2c44 h LEU 297 CO 0.03 0.52 -0.03 0.00 -0.34 0.00 0.00 178.44 178.62 2c44 h VAL 299 N 0.95 0.93 0.08 0.00 2.07 -1.46 0.25 116.25 119.07 2c44 h VAL 299 Ca 0.16 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 2c44 h VAL 299 Cb 0.59 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2c44 h VAL 299 CO 0.04 0.10 -0.51 0.58 0.02 0.00 0.00 177.57 177.79 2c44 h VAL 300 N 0.55 1.61 0.06 2.57 2.07 -1.52 -3.36 116.25 118.23 2c44 h VAL 300 Ca 0.31 -2.43 -0.30 0.00 0.82 0.00 0.00 66.70 65.10 2c44 h VAL 300 Cb 0.48 3.23 -0.03 0.00 -1.52 0.00 0.00 31.29 33.45 2c44 h VAL 300 CO -0.10 0.67 -1.59 1.56 0.02 0.00 0.00 177.57 178.13 2c44 h GLN 301 N -0.58 0.12 0.00 1.57 1.08 -1.01 -3.45 115.11 112.85 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 1.39 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.90 2c44 h GLN 301 CO 0.10 0.88 -0.97 0.39 -0.95 0.00 0.00 178.83 178.27 2c44 n GLU 302 N -3.29 0.00 -2.20 1.46 -0.58 0.74 -5.08 120.64 111.70 2c44 n GLU 302 Ca -0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 2c44 n GLU 302 Cb 1.03 -0.74 0.00 0.00 -0.57 0.00 0.00 31.44 31.16 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 3.20 -0.93 3.65 0.62 0.00 -0.31 -3.42 105.19 108.00 2c44 n GLY 303 Ca 0.00 -1.59 -0.44 0.00 0.00 0.00 0.00 46.02 43.99 2c44 n GLY 303 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2c44 n PHE 304 N 1.36 1.93 0.04 1.61 7.35 -1.26 -3.22 117.46 125.28 2c44 n PHE 304 Ca 0.00 0.55 0.00 0.00 -0.76 0.00 0.00 57.45 57.24 2c44 n PHE 304 Cb 0.00 -2.39 0.01 0.00 0.35 0.00 0.00 39.48 37.46 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 1.27 0.02 -0.14 -7.13 -0.04 -1.26 -0.03 135.00 127.69 2c44 n PRO 305 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2c44 n PRO 305 Cb 0.32 -1.34 0.17 0.00 -0.04 0.00 0.00 33.50 32.62 2c44 n PRO 305 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c44 n THR 306 N -0.84 0.42 0.00 0.52 -2.24 -1.26 -4.25 114.28 106.62 2c44 n THR 306 Ca 0.00 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 2c44 n THR 306 Cb 0.00 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 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 1.27 0.00 -3.81 4.78 4.11 -0.82 -4.53 117.16 118.16 2c44 n TYR 307 Ca 0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.80 2c44 n TYR 307 Cb 0.55 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.82 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 0.07 -0.16 0.84 -7.48 0.00 0.96 -0.27 105.19 99.15 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 -1.73 0.78 3.36 -0.02 0.00 -1.22 -1.65 105.19 104.71 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 2.37 0.65 0.99 1.43 0.63 -4.47 118.68 120.28 2c44 s LEU 310 Ca 0.00 -0.37 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 2c44 s LEU 310 Cb 0.00 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.75 2c44 s LEU 310 CO 0.00 0.29 1.05 -1.83 0.23 0.00 0.00 176.35 176.09 2c44 s GLU 311 N -0.39 3.12 0.20 1.70 -1.05 -1.26 -4.79 118.70 116.24 2c44 s GLU 311 Ca 0.04 1.02 -0.18 0.00 -0.15 0.00 0.00 54.97 55.69 2c44 s GLU 311 Cb -0.12 -2.01 0.19 0.00 -0.44 0.00 0.00 34.13 31.74 2c44 s GLU 311 CO 0.02 -0.96 1.59 0.78 0.95 0.00 0.00 175.26 177.64 2c44 h GLY 312 N -0.30 0.11 1.17 -3.83 0.00 -1.90 0.41 103.07 98.72 2c44 h GLY 312 Ca -0.45 0.37 0.06 0.00 0.00 0.00 0.00 47.33 47.32 2c44 h GLY 312 CO 0.57 -0.23 0.41 -1.33 0.00 0.00 0.00 176.54 175.96 2c44 h GLY 313 N -0.10 0.76 1.77 4.60 0.00 -1.83 -1.09 103.07 107.18 2c44 h GLY 313 Ca 0.28 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2c44 h GLY 313 CO -0.72 0.19 -0.14 0.00 0.00 0.00 0.00 176.54 175.87 2c44 h ALA 314 N 1.66 1.43 0.02 3.60 0.00 -1.23 0.94 119.26 125.69 2c44 h ALA 314 Ca 0.27 -0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.70 2c44 h ALA 314 Cb 0.26 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.97 2c44 h ALA 314 CO -0.08 0.40 -1.03 0.52 0.00 0.00 0.00 179.25 179.06 2c44 h MET 315 N 0.27 0.51 -0.54 0.00 2.86 -0.79 -1.72 114.93 115.52 2c44 h MET 315 Ca 0.05 -0.58 -0.05 0.00 -2.06 0.00 0.00 59.70 57.06 2c44 h MET 315 Cb 0.42 0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.23 2c44 h MET 315 CO 0.03 1.21 0.13 0.93 1.06 0.00 0.00 176.91 180.26 2c44 h GLU 316 N 0.27 0.87 -0.70 1.72 4.39 -1.00 -0.68 114.58 119.46 2c44 h GLU 316 Ca -0.11 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.36 2c44 h GLU 316 Cb 1.68 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 30.18 2c44 h GLU 316 CO 0.19 0.82 0.36 -0.09 -1.16 0.00 0.00 179.01 179.13 2c44 h ARG 317 N 0.76 1.00 -0.35 2.33 2.43 -0.79 -2.60 114.38 117.17 2c44 h ARG 317 Ca 0.17 -0.13 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 2c44 h ARG 317 Cb 0.35 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2c44 h ARG 317 CO 0.00 0.77 -0.30 1.25 -1.51 0.00 0.00 179.97 180.18 2c44 h LEU 318 N 0.97 0.77 -1.95 3.80 5.85 -1.06 0.58 115.31 124.27 2c44 h LEU 318 Ca 0.24 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 58.75 2c44 h LEU 318 Cb 0.09 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 2c44 h LEU 318 CO -0.03 1.02 0.26 0.00 -0.34 0.00 0.00 178.44 179.35 2c44 h ALA 319 N 1.03 2.26 0.15 1.25 0.00 -0.75 -1.56 119.26 121.63 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 0.83 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2c44 h ALA 319 CO 0.07 -0.36 -1.75 0.28 0.00 0.00 0.00 179.25 177.49 2c44 h VAL 320 N 0.06 0.85 -1.00 0.00 2.07 -1.13 -3.38 116.25 113.72 2c44 h VAL 320 Ca 0.17 -2.42 0.06 0.00 0.82 0.00 0.00 66.70 65.33 2c44 h VAL 320 Cb 0.60 2.65 -0.07 0.00 -1.52 0.00 0.00 31.29 32.96 2c44 h VAL 320 CO -0.01 0.82 0.65 1.23 0.02 0.00 0.00 177.57 180.28 2c44 h GLY 321 N 0.62 1.51 1.03 2.17 0.00 -0.25 -1.00 103.07 107.15 2c44 h GLY 