#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c44 n LYS 5 N 0.00 0.48 -2.33 -1.08 4.76 -1.26 -4.60 118.16 114.13 2c44 n LYS 5 Ca 0.00 0.50 -0.43 0.00 -2.87 0.00 0.00 58.31 55.51 2c44 n LYS 5 Cb 0.00 -1.67 -0.02 0.00 -1.84 0.00 0.00 35.03 31.50 2c44 n LYS 5 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2c44 s HIS 6 N -2.33 2.35 0.64 2.13 2.46 -1.26 -4.80 115.29 114.48 2c44 s HIS 6 Ca -0.19 0.66 -0.16 0.00 0.47 0.00 0.00 55.06 55.84 2c44 s HIS 6 Cb 0.03 -4.31 -0.01 0.00 -0.13 0.00 0.00 32.58 28.16 2c44 s HIS 6 CO 0.30 -2.04 1.13 -0.51 -2.47 0.00 0.00 174.74 171.15 2c44 s LEU 7 N 5.61 3.48 0.31 8.88 1.43 -1.26 -4.99 118.68 132.14 2c44 s LEU 7 Ca 0.62 2.11 -0.28 0.00 -1.03 0.00 0.00 54.13 55.55 2c44 s LEU 7 Cb -0.14 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.42 2c44 s LEU 7 CO 0.32 -1.62 1.04 -2.16 0.23 0.00 0.00 176.35 174.16 2c44 s PRO 8 N -3.84 4.54 -0.01 1.29 0.04 -1.26 -4.94 135.00 130.82 2c44 s PRO 8 Ca 0.70 1.61 -0.34 0.00 0.04 0.00 0.00 61.00 63.01 2c44 s PRO 8 Cb -0.23 -2.97 -0.12 0.00 0.04 0.00 0.00 34.50 31.21 2c44 s PRO 8 CO 0.38 0.17 1.78 0.39 0.04 0.00 0.00 177.00 179.77 2c44 n GLU 9 N 0.81 2.17 -0.62 4.56 4.71 -1.26 -4.82 120.64 126.18 2c44 n GLU 9 Ca 0.01 0.79 -0.04 0.00 -0.01 0.00 0.00 57.16 57.91 2c44 n GLU 9 Cb 0.47 -2.61 -0.01 0.00 -1.01 0.00 0.00 31.44 28.28 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 5.59 1.24 -3.58 3.49 -0.04 -1.26 -4.78 135.00 135.66 2c44 n PRO 10 Ca 0.21 -0.38 -0.08 0.00 -0.04 0.00 0.00 63.50 63.21 2c44 n PRO 10 Cb 0.29 -1.20 -0.02 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.27 -0.31 -0.07 0.54 -0.12 -1.26 -4.98 117.98 111.51 2c44 s PHE 11 Ca 0.11 0.10 -0.01 0.00 -0.05 0.00 0.00 56.93 57.08 2c44 s PHE 11 Cb 0.07 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 43.01 2c44 s PHE 11 CO -0.00 -0.71 -0.01 1.03 -0.05 0.00 0.00 175.22 175.48 2c44 s ARG 12 N -3.31 2.92 -0.02 1.99 0.52 -1.26 -5.08 118.95 114.71 2c44 s ARG 12 Ca 0.07 -0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 54.52 2c44 s ARG 12 Cb -0.01 -2.75 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 2c44 s ARG 12 CO -0.06 0.69 1.23 0.42 0.02 0.00 0.00 175.30 177.59 2c44 s ILE 13 N -0.91 4.13 -0.13 1.52 1.01 -1.26 -4.93 121.20 120.63 2c44 s ILE 13 Ca 0.14 1.49 0.04 0.00 0.00 0.00 0.00 60.65 62.32 2c44 s ILE 13 Cb -0.11 -3.96 -0.11 0.00 0.01 0.00 0.00 42.46 38.29 2c44 s ILE 13 CO 0.04 0.03 -0.07 0.54 0.00 0.00 0.00 174.94 175.48 2c44 n ARG 14 N 4.89 1.00 -4.07 2.79 3.00 -1.26 -5.02 116.66 117.98 2c44 n ARG 14 Ca 0.11 0.05 -0.16 0.00 -0.01 0.00 0.00 57.85 57.84 2c44 n ARG 14 Cb 0.46 -1.29 -0.15 0.00 0.00 0.00 