321 Ca -0.36 -0.48 0.13 0.00 0.00 0.00 0.00 47.33 46.62 2c44 h GLY 321 CO 0.11 0.35 0.36 1.41 0.00 0.00 0.00 176.54 178.77 2c44 h LEU 322 N 1.19 0.06 0.00 3.11 3.38 -1.47 0.68 115.31 122.26 2c44 h LEU 322 Ca 0.43 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.33 2c44 h LEU 322 Cb 0.14 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2c44 h LEU 322 CO -0.16 0.04 -0.53 1.88 0.09 0.00 0.00 178.44 179.75 2c44 h TYR 323 N 0.07 0.00 -0.77 1.13 0.05 -1.42 -3.36 116.97 112.66 2c44 h TYR 323 Ca 0.24 0.00 0.16 0.00 0.05 0.00 0.00 58.73 59.18 2c44 h TYR 323 Cb 0.87 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.55 2c44 h TYR 323 CO -0.00 0.65 0.52 -0.44 -1.05 0.00 0.00 178.16 177.83 2c44 h ASP 324 N -1.00 0.38 0.69 3.88 5.19 -1.04 0.82 116.42 125.35 2c44 h ASP 324 Ca -0.11 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2c44 h ASP 324 Cb 0.74 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.20 2c44 h ASP 324 CO -0.06 0.19 0.00 1.23 -3.12 0.00 0.00 179.24 177.48 2c44 h GLY 325 N 0.40 0.00 -0.72 2.75 0.00 -1.03 -2.81 103.07 101.66 2c44 h GLY 325 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2c44 h GLY 325 CO -0.12 0.00 -0.12 1.03 0.00 0.00 0.00 176.54 177.33 2c44 n MET 326 N -2.33 1.57 -1.68 4.80 2.81 0.28 -4.79 117.12 117.78 2c44 n MET 326 Ca 0.02 -1.09 -0.45 0.00 -1.81 0.00 0.00 57.70 54.37 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 0.24 3.46 -0.15 7.83 2.85 -1.06 -4.78 115.26 123.65 2c44 n ASN 327 Ca 0.15 1.05 -0.08 0.00 -0.11 0.00 0.00 54.58 55.58 2c44 n ASN 327 Cb 0.43 -1.46 0.00 0.00 1.24 0.00 0.00 39.78 39.98 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 6.99 0.55 -0.87 1.20 5.85 -1.92 -1.07 115.31 126.04 2c44 h LEU 328 Ca -0.45 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.15 2c44 h LEU 328 Cb 1.24 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2c44 h LEU 328 CO 0.92 0.50 0.50 0.44 -0.34 0.00 0.00 178.44 180.46 2c44 h ASP 329 N 0.56 1.07 0.66 1.25 3.45 -1.99 -1.18 116.42 120.23 2c44 h ASP 329 Ca 0.15 -0.09 -0.03 0.00 0.43 0.00 0.00 57.03 57.49 2c44 h ASP 329 Cb 0.08 -0.27 0.01 0.00 -0.56 0.00 0.00 39.33 38.59 2c44 h ASP 329 CO -0.02 0.85 -0.31 -0.25 -1.57 0.00 0.00 179.24 177.93 2c44 h TRP 330 N 1.21 -0.82 -0.68 4.55 -0.00 -1.87 -1.69 115.95 116.65 2c44 h TRP 330 Ca 0.31 -0.02 0.09 0.00 -0.00 0.00 0.00 58.89 59.27 2c44 h TRP 330 Cb -0.00 0.27 -0.07 0.00 -0.00 0.00 0.00 29.16 29.36 2c44 h TRP 330 CO 0.00 -0.50 0.33 -0.07 -0.00 0.00 0.00 178.44 178.21 2c44 h LEU 331 N -0.91 0.43 -0.69 0.65 3.38 -1.02 0.76 115.31 117.92 2c44 h LEU 331 Ca -0.09 0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2c44 h LEU 331 Cb 0.68 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 2c44 h LEU 331 CO 0.15 0.26 0.45 0.00 0.09 0.00 0.00 178.44 179.38 2c44 h ALA 332 N 1.41 0.89 0.48 1.53 0.00 -1.15 -1.47 119.26 120.95 2c44 h ALA 332 Ca 0.33 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2c44 h ALA 332 Cb 0.33 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2c44 h ALA 332 CO -0.26 0.27 -0.23 -0.92 0.00 0.00 0.00 179.25 178.11 2c44 h TYR 333 N 0.91 -0.60 -0.19 0.00 3.20 -0.23 -1.15 116.97 118.91 2c44 h TYR 333 Ca 0.26 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.17 2c44 h TYR 333 Cb -0.06 0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.34 2c44 h TYR 333 CO -0.03 -0.29 -0.30 -0.09 -1.64 0.00 0.00 178.16 175.80 2c44 h ARG 334 N -0.85 -0.33 -0.01 1.82 1.12 -0.80 -0.80 114.38 114.53 2c44 h ARG 334 Ca -0.07 0.02 -0.06 0.00 -1.11 0.00 0.00 59.98 58.77 2c44 h ARG 334 Cb 0.58 0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.61 2c44 h ARG 334 CO 0.11 -0.22 -0.26 0.82 -3.11 0.00 0.00 179.97 177.31 2c44 h ILE 335 N -0.34 1.19 -0.14 1.20 2.04 -1.33 -2.37 117.51 117.77 2c44 h ILE 335 Ca 0.11 -0.91 -0.12 0.00 1.00 0.00 0.00 64.86 64.94 2c44 h ILE 335 Cb 0.52 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 2c44 h ILE 335 CO -0.39 0.26 -0.45 0.00 0.00 0.00 0.00 178.15 177.58 2c44 h ALA 336 N 1.72 0.98 -0.45 1.87 0.00 -0.18 -1.75 119.26 121.45 2c44 h ALA 336 Ca 0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 2c44 h ALA 336 Cb 0.47 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2c44 h ALA 336 CO 0.03 0.63 0.08 0.37 0.00 0.00 0.00 179.25 180.37 2c44 h GLN 337 N 0.27 0.74 -0.48 0.00 4.15 -0.66 -0.42 115.11 118.73 2c44 h GLN 337 Ca 0.02 -0.20 -0.02 0.00 0.77 0.00 0.00 58.65 59.22 2c44 h GLN 337 Cb 0.90 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 2c44 h GLN 337 CO 0.07 0.76 0.22 0.28 -1.93 0.00 0.00 178.83 178.23 2c44 h VAL 338 N 0.61 1.19 -0.71 2.39 2.07 -1.33 -1.83 116.25 118.64 2c44 h VAL 338 Ca 0.14 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.16 2c44 h VAL 338 Cb 0.37 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 30.77 2c44 h VAL 338 CO 0.01 0.22 0.39 -0.61 0.02 0.00 0.00 177.57 177.60 2c44 h GLN 339 N 0.62 0.69 -0.40 1.57 5.75 -1.01 -0.45 115.11 121.88 2c44 h GLN 339 Ca 0.16 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.66 2c44 h GLN 339 Cb 0.14 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 2c44 h GLN 339 CO -0.02 0.45 0.18 -0.92 -2.65 0.00 0.00 178.83 175.88 2c44 h TYR 340 N 0.71 0.33 -0.47 3.99 3.20 -0.52 0.13 116.97 124.35 2c44 h TYR 340 Ca 0.33 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.17 2c44 h TYR 340 Cb 0.24 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 2c44 h TYR 340 CO -0.08 0.17 0.11 1.25 -1.64 0.00 0.00 178.16 177.97 2c44 h LEU 341 N 0.38 0.70 -0.46 2.82 5.85 -0.68 -0.33 115.31 123.59 2c44 h LEU 341 Ca 0.17 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2c44 h LEU 341 Cb 0.10 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2c44 h LEU 341 CO -0.14 0.75 0.18 0.58 -0.34 0.00 