0.00 32.46 31.48 2c44 n ARG 14 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2c44 s VAL 15 N -2.29 0.33 0.16 1.55 1.01 -1.26 -5.16 120.40 114.74 2c44 s VAL 15 Ca -0.15 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 61.81 2c44 s VAL 15 Cb 0.04 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 2c44 s VAL 15 CO 0.38 0.13 -0.18 0.27 0.00 0.00 0.00 175.10 175.71 2c44 s ILE 16 N 0.34 1.76 -0.23 2.22 -4.36 -1.26 -5.12 121.20 114.55 2c44 s ILE 16 Ca -0.04 -1.89 0.02 0.00 -0.26 0.00 0.00 60.65 58.48 2c44 s ILE 16 Cb -0.07 -1.80 0.05 0.00 1.25 0.00 0.00 42.46 41.89 2c44 s ILE 16 CO -0.01 -0.33 -0.12 -0.70 0.24 0.00 0.00 174.94 174.03 2c44 s GLU 17 N -2.78 2.29 0.53 0.37 2.12 -1.26 -5.12 118.70 114.86 2c44 s GLU 17 Ca 0.15 -1.12 -0.22 0.00 0.36 0.00 0.00 54.97 54.14 2c44 s GLU 17 Cb -0.06 -2.71 -0.05 0.00 0.26 0.00 0.00 34.13 31.57 2c44 s GLU 17 CO 0.06 -0.48 1.36 -2.14 -0.54 0.00 0.00 175.26 173.52 2c44 s PRO 18 N 1.22 3.21 0.11 4.30 0.02 -1.26 -5.04 135.00 137.57 2c44 s PRO 18 Ca -0.05 2.23 0.06 0.00 0.02 0.00 0.00 61.00 63.26 2c44 s PRO 18 Cb -0.18 -2.30 -0.04 0.00 0.02 0.00 0.00 34.50 32.01 2c44 s PRO 18 CO -0.07 -1.13 -0.14 0.14 -0.33 0.00 0.00 177.00 175.47 2c44 s VAL 19 N -1.30 1.25 0.29 3.83 -7.23 -1.26 -5.16 120.40 110.81 2c44 s VAL 19 Ca 0.70 -1.64 0.07 0.00 -1.81 0.00 0.00 61.98 59.30 2c44 s VAL 19 Cb -0.40 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 2c44 s VAL 19 CO 0.48 -0.40 0.29 -1.59 -0.31 0.00 0.00 175.10 173.57 2c44 s LYS 20 N -2.53 2.98 0.40 4.82 0.00 -1.26 -5.12 119.74 119.02 2c44 s LYS 20 Ca 0.07 -1.07 0.08 0.00 0.00 0.00 0.00 55.97 55.04 2c44 s LYS 20 Cb -0.05 -2.63 -0.04 0.00 0.00 0.00 0.00 37.83 35.11 2c44 s LYS 20 CO 0.03 0.26 0.24 1.03 0.00 0.00 0.00 175.35 176.91 2c44 s ARG 21 N -3.96 2.37 0.26 1.78 1.81 -1.26 -4.36 118.95 115.58 2c44 s ARG 21 Ca 0.37 -1.67 0.00 0.00 -1.72 0.00 0.00 55.73 52.71 2c44 s ARG 21 Cb -0.08 -2.16 -0.03 0.00 -0.45 0.00 0.00 34.95 32.23 2c44 s ARG 21 CO 0.27 -0.09 0.25 0.95 -0.68 0.00 0.00 175.30 175.99 2c44 s THR 22 N -2.52 0.00 0.19 0.02 -4.23 -1.26 -5.07 115.64 102.77 2c44 s THR 22 Ca 0.43 -1.90 0.04 0.00 -1.18 0.00 0.00 61.69 59.08 2c44 s THR 22 Cb 0.00 -2.49 -0.03 0.00 1.34 0.00 0.00 72.50 71.32 2c44 s THR 22 CO 0.24 0.00 0.31 0.42 -0.54 0.00 0.00 174.62 175.06 2c44 s THR 23 N -3.81 5.29 0.18 3.99 -4.23 -1.26 -5.00 115.64 110.79 2c44 s THR 23 Ca 0.37 -0.81 -0.13 0.00 -1.18 0.00 0.00 61.69 59.94 2c44 s THR 23 Cb 0.04 -3.78 0.09 0.00 1.34 0.00 0.00 72.50 70.18 2c44 s THR 23 CO 0.17 -0.19 1.80 -0.09 -0.54 0.00 0.00 174.62 175.77 2c44 h ARG 24 N 1.75 0.56 -0.58 3.99 9.65 -1.95 -1.40 114.38 126.40 