0.00 178.44 179.47 2c44 h VAL 342 N 0.62 1.21 -0.38 1.05 2.07 -0.69 -1.07 116.25 119.06 2c44 h VAL 342 Ca 0.15 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.92 2c44 h VAL 342 Cb 0.32 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2c44 h VAL 342 CO 0.00 0.24 -0.15 0.44 0.02 0.00 0.00 177.57 178.13 2c44 h ASP 343 N 0.60 0.68 -0.48 0.57 3.32 -0.63 -0.82 116.42 119.65 2c44 h ASP 343 Ca 0.15 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 2c44 h ASP 343 Cb 0.21 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2c44 h ASP 343 CO -0.01 0.84 0.19 1.23 -1.72 0.00 0.00 179.24 179.77 2c44 h GLY 344 N 0.98 0.78 0.91 2.75 0.00 -0.72 -0.98 103.07 106.78 2c44 h GLY 344 Ca 0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 2c44 h GLY 344 CO 0.04 0.40 -0.00 1.41 0.00 0.00 0.00 176.54 178.39 2c44 h LEU 345 N 0.64 0.58 -1.56 3.11 3.38 -1.01 -2.86 115.31 117.59 2c44 h LEU 345 Ca 0.16 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2c44 h LEU 345 Cb 0.20 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2c44 h LEU 345 CO -0.01 0.75 0.23 -0.08 0.09 0.00 0.00 178.44 179.41 2c44 h GLU 346 N 0.40 0.52 0.00 1.13 4.57 -0.97 -1.24 114.58 118.99 2c44 h GLU 346 Ca 0.10 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.19 2c44 h GLU 346 Cb 0.45 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2c44 h GLU 346 CO 0.02 0.37 -0.22 1.05 -1.18 0.00 0.00 179.01 179.05 2c44 h GLU 347 N 0.53 0.00 -0.52 1.92 4.11 -0.96 -2.49 114.58 117.18 2c44 h GLU 347 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.57 2c44 h GLU 347 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2c44 h GLU 347 CO -0.03 0.22 0.00 0.44 0.07 0.00 0.00 179.01 179.72 2c44 n ILE 348 N -3.35 0.78 -0.50 -1.06 -5.35 -0.77 -4.91 119.36 104.21 2c44 n ILE 348 Ca 0.00 -0.69 0.00 0.00 -0.27 0.00 0.00 62.75 61.80 2c44 n ILE 348 Cb 0.45 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 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 1.19 0.71 3.30 3.28 0.00 -0.94 -5.02 105.19 107.71 2c44 n GLY 349 Ca 0.17 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 4.69 0.20 1.61 1.01 -0.54 -5.00 120.40 120.36 2c44 s VAL 350 Ca 0.00 -1.42 -0.31 0.00 0.00 0.00 0.00 61.98 60.25 2c44 s VAL 350 Cb 0.00 -3.92 -0.10 0.00 0.00 0.00 0.00 36.38 32.36 2c44 s VAL 350 CO 0.00 -0.66 1.46 -0.69 0.00 0.00 0.00 175.10 175.21 2c44 s VAL 351 N 1.50 2.80 0.25 2.92 1.01 -1.26 -3.28 120.40 124.34 2c44 s VAL 351 Ca 0.04 0.62 0.04 0.00 0.00 0.00 0.00 61.98 62.68 2c44 s VAL 351 Cb -0.25 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2c44 s VAL 351 CO 0.03 0.08 0.01 0.00 0.00 0.00 0.00 175.10 175.21 2c44 s GLN 353 N -3.87 3.01 0.44 0.00 2.00 -0.39 -4.80 119.66 116.05 2c44 s GLN 353 Ca 0.30 1.52 -0.25 0.00 -2.00 0.00 0.00 55.36 54.93 2c44 s GLN 353 Cb 0.06 -1.97 -0.09 0.00 0.80 0.00 0.00 33.01 31.82 2c44 s GLN 353 CO 0.10 -1.10 1.41 0.00 -0.50 0.00 0.00 175.29 175.20 2c44 n GLN 354 N -1.92 2.23 -1.67 1.67 10.64 -1.26 -4.66 117.38 122.40 2c44 n GLN 354 Ca 0.11 0.79 -0.61 0.00 -1.83 0.00 0.00 57.00 55.47 2c44 n GLN 354 Cb 0.51 -2.59 -0.08 0.00 -0.86 0.00 0.00 30.24 27.22 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 -0.17 -1.29 -2.12 2.61 0.00 -1.26 -4.96 120.51 113.32 2c44 n ALA 355 Ca 0.05 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2c44 n ALA 355 Cb 0.41 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 3.44 2.43 0.13 0.00 0.00 -1.26 -5.00 105.19 104.94 2c44 n GLY 356 Ca 0.26 -1.95 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 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 0.28 -0.24 -0.02 0.00 -1.65 -3.43 103.07 98.02 2c44 h GLY 357 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2c44 h GLY 357 CO 0.00 0.63 -0.08 -2.39 0.00 0.00 0.00 176.54 174.70 2c44 n HIS 358 N -3.44 0.00 -3.54 5.60 1.44 -1.26 -4.54 115.22 109.47 2c44 n HIS 358 Ca -0.29 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.35 2c44 n HIS 358 Cb 1.05 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 31.14 2c44 n HIS 358 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2c44 s ALA 359 N -0.81 -1.87 -0.20 1.59 0.00 -1.26 -1.51 121.76 117.70 2c44 s ALA 359 Ca 0.04 1.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.91 2c44 s ALA 359 Cb 0.04 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 2c44 s ALA 359 CO 0.11 -0.71 0.33 0.00 0.00 0.00 0.00 175.76 175.49 2c44 s ALA 360 N -2.98 3.57 -0.40 0.00 0.00 -1.05 -4.19 121.76 116.71 2c44 s ALA 360 Ca 0.07 -0.57 -0.09 0.00 0.00 0.00 0.00 51.96 51.36 2c44 s ALA 360 Cb -0.01 -2.51 0.06 0.00 0.00 0.00 0.00 23.12 20.67 2c44 s ALA 360 CO -0.07 -0.17 0.24 -0.06 0.00 0.00 0.00 175.76 175.70 2c44 s PHE 361 N 1.02 3.31 0.13 0.00 0.40 -1.26 -0.51 117.98 121.07 2c44 s PHE 361 Ca 0.16 -1.40 -0.30 0.00 -0.60 0.00 0.00 56.93 54.79 2c44 s PHE 361 Cb -0.14 -2.79 -0.06 0.00 0.51 0.00 0.00 43.02 40.53 2c44 s PHE 361 CO 0.06 -0.80 0.99 0.08 0.70 0.00 0.00 175.22 176.25 2c44 s VAL 362 N 1.45 4.35 -1.03 -0.44 1.01 0.45 -1.27 120.40 124.92 2c44 s VAL 362 Ca 0.02 1.98 -0.19 0.00 0.00 0.00 0.00 61.98 63.79 2c44 s VAL 362 Cb -0.22 -4.26 0.11 0.00 0.00 0.00 0.00 36.38 32.01 2c44 s VAL 362 CO 0.03 0.32 1.32 -0.62 0.00 0.00 0.00 175.10 176.15 2c44 s ASP 363 N -0.06 6.67 0.36 3.32 3.68 -0.51 -0.11 116.67 130.02 2c44 s ASP 363 Ca 0.47 -2.02 0.07 0.00 2.13 0.00 0.00 52.55 53.20 2c44 s ASP 363 Cb -0.25 -2.47 0.78 0.00 -1.45 0.00 0.00 42.92 39.53 2c44 s ASP 363 CO 0.31 -1.17 1.94 0.00 0.13 0.00 0.00 175.17 176.38 2c44 h ALA 364 N 8.80 1.76 -0.24 3.66 0.00 -1.32 -1.17 119.26 130.75 2c44 h ALA 364 Ca 0.22 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.16 2c44 h ALA 364 Cb 0.99 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2c44 h ALA 364 CO 1.25 0.10 -0.06 0.78 0.00 0.00 0.00 179.25 181.32 2c44 h GLY 365 N 0.72 0.17 1.82 0.00 0.00 -1.79 0.53 103.07 104.52 2c44 h GLY 365 Ca 0.34 0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.61 2c44 h GLY 365 CO -0.12 -0.09 -0.59 0.50 0.00 0.00 0.00 176.54 176.24 2c44 h LYS 366 N 0.00 0.19 0.02 4.80 1.57 -1.69 -2.89 116.57 118.56 2c44 h LYS 366 Ca 0.11 -0.13 -0.20 0.00 -1.87 0.00 0.00 60.65 58.56 2c44 h LYS 366 Cb 0.17 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2c44 h LYS 366 CO -0.24 0.72 -0.93 1.25 -0.57 0.00 0.00 179.45 179.68 2c44 h LEU 367 N 0.14 0.20 -6.01 2.94 5.85 -0.68 -3.37 115.31 114.37 2c44 h LEU 367 Ca -0.00 -0.18 -0.58 0.00 0.84 0.00 0.00 57.88 57.96 2c44 h LEU 367 Cb 1.08 -0.06 -0.41 0.00 0.37 0.00 0.00 40.66 41.63 2c44 h LEU 367 CO 0.09 1.02 -0.77 0.18 -0.34 0.00 0.00 178.44 178.62 2c44 n LEU 368 N -3.59 2.73 0.31 2.25 4.77 0.18 -4.79 117.00 118.88 2c44 n LEU 368 Ca -0.03 -5.25 0.21 0.00 -0.03 0.00 0.00 56.01 50.91 2c44 n LEU 368 Cb 0.85 -0.22 1.09 0.00 -2.33 0.00 0.00 43.42 42.80 2c44 n LEU 368 CO 0.48 2.11 1.13 1.55 -1.33 0.00 0.00 177.39 181.33 2c44 h PRO 369 N 3.90 0.00 0.00 3.23 0.13 -1.68 -2.93 132.00 134.65 2c44 h PRO 369 Ca 0.15 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.27 2c44 h PRO 369 Cb 0.72 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 2c44 h PRO 369 CO 0.72 0.00 -0.05 1.12 -0.23 0.00 0.00 178.00 179.55 2c44 h HIS 370 N 0.00 0.00 -3.80 1.56 2.07 -1.92 -3.44 115.15 109.62 2c44 h HIS 370 Ca 0.00 0.00 -0.64 0.00 -2.85 0.00 0.00 60.37 56.88 2c44 h HIS 370 Cb 0.08 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 29.90 2c44 h HIS 370 CO 0.00 0.05 -0.37 0.42 -3.07 0.00 0.00 177.93 174.97 2c44 s ILE 371 N -3.27 5.24 0.45 6.12 1.09 -1.11 -5.05 121.20 124.66 2c44 s ILE 371 Ca 0.06 0.35 -0.25 0.00 -1.10 0.00 0.00 60.65 59.71 2c44 s ILE 371 Cb 0.06 -3.63 -0.08 0.00 -1.06 0.00 0.00 42.46 37.75 2c44 s ILE 371 CO 0.66 0.18 1.34 -2.16 -0.10 0.00 0.00 174.94 174.86 2c44 s PRO 372 N 1.92 3.71 0.32 2.79 0.04 -1.26 -4.65 135.00 137.87 2c44 s PRO 372 Ca 0.11 2.23 0.10 0.00 0.04 0.00 0.00 61.00 63.48 2c44 s PRO 372 Cb -0.16 -2.61 0.94 0.00 0.04 0.00 0.00 34.50 32.71 2c44 s PRO 372 CO 0.10 -0.73 1.67 0.00 0.04 0.00 0.00 177.00 178.09 2c44 h ALA 373 N 2.29 1.72 -0.11 8.56 0.00 -1.97 0.81 119.26 130.56 2c44 h ALA 373 Ca -0.50 0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 373 Cb 1.26 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2c44 h ALA 373 CO 0.61 -0.49 0.29 0.38 0.00 0.00 0.00 179.25 180.04 2c44 h ASP 374 N 0.33 0.00 -0.67 0.00 2.03 -1.98 0.94 116.42 117.07 2c44 h ASP 374 Ca 0.66 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.96 2c44 h ASP 374 Cb 1.43 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.93 2c44 h ASP 374 CO -0.60 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.61 2c44 n GLN 375 N -3.22 3.30 -3.53 4.15 6.02 0.28 -4.95 117.38 119.44 2c44 n GLN 375 Ca 0.00 -2.77 -0.17 0.00 -0.01 0.00 0.00 57.00 54.05 2c44 n GLN 375 Cb 0.38 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 29.90 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 1.30 -2.36 -0.08 1.08 3.01 0.32 -1.41 117.46 119.33 2c44 n PHE 376 Ca 0.25 0.89 0.06 0.00 1.01 0.00 0.00 57.45 59.67 2c44 n PHE 376 Cb 0.77 -3.31 0.42 0.00 -0.01 0.00 0.00 39.48 37.34 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 -0.21 0.57 -0.06 -1.08 0.13 -1.79 -1.93 132.00 127.63 2c44 h PRO 377 Ca -0.41 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.60 2c44 h PRO 377 Cb 1.25 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 2c44 h PRO 377 CO 0.36 0.38 -0.36 0.00 -0.23 0.00 0.00 178.00 178.14 2c44 h ALA 378 N 1.69 1.29 -0.08 -0.56 0.00 -1.88 -0.59 119.26 119.13 2c44 h ALA 378 Ca 0.23 -0.36 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 2c44 h ALA 378 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2c44 h ALA 378 CO -0.06 0.51 -0.76 1.96 0.00 0.00 0.00 179.25 180.90 2c44 h GLN 379 N 0.10 0.47 -0.43 0.00 1.08 -1.72 -1.82 115.11 112.79 2c44 h GLN 379 Ca 0.01 -0.39 -0.06 0.00 -1.45 0.00 0.00 58.65 56.76 2c44 h GLN 379 Cb 0.69 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.19 2c44 h GLN 379 CO 0.05 1.03 0.05 0.00 -0.95 0.00 0.00 178.83 179.01 2c44 h ALA 380 N 0.86 0.57 -0.94 3.87 0.00 -1.06 -2.10 119.26 120.46 2c44 h ALA 380 Ca -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2c44 h ALA 380 Cb 1.35 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2c44 h ALA 380 CO 0.13 0.31 0.59 1.25 0.00 0.00 0.00 179.25 181.54 2c44 h LEU 381 N 0.58 1.11 -0.24 0.00 5.85 -1.04 -1.07 115.31 120.49 2c44 h LEU 381 Ca 0.13 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.80 2c44 h LEU 381 Cb 0.41 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2c44 h LEU 381 CO 0.01 0.83 0.15 0.00 -0.34 0.00 0.00 178.44 179.10 2c44 h ALA 382 N 1.32 0.31 -0.45 1.25 0.00 -0.94 0.77 119.26 121.52 2c44 h ALA 382 Ca 0.34 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 2c44 h ALA 382 Cb -0.09 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2c44 h ALA 382 CO -0.07 -0.23 0.09 0.00 0.00 0.00 0.00 179.25 179.04 2c44 h GLU 384 N 0.66 -0.02 -0.60 0.00 4.57 -0.48 -1.28 114.58 117.43 2c44 h GLU 384 Ca 0.15 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 2c44 h GLU 384 Cb 0.27 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.82 2c44 h GLU 384 CO -0.00 0.19 0.31 1.25 -1.18 0.00 0.00 179.01 179.59 2c44 h LEU 385 N -0.24 0.44 -0.01 1.64 5.85 -0.53 -0.78 115.31 121.68 2c44 h LEU 385 Ca -0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2c44 h LEU 385 Cb 0.23 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2c44 h LEU 385 CO 0.00 0.29 0.01 0.22 -0.34 0.00 0.00 178.44 178.62 2c44 h TYR 386 N 