2c44 h ARG 24 Ca -0.50 -0.03 0.08 0.00 -1.10 0.00 0.00 59.98 58.43 2c44 h ARG 24 Cb 1.21 -0.13 -0.06 0.00 -1.39 0.00 0.00 29.97 29.60 2c44 h ARG 24 CO 0.65 0.37 0.24 0.00 2.80 0.00 0.00 179.97 184.03 2c44 h ALA 25 N 1.27 0.74 -0.26 2.80 0.00 -1.95 0.09 119.26 121.95 2c44 h ALA 25 Ca 0.23 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2c44 h ALA 25 Cb 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2c44 h ALA 25 CO -0.14 -0.15 0.16 -0.92 0.00 0.00 0.00 179.25 178.19 2c44 h TYR 26 N 0.44 0.35 -0.78 0.00 5.03 -1.75 -2.39 116.97 117.86 2c44 h TYR 26 Ca 0.28 -0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.59 2c44 h TYR 26 Cb 0.30 -0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.42 2c44 h TYR 26 CO -0.14 0.27 0.48 0.00 -1.32 0.00 0.00 178.16 177.45 2c44 h ARG 27 N 0.33 1.06 -0.50 1.82 3.08 -0.71 -0.20 114.38 119.27 2c44 h ARG 27 Ca 0.09 -0.09 0.10 0.00 0.07 0.00 0.00 59.98 60.16 2c44 h ARG 27 Cb 0.02 -0.23 -0.09 0.00 0.08 0.00 0.00 29.97 29.75 2c44 h ARG 27 CO -0.02 0.74 -0.07 0.93 -1.07 0.00 0.00 179.97 180.48 2c44 h GLU 28 N 1.07 0.05 -0.08 0.04 4.39 -0.72 0.31 114.58 119.65 2c44 h GLU 28 Ca 0.28 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.97 2c44 h GLU 28 Cb -0.06 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2c44 h GLU 28 CO -0.06 0.03 -0.01 0.93 -1.16 0.00 0.00 179.01 178.75 2c44 h GLU 29 N 0.05 0.14 -0.42 2.33 4.39 -0.93 -3.13 114.58 117.00 2c44 h GLU 29 Ca 0.25 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.93 2c44 h GLU 29 Cb 0.38 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.98 2c44 h GLU 29 CO -0.47 0.44 0.20 0.00 -1.16 0.00 0.00 179.01 178.01 2c44 h ALA 30 N 0.70 0.52 -0.05 3.43 0.00 -0.28 -0.87 119.26 122.71 2c44 h ALA 30 Ca 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 30 Cb 0.38 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2c44 h ALA 30 CO 0.01 -0.17 -0.13 0.97 0.00 0.00 0.00 179.25 179.93 2c44 h ILE 31 N 0.40 1.12 -0.05 0.00 6.09 -0.47 -0.37 117.51 124.22 2c44 h ILE 31 Ca 0.18 -0.55 -0.13 0.00 -1.37 0.00 0.00 64.86 62.99 2c44 h ILE 31 Cb 0.11 1.23 0.01 0.00 0.47 0.00 0.00 36.82 38.63 2c44 h ILE 31 CO -0.14 0.16 -0.47 0.40 -3.07 0.00 0.00 178.15 175.03 2c44 h ILE 32 N 0.07 1.42 -0.04 2.19 2.04 -1.37 -1.20 117.51 120.62 2c44 h ILE 32 Ca 0.01 -1.90 -0.02 0.00 1.00 0.00 0.00 64.86 63.96 2c44 h ILE 32 Cb 0.27 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 38.77 2c44 h ILE 32 CO 0.02 0.55 -0.06 0.11 0.00 0.00 0.00 178.15 178.77 2c44 h LYS 33 N -0.09 0.05 -0.23 2.37 1.57 -0.60 -1.35 116.57 118.30 2c44 h LYS 33 Ca -0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2c44 h LYS 33 