0.58 0.02 -0.19 1.25 3.20 -1.12 -2.12 116.97 118.59 2c44 h TYR 386 Ca 0.27 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.19 2c44 h TYR 386 Cb 0.20 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.39 2c44 h TYR 386 CO -0.10 0.03 -0.43 0.87 -1.64 0.00 0.00 178.16 176.90 2c44 h LYS 387 N -0.00 -0.44 -0.28 1.82 6.56 -0.70 0.18 116.57 123.70 2c44 h LYS 387 Ca 0.01 0.03 0.07 0.00 -1.06 0.00 0.00 60.65 59.69 2c44 h LYS 387 Cb 0.02 0.10 -0.07 0.00 -0.57 0.00 0.00 32.23 31.71 2c44 h LYS 387 CO -0.00 -0.30 -0.20 0.28 -2.06 0.00 0.00 179.45 177.17 2c44 h VAL 388 N -0.46 0.45 0.00 0.50 2.07 -0.91 -3.38 116.25 114.51 2c44 h VAL 388 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 2c44 h VAL 388 Cb 0.62 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2c44 h VAL 388 CO -0.44 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.15 2c44 n ALA 389 N -2.78 1.01 -1.45 1.67 0.00 -0.82 -5.00 120.51 113.14 2c44 n ALA 389 Ca -0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 53.44 52.98 2c44 n ALA 389 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.72 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 0.42 3.76 0.00 0.00 0.60 -4.81 105.19 105.08 2c44 n GLY 390 Ca 0.00 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.07 5.38 -0.15 -0.61 1.01 -1.26 -1.35 121.20 122.16 2c44 s ILE 391 Ca 0.00 0.18 -0.04 0.00 0.00 0.00 0.00 60.65 60.79 2c44 s ILE 391 Cb 0.00 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 2c44 s ILE 391 CO 0.00 0.48 -0.03 -0.60 0.00 0.00 0.00 174.94 174.79 2c44 s ARG 392 N 0.06 3.63 0.28 2.79 3.52 -0.79 -2.97 118.95 125.47 2c44 s ARG 392 Ca 0.09 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 55.21 2c44 s ARG 392 Cb -0.11 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.33 2c44 s ARG 392 CO -0.01 0.28 0.16 0.00 -0.81 0.00 0.00 175.30 174.92 2c44 s ALA 393 N 0.27 1.77 0.19 6.12 0.00 -1.26 0.26 121.76 129.11 2c44 s ALA 393 Ca -0.03 -1.79 0.11 0.00 0.00 0.00 0.00 51.96 50.25 2c44 s ALA 393 Cb -0.14 1.22 -0.04 0.00 0.00 0.00 0.00 23.12 24.15 2c44 s ALA 393 CO 0.03 -0.53 -0.23 0.14 0.00 0.00 0.00 175.76 175.16 2c44 s VAL 394 N -3.71 2.29 -0.02 0.00 -7.23 -1.13 -4.81 120.40 105.79 2c44 s VAL 394 Ca 0.37 -2.03 -0.09 0.00 -1.81 0.00 0.00 61.98 58.42 2c44 s VAL 394 Cb 0.05 -2.09 -0.05 0.00 0.56 0.00 0.00 36.38 34.85 2c44 s VAL 394 CO 0.17 -0.15 0.27 -1.83 -0.31 0.00 0.00 175.10 173.26 2c44 s GLU 395 N -2.71 3.63 -0.55 4.82 4.04 -1.26 0.26 118.70 126.94 2c44 s GLU 395 Ca 0.20 0.03 0.07 0.00 0.04 0.00 0.00 54.97 55.31 2c44 s GLU 395 Cb -0.08 -3.13 0.28 0.00 0.02 0.00 0.00 34.13 31.23 2c44 s GLU 395 CO 0.10 0.68 0.76 -0.89 -1.84 0.00 0.00 175.26 174.07 2c44 n ILE 396 N 1.47 1.72 0.00 1.83 -0.00 0.14 -4.68 119.36 119.84 2c44 n ILE 396 Ca -0.14 -5.03 0.00 0.00 -0.00 0.00 0.00 62.75 57.58 2c44 n ILE 396 Cb 0.53 -1.69 0.00 0.00 -0.00 0.00 0.00 39.64 38.48 2c44 n ILE 396 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2c44 n GLY 397 N 0.60 5.40 0.24 7.39 0.00 -1.26 -2.92 105.19 114.65 2c44 n GLY 397 Ca 0.28 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.44 2c44 n GLY 397 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2c44 h SER 398 N 0.00 0.59 -0.32 1.61 0.02 -1.85 -1.88 113.55 111.72 2c44 h SER 398 Ca 0.00 -0.22 0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2c44 h SER 398 Cb 0.00 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.33 2c44 h SER 398 CO 0.00 0.84 0.05 0.15 -1.14 0.00 0.00 176.83 176.73 2c44 h PHE 399 N 0.51 0.07 -0.11 3.45 -0.00 -1.94 -2.94 116.94 115.98 2c44 h PHE 399 Ca 0.07 0.02 -0.23 0.00 -0.00 0.00 0.00 57.97 57.83 2c44 h PHE 399 Cb 0.73 0.02 0.01 0.00 -0.00 0.00 0.00 35.95 36.71 2c44 h PHE 399 CO 0.03 -0.00 -0.83 1.25 -0.00 0.00 0.00 178.31 178.75 2c44 h LEU 400 N 0.15 0.87 -1.51 0.59 6.46 -1.81 -3.29 115.31 116.77 2c44 h LEU 400 Ca 0.15 -0.60 0.10 0.00 -0.12 0.00 0.00 57.88 57.42 2c44 h LEU 400 Cb 0.18 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 39.81 2c44 h LEU 400 CO -0.22 1.39 0.46 0.25 -0.62 0.00 0.00 178.44 179.71 2c44 h LEU 401 N 0.47 0.49 0.00 2.25 5.85 -1.21 -3.46 115.31 119.71 2c44 h LEU 401 Ca -0.07 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2c44 h LEU 401 Cb 1.46 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2c44 h LEU 401 CO 0.17 0.29 0.00 0.61 -0.34 0.00 0.00 178.44 179.17 2c44 n GLY 402 N -1.49 -1.84 3.80 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 2.80 -0.20 1.61 0.52 -1.26 -1.66 118.95 120.76 2c44 s ARG 403 Ca 0.00 -1.15 -0.29 0.00 -0.52 0.00 0.00 55.73 53.77 2c44 s ARG 403 Cb 0.00 -2.49 -0.03 0.00 0.52 0.00 0.00 34.95 32.96 2c44 s ARG 403 CO 0.00 0.35 1.60 0.34 0.02 0.00 0.00 175.30 177.61 2c44 s ASP 404 N -3.84 6.44 0.45 0.23 -1.08 0.13 -4.78 116.67 114.22 2c44 s ASP 404 Ca 0.34 1.68 0.25 0.00 -0.52 0.00 0.00 52.55 54.30 2c44 s ASP 404 Cb -0.07 -2.53 1.35 0.00 -1.46 0.00 0.00 42.92 40.21 2c44 s ASP 404 CO 0.24 -1.20 1.73 1.55 0.52 0.00 0.00 175.17 178.02 2c44 h PRO 405 N 10.46 0.00 0.00 4.34 0.13 -1.96 1.00 132.00 145.97 2c44 h PRO 405 Ca -0.34 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.49 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 -2.46 0.56 -0.01 0.86 4.01 -1.26 -4.61 118.16 115.25 2c44 n LYS 406 Ca -0.02 0.31 -0.18 0.00 -0.51 0.00 0.00 58.31 57.92 2c44 n LYS 406 Cb 0.18 -1.53 -0.08 0.00 -0.51 0.00 0.00 35.03 33.09 2c44 n LYS 406 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 2c44 h THR 407 N -1.00 1.28 0.00 -0.18 1.35 -1.90 -3.47 112.91 108.99 2c44 h THR 407 Ca -0.45 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.38 2c44 h THR 407 Cb 1.37 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.88 2c44 h THR 407 CO -0.27 0.64 0.00 0.61 -0.25 0.00 0.00 175.52 176.24 2c44 n GLY 408 N 0.80 0.75 3.93 5.82 0.00 0.34 -4.98 105.19 111.85 2c44 n GLY 408 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 2c44 n GLY 408 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c44 s LYS 409 N -0.50 3.51 0.09 1.61 0.00 -1.26 -4.68 119.74 118.52 2c44 s LYS 409 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 55.97 55.26 2c44 s LYS 409 Cb 0.00 -2.88 -0.14 0.00 0.00 0.00 0.00 37.83 34.81 2c44 s LYS 409 CO 0.00 0.45 1.63 0.94 0.00 0.00 0.00 175.35 178.37 2c44 n GLN 410 N -0.48 2.07 -2.32 1.78 -0.06 -1.26 0.20 117.38 117.32 2c44 n GLN 410 Ca -0.05 0.75 -0.38 0.00 -2.00 0.00 0.00 57.00 55.32 2c44 n GLN 410 Cb 0.53 -2.53 -0.02 0.00 -4.06 0.00 0.00 30.24 24.17 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 1.65 4.15 0.29 1.69 1.43 -0.66 -4.79 118.68 122.43 2c44 s LEU 411 Ca 0.83 2.30 -0.29 0.00 -1.03 0.00 0.00 54.13 55.93 2c44 s LEU 411 Cb -0.71 -4.09 -0.10 0.00 0.03 0.00 0.00 46.19 41.33 2c44 s LEU 411 CO 0.42 -0.71 1.20 -2.16 0.23 0.00 0.00 176.35 175.34 2c44 s PRO 412 N -2.41 4.50 -0.12 1.29 0.04 -1.26 -4.93 135.00 132.11 2c44 s PRO 412 Ca 0.59 1.99 0.02 0.00 0.04 0.00 0.00 61.00 63.64 2c44 s PRO 412 Cb -0.29 -3.15 -0.01 0.00 0.04 0.00 0.00 34.50 31.10 2c44 s PRO 412 CO 0.36 -0.00 -0.18 0.00 0.04 0.00 0.00 177.00 177.22 2c44 h PRO 414 N 6.78 0.00 -1.67 0.00 0.13 -1.97 -3.45 132.00 131.82 2c44 h PRO 414 Ca -0.24 0.00 0.04 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 32.12 2c44 h PRO 414 CO 0.52 0.06 0.43 0.00 -0.23 0.00 0.00 178.00 178.78 2c44 s ALA 415 N -4.03 -1.91 -0.63 -0.56 0.00 -1.26 -4.95 121.76 108.41 2c44 s ALA 415 Ca -0.02 1.70 -0.09 0.00 0.00 0.00 0.00 51.96 53.55 2c44 s ALA 415 Cb 0.12 -0.93 0.16 0.00 0.00 0.00 0.00 23.12 22.47 2c44 s ALA 415 CO 0.53 -0.29 0.51 -1.21 0.00 0.00 0.00 175.76 175.30 2c44 s GLU 416 N -0.49 2.88 -0.03 0.00 0.41 -1.26 -4.29 118.70 115.92 2c44 s GLU 416 Ca -0.01 -2.22 0.00 0.00 -0.41 0.00 0.00 54.97 52.33 2c44 s GLU 416 Cb -0.02 -4.04 -0.04 0.00 -1.78 0.00 0.00 34.13 28.25 2c44 s GLU 416 CO -0.00 -1.22 0.01 -0.51 -0.49 0.00 0.00 175.26 173.04 2c44 s LEU 417 N 0.55 3.56 -0.28 1.80 1.43 -1.15 -0.87 118.68 123.71 2c44 s LEU 417 Ca 0.13 0.05 -0.08 0.00 -1.03 0.00 0.00 54.13 53.20 2c44 s LEU 417 Cb -0.19 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 2c44 s LEU 417 CO -0.04 0.31 0.10 -0.22 0.23 0.00 0.00 176.35 176.73 2c44 s LEU 418 N -1.38 3.77 -0.36 1.79 2.96 0.85 0.24 118.68 126.55 2c44 s LEU 418 Ca 0.18 -0.46 -0.17 0.00 -0.22 0.00 0.00 54.13 53.46 2c44 s LEU 418 Cb -0.11 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.64 2c44 s LEU 418 CO 0.08 -0.13 0.45 -0.60 -1.32 0.00 0.00 176.35 174.83 2c44 s ARG 419 N 1.58 3.54 -1.19 1.98 3.52 0.14 -0.41 118.95 128.10 2c44 s ARG 419 Ca 0.05 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.20 2c44 s ARG 419 Cb -0.16 -3.83 0.20 0.00 -1.56 0.00 0.00 34.95 29.60 2c44 s ARG 419 CO 0.04 -0.63 1.40 1.28 -0.81 0.00 0.00 175.30 176.58 2c44 n LEU 420 N 5.60 5.45 -4.70 -0.88 4.32 0.34 -2.85 117.00 124.27 2c44 n LEU 420 Ca -0.07 -4.64 -0.42 0.00 -0.02 0.00 0.00 56.01 50.86 2c44 n LEU 420 Cb 0.49 -1.56 -0.03 0.00 -1.62 0.00 0.00 43.42 40.70 2c44 n LEU 420 CO 0.43 0.96 1.16 -0.89 -1.22 0.00 0.00 177.39 177.84 2c44 s THR 421 N 0.62 3.41 -0.41 -5.08 2.01 -0.93 -2.54 115.64 112.73 2c44 s THR 421 Ca 0.39 0.89 -0.12 0.00 0.31 0.00 0.00 61.69 63.16 2c44 s THR 421 Cb -0.03 -3.57 0.04 0.00 0.01 0.00 0.00 72.50 68.95 2c44 s THR 421 CO -0.01 0.02 0.27 -0.63 -0.69 0.00 0.00 174.62 173.58 2c44 s ILE 422 N 2.08 4.80 0.50 1.82 -1.09 -0.57 -4.33 121.20 124.41 2c44 s ILE 422 Ca 0.67 -0.95 -0.24 0.00 -2.23 0.00 0.00 60.65 57.90 2c44 s ILE 422 Cb -0.35 -3.76 -0.07 0.00 -1.58 0.00 0.00 42.46 36.70 2c44 s ILE 422 CO 0.29 -0.37 1.41 -2.65 -1.23 0.00 0.00 174.94 172.39 2c44 n PRO 423 N 5.06 2.00 -2.06 2.79 -0.02 -1.26 -4.75 135.00 136.77 2c44 n PRO 423 Ca -0.11 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.67 2c44 n PRO 423 Cb 0.45 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.28 2c44 n PRO 423 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2c44 s ARG 424 N -2.67 4.27 -1.60 -0.52 0.52 -1.26 -3.41 118.95 114.28 2c44 s ARG 424 Ca 0.66 2.22 -0.11 0.00 -0.52 0.00 0.00 55.73 57.98 2c44 s ARG 424 Cb -0.43 -3.19 0.10 0.00 0.52 0.00 0.00 34.95 31.95 2c44 s ARG 424 CO 0.53 -0.50 0.61 0.00 0.02 0.00 0.00 175.30 175.97 2c44 n ALA 425 N 3.71 -1.55 -0.05 2.13 0.00 -1.26 -0.80 120.51 122.68 2c44 n ALA 425 Ca 0.12 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.36 2c44 n ALA 425 Cb 0.40 -2.65 -0.04 0.00 0.00 0.00 0.00 19.45 17.17 2c44 n ALA 425 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2c44 n THR 426 N -4.40 0.52 -4.26 0.00 -1.04 -1.22 -4.27 114.28 99.60 2c44 n THR 426 Ca -0.08 -0.18 -0.23 0.00 -2.04 0.00 0.00 64.05 61.52 2c44 n THR 426 Cb 0.57 -1.04 -0.07 0.00 -1.82 0.00 0.00 70.33 67.96 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 -2.18 2.69 0.57 -1.42 2.02 -1.26 -5.07 117.35 112.69 2c44 s TYR 427 Ca -0.12 -0.27 0.07 0.00 -0.37 0.00 0.00 57.07 56.38 2c44 s TYR 427 Cb 0.04 -1.29 0.07 0.00 -0.40 0.00 0.00 41.96 40.37 2c44 s TYR 427 CO 0.20 0.56 0.58 0.25 -1.57 0.00 0.00 175.55 175.57 2c44 n THR 428 N -0.95 0.00 0.11 -0.71 -2.24 -1.26 -4.98 114.28 104.26 2c44 n THR 428 Ca -0.06 -2.10 0.03 0.00 -2.27 0.00 0.00 64.05 59.66 2c44 n THR 428 Cb 0.60 -0.23 0.43 0.00 -2.10 0.00 0.00 70.33 69.03 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 0.27 -0.64 -0.78 4.15 -1.99 -1.53 115.11 114.59 2c44 h GLN 429 Ca -0.32 -0.05 -0.05 0.00 0.77 0.00 0.00 58.65 59.01 2c44 h GLN 429 Cb 1.28 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.89 2c44 h GLN 429 CO 0.48 0.33 0.20 1.15 -1.93 0.00 0.00 178.83 179.05 2c44 h THR 430 N 0.27 1.24 -0.47 2.39 2.02 -1.99 -0.74 112.91 115.63 2c44 h THR 430 Ca 0.06 -0.83 -0.08 0.00 0.77 0.00 0.00 66.41 66.34 2c44 h THR 430 Cb 0.23 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2c44 h THR 430 CO 0.01 0.32 -0.01 0.45 0.37 0.00 0.00 175.52 176.66 2c44 h HIS 431 N 0.94 0.91 -0.39 3.16 3.86 -1.68 -0.11 115.15 121.84 2c44 h HIS 431 Ca 0.21 -0.16 0.05 0.00 -1.16 0.00 0.00 60.37 59.31 2c44 h HIS 431 Cb 0.27 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 28.46 2c44 h HIS 431 CO 0.02 0.88 0.10 0.52 0.86 0.00 0.00 177.93 180.30 2c44 h MET 432 N 0.68 0.23 -0.71 2.45 2.07 -0.78 0.16 114.93 119.03 2c44 h MET 432 Ca 0.13 -0.01 -0.01 0.00 -2.07 0.00 0.00 59.70 57.74 2c44 h MET 432 Cb 0.52 -0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 30.16 2c44 h MET 432 CO 0.03 0.15 0.41 -0.44 1.07 0.00 0.00 176.91 178.13 2c44 h ASP 433 N 0.24 0.86 -0.50 1.22 3.45 -0.85 -0.30 116.42 120.54 2c44 h ASP 433 Ca 0.18 -0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.56 2c44 h ASP 433 Cb 0.20 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 2c44 h ASP 433 CO -0.22 0.68 0.23 0.15 -1.57 0.00 0.00 179.24 178.50 2c44 h PHE 434 N 0.98 0.73 -0.34 4.55 3.57 0.53 -0.19 116.94 126.78 2c44 h PHE 434 Ca 0.25 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 2c44 h PHE 434 Cb -0.01 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 2c44 h PHE 434 CO 0.00 0.59 0.15 0.82 -2.23 0.00 0.00 178.31 177.64 2c44 h ILE 435 N 0.66 1.17 -0.70 1.41 2.04 0.09 -1.20 117.51 120.98 2c44 h ILE 435 Ca 0.17 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.53 2c44 h ILE 435 Cb 0.14 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2c44 h ILE 435 CO -0.02 0.18 0.45 0.40 0.00 0.00 0.00 178.15 179.16 2c44 h ILE 436 N 0.40 1.19 -0.88 -0.67 2.04 -0.82 -1.60 117.51 117.16 2c44 h ILE 436 Ca 0.11 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2c44 h ILE 436 Cb 0.14 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 2c44 h ILE 436 CO -0.01 0.19 0.51 -0.08 0.00 0.00 0.00 178.15 178.76 2c44 h GLU 437 N 0.95 1.21 -0.54 2.37 4.57 -0.76 -2.24 114.58 120.14 2c44 h GLU 437 Ca 0.25 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2c44 h GLU 437 Cb -0.08 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 28.24 2c44 h GLU 437 CO -0.05 0.87 0.34 0.00 -1.18 0.00 0.00 179.01 178.99 2c44 h ALA 438 N 1.28 0.69 0.00 2.92 0.00 -0.51 -1.99 119.26 121.66 2c44 h ALA 438 Ca 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2c44 h ALA 438 Cb -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2c44 h ALA 438 CO -0.06 0.15 0.00 0.74 0.00 0.00 0.00 179.25 180.09 2c44 h PHE 439 N 0.73 0.00 -0.63 0.00 0.04 -0.72 -1.33 116.94 115.04 2c44 h PHE 439 Ca 0.20 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.95 2c44 h PHE 439 Cb -0.05 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.07 2c44 h PHE 439 CO -0.03 0.00 0.34 0.87 -0.60 0.00 0.00 178.31 178.89 2c44 h LYS 440 N 0.00 0.88 -0.25 1.51 1.57 -1.07 -0.30 116.57 118.90 2c44 h LYS 440 Ca 0.00 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.56 2c44 h LYS 440 Cb 0.18 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 2c44 h LYS 440 CO 0.00 0.67 -0.30 0.45 -0.57 0.00 0.00 179.45 179.70 2c44 h HIS 441 N 0.86 0.79 -0.53 -1.35 3.86 -1.33 -2.04 115.15 115.40 2c44 h HIS 441 Ca 0.22 -0.25 0.06 0.00 -1.16 0.00 0.00 60.37 59.24 2c44 h HIS 441 Cb 0.05 -0.16 -0.05 0.00 1.06 0.00 0.00 27.41 28.31 2c44 h HIS 441 CO -0.01 0.98 0.25 0.28 0.86 0.00 0.00 177.93 180.30 2c44 h VAL 442 N 0.37 0.92 -0.10 2.45 2.07 -1.18 -2.27 116.25 118.51 2c44 h VAL 442 Ca 0.03 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2c44 h VAL 442 Cb 0.87 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2c44 h VAL 442 CO 0.07 0.09 0.05 0.50 0.02 0.00 0.00 177.57 178.30 2c44 h LYS 443 N 0.49 0.14 0.00 1.57 3.64 -1.03 -1.36 116.57 120.02 2c44 h LYS 443 Ca 0.24 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2c44 h LYS 443 Cb 0.19 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2c44 h LYS 443 CO -0.19 0.20 0.08 0.39 -2.27 0.00 0.00 179.45 177.65 2c44 n GLU 444 N -4.96 0.03 0.00 1.90 1.02 -0.77 -1.05 120.64 116.81 2c44 n GLU 444 Ca -0.05 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 2c44 n GLU 444 Cb 0.08 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.82 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 -1.62 1.43 -0.22 1.62 5.15 -0.75 -4.86 115.26 116.03 2c44 n ASN 445 Ca -0.00 -1.58 -0.12 0.00 -0.60 0.00 0.00 54.58 52.28 2c44 n ASN 445 Cb 0.09 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.26 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 -0.60 -0.13 5.20 0.00 -0.02 -1.49 119.26 122.22 2c44 h ALA 446 Ca 0.00 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2c44 h ALA 446 Cb 0.42 1.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 2c44 h ALA 446 CO 0.00 -0.97 0.50 0.77 0.00 0.00 0.00 179.25 179.55 2c44 h SER 447 N -0.27 0.00 -0.22 0.00 0.02 -1.86 -1.28 113.55 109.93 2c44 h SER 447 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 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 -0.70 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 175.58 2c44 n ASN 448 N -3.01 3.23 -4.70 3.07 3.02 -0.56 -4.95 115.26 111.36 2c44 n ASN 448 Ca 0.01 -1.98 -0.42 0.00 -0.03 0.00 0.00 54.58 52.16 2c44 n ASN 448 Cb 0.58 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.58 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 -1.69 4.71 0.07 2.41 1.01 -0.49 -5.03 121.20 122.19 2c44 s ILE 449 Ca 0.33 1.96 -0.19 0.00 0.00 0.00 0.00 60.65 62.76 2c44 s ILE 449 Cb 0.21 -4.26 -0.07 0.00 0.01 0.00 0.00 42.46 38.36 2c44 s ILE 449 CO 0.30 0.07 0.56 -1.59 0.00 0.00 0.00 174.94 174.28 2c44 s LYS 450 N 1.59 4.16 1.07 2.79 0.00 -1.26 -4.90 119.74 123.20 2c44 s LYS 450 Ca 0.51 0.70 -0.12 0.00 0.00 0.00 0.00 55.97 57.06 2c44 s LYS 450 Cb -0.21 -3.21 0.23 0.00 0.00 0.00 0.00 37.83 34.64 2c44 s LYS 450 CO 0.23 0.63 1.07 0.20 0.00 0.00 0.00 175.35 177.48 2c44 s GLY 451 N -1.15 1.59 0.40 0.59 0.00 -1.26 -4.18 107.32 103.30 2c44 s GLY 451 Ca 0.29 0.04 0.07 0.00 0.00 0.00 0.00 44.72 45.13 2c44 s GLY 451 CO 0.19 0.66 0.01 1.08 0.00 0.00 0.00 173.10 175.04 2c44 s LEU 452 N -6.94 2.88 -0.11 0.66 1.43 -0.50 0.86 118.68 116.96 2c44 s LEU 452 Ca 0.67 -1.32 -0.26 0.00 -1.03 0.00 0.00 54.13 52.19 2c44 s LEU 452 Cb -0.23 -0.96 0.06 0.00 0.03 0.00 0.00 46.19 45.09 2c44 s LEU 452 CO 0.62 -0.43 0.62 0.28 0.23 0.00 0.00 176.35 177.67 2c44 s THR 453 N -2.69 0.01 0.63 5.49 -1.32 -0.96 -4.53 115.64 112.26 2c44 s THR 453 Ca 0.35 -0.06 -0.18 0.00 -1.21 0.00 0.00 61.69 60.59 2c44 s THR 453 Cb 0.09 -0.91 -0.03 0.00 -1.51 0.00 0.00 72.50 70.14 2c44 s THR 453 CO 0.18 -0.04 1.16 0.49 -2.21 0.00 0.00 174.62 174.21 2c44 n PHE 454 N 1.58 1.49 0.00 9.09 3.01 -1.26 -0.60 117.46 130.77 2c44 n PHE 454 Ca -0.18 0.43 0.00 0.00 1.01 0.00 0.00 57.45 58.71 2c44 n PHE 454 Cb 0.56 -2.22 0.00 0.00 -0.01 0.00 0.00 39.48 37.82 2c44 n PHE 454 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2c44 n THR 455 N -1.82 0.00 -3.46 4.37 -2.24 -0.39 -4.73 114.28 106.01 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 69.07 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 -0.45 -1.42 -0.15 4.78 5.04 -1.06 -4.97 117.35 119.11 2c44 s TYR 456 Ca 0.00 2.07 -0.01 0.00 -2.44 0.00 0.00 57.07 56.69 2c44 s TYR 456 Cb 0.00 0.71 0.04 0.00 0.35 0.00 0.00 41.96 43.06 2c44 s TYR 456 CO 0.00 -0.73 -0.04 -2.00 -1.34 0.00 0.00 175.55 171.44 2c44 s GLU 457 N 2.88 1.24 0.84 4.97 2.12 -1.26 -1.67 118.70 127.81 2c44 s GLU 457 Ca 0.04 -0.41 -0.10 0.00 0.36 0.00 0.00 54.97 54.85 2c44 s GLU 457 Cb -0.13 -1.87 0.10 0.00 0.26 0.00 0.00 34.13 32.49 2c44 s GLU 457 CO -0.20 -0.43 1.12 -2.14 -0.54 0.00 0.00 175.26 173.07 2c44 s PRO 458 N 1.71 1.65 0.26 4.30 0.02 -1.26 -4.95 135.00 136.72 2c44 s PRO 458 Ca 0.01 1.37 0.14 0.00 0.02 0.00 0.00 61.00 62.55 2c44 s PRO 458 Cb -0.15 -1.81 0.03 0.00 0.02 0.00 0.00 34.50 32.59 2c44 s PRO 458 CO -0.07 -2.13 1.42 1.57 -0.33 0.00 0.00 177.00 177.45 2c44 h LYS 459 N -1.46 0.00 -5.54 5.54 -0.00 -2.00 -3.40 116.57 109.70 2c44 h LYS 459 Ca -0.43 0.00 -0.52 0.00 -0.00 0.00 0.00 60.65 59.70 2c44 h LYS 459 Cb 1.25 0.00 -0.28 0.00 -0.00 0.00 0.00 32.23 33.20 2c44 h LYS 459 CO 0.46 0.56 -0.82 0.54 -0.00 0.00 0.00 179.45 180.19 2c44 s VAL 460 N -2.93 1.29 -1.61 0.07 0.11 -1.26 -4.81 120.40 111.26 2c44 s VAL 460 Ca 0.04 -0.78 -0.08 0.00 -2.93 0.00 0.00 61.98 58.22 2c44 s VAL 460 Cb 0.08 -1.09 0.08 0.00 -1.53 0.00 0.00 36.38 33.92 2c44 s VAL 460 CO 0.75 0.29 0.36 0.18 -3.33 0.00 0.00 175.10 173.36 2c44 n LEU 461 N 2.49 -1.36 -0.31 2.54 4.77 -1.26 -4.83 117.00 119.03 2c44 n LEU 461 Ca -0.15 -1.16 0.16 0.00 -0.03 0.00 0.00 56.01 54.82 2c44 n LEU 461 Cb 0.54 -1.83 0.34 0.00 -2.33 0.00 0.00 43.42 40.14 2c44 n LEU 461 CO 0.24 0.35 1.00 0.08 -1.33 0.00 0.00 177.39 177.73 2c44 h ARG 462 N -1.56 0.25 -0.36 3.23 0.11 -1.87 -2.91 114.38 111.28 2c44 h ARG 462 Ca -0.63 -0.02 0.10 0.00 0.10 0.00 0.00 59.98 59.54 2c44 h ARG 462 Cb 1.39 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 2c44 h ARG 462 CO 0.74 0.17 0.40 1.12 0.10 0.00 0.00 179.97 182.50 2c44 h HIS 463 N 0.26 0.00 -0.19 4.08 2.07 -1.88 -1.64 115.15 117.85 2c44 h HIS 463 Ca 0.60 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.96 2c44 h HIS 463 Cb 1.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.22 2c44 h HIS 463 CO -0.19 0.00 -0.54 0.74 -3.07 0.00 0.00 177.93 174.87 2c44 h PHE 464 N 0.00 0.68 0.00 6.12 -1.00 -1.89 -3.38 116.94 117.48 2c44 h PHE 464 Ca 0.17 -0.24 0.00 0.00 2.81 0.00 0.00 57.97 60.71 2c44 h PHE 464 Cb 0.97 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.40 2c44 h PHE 464 CO 0.00 0.97 -0.03 0.25 -1.61 0.00 0.00 178.31 177.89 2c44 n THR 465 N -3.96 0.51 -1.41 -1.55 -2.24 -1.06 -4.68 114.28 99.89 2c44 n THR 465 Ca -0.03 -0.53 -0.31 0.00 -2.27 0.00 0.00 64.05 60.91 2c44 n THR 465 Cb 0.60 0.70 0.08 0.00 -2.10 0.00 0.00 70.33 69.61 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 -0.56 2.37 0.00 6.98 0.00 -0.64 -4.91 121.76 125.00 2c44 s ALA 466 Ca 0.02 0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.15 2c44 s ALA 466 Cb 0.01 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 2c44 s ALA 466 CO 0.00 -1.59 -0.15 0.15 0.00 0.00 0.00 175.76 174.17 2c44 s LYS 467 N -4.99 1.17 0.32 0.00 1.02 -0.67 -4.73 119.74 111.86 2c44 s LYS 467 Ca 0.60 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 56.00 2c44 s LYS 467 Cb -0.16 -1.15 -0.06 0.00 -0.52 0.00 0.00 37.83 35.94 2c44 s LYS 467 CO 0.56 0.31 0.06 -0.51 -0.92 0.00 0.00 175.35 174.85 2c44 s LEU 468 N -0.60 2.12 0.28 3.17 1.02 0.23 -1.27 118.68 123.63 2c44 s LEU 468 Ca 0.05 -1.39 0.03 0.00 0.02 0.00 0.00 54.13 52.83 2c44 s LEU 468 Cb -0.06 -0.33 -0.04 0.00 0.02 0.00 0.00 46.19 45.77 2c44 s LEU 468 CO 0.00 -0.63 0.17 -0.75 0.02 0.00 0.00 176.35 175.16 2c44 s LYS 469 N -3.90 1.50 0.00 1.70 2.20 0.24 -4.04 119.74 117.44 2c44 s LYS 469 Ca 0.36 -1.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.13 2c44 s LYS 469 Cb 0.08 0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.48 2c44 s LYS 469 CO 0.15 -0.46 0.00 -1.91 -0.36 0.00 0.00 175.35 172.77 2c44 n GLU 470 N -0.49 0.00 0.00 4.03 2.13 -1.26 -2.27 120.64 122.78 2c44 n GLU 470 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 2c44 n GLU 470 Cb 0.65 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.36 2c44 n GLU 470 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05