Cb 1.15 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2c44 h LYS 33 CO 0.09 0.11 0.00 -1.13 -0.57 0.00 0.00 179.45 177.96 2c44 n SER 34 N -4.44 0.69 -2.83 0.86 3.41 -0.20 -4.87 113.62 106.24 2c44 n SER 34 Ca -0.02 -2.02 -0.21 0.00 -0.26 0.00 0.00 58.87 56.36 2c44 n SER 34 Cb 0.16 -0.13 0.03 0.00 -0.26 0.00 0.00 64.21 64.00 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 0.57 -0.46 2.61 5.00 0.00 -0.51 -2.01 105.19 110.38 2c44 n GLY 35 Ca 0.03 0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2c44 n GLY 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c44 n MET 36 N -3.81 -2.67 -3.77 1.61 0.00 -0.46 0.64 117.12 108.65 2c44 n MET 36 Ca -0.12 0.90 -0.30 0.00 0.00 0.00 0.00 57.70 58.19 2c44 n MET 36 Cb 0.62 -5.61 -0.15 0.00 0.00 0.00 0.00 33.22 28.07 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 -2.25 3.85 0.51 7.83 3.84 -0.85 -4.76 114.94 123.12 2c44 s ASN 37 Ca 0.10 -1.46 0.33 0.00 0.21 0.00 0.00 52.86 52.04 2c44 s ASN 37 Cb -0.04 -0.89 1.47 0.00 -0.55 0.00 0.00 41.25 41.23 2c44 s ASN 37 CO 0.12 -0.37 1.79 -0.65 -2.79 0.00 0.00 177.10 175.20 2c44 h PRO 38 N 8.08 0.07 -0.17 0.43 0.11 -1.88 0.22 132.00 138.85 2c44 h PRO 38 Ca -0.14 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.02 2c44 h PRO 38 Cb 1.04 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2c44 h PRO 38 CO 0.44 0.05 0.20 0.74 -0.21 0.00 0.00 178.00 179.22 2c44 h PHE 39 N 0.07 0.00 -0.16 0.65 -1.00 -1.89 -0.38 116.94 114.23 2c44 h PHE 39 Ca 0.58 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.36 2c44 h PHE 39 Cb 2.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.71 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 -3.75 2.41 -4.83 1.54 4.77 0.77 -4.94 117.00 112.97 2c44 n LEU 40 Ca 0.01 -0.93 -0.33 0.00 -0.03 0.00 0.00 56.01 54.74 2c44 n LEU 40 Cb 0.32 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2c44 n LEU 40 CO 0.27 0.47 0.68 -0.76 -1.33 0.00 0.00 177.39 176.71 2c44 s LEU 41 N -1.74 3.73 0.31 2.23 1.43 -0.16 -4.85 118.68 119.63 2c44 s LEU 41 Ca 0.34 1.68 -0.27 0.00 -1.03 0.00 0.00 54.13 54.85 2c44 s LEU 41 Cb 0.20 -4.53 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 2c44 s LEU 41 CO 0.30 -0.61 0.95 -1.81 0.23 0.00 0.00 176.35 175.42 2c44 s ASP 42 N -2.65 7.35 0.20 2.29 1.01 -1.26 -4.96 116.67 118.65 2c44 s ASP 42 Ca 0.61 1.88 -0.10 0.00 0.71 0.00 0.00 52.55 55.64 2c44 s ASP 42 Cb -0.11 -2.59 0.27 0.00 1.01 0.00 0.00 42.92 41.50 2c44 s ASP 42 CO 0.25 -0.06 1.71 -1.28 0.21 0.00 0.00 175.17 176.00 2c44 h SER 43 N 3.29 0.04 0.27 0.27 0.87 -1.96 -0.33 113.55 115.99 2c44 h SER 43 Ca -0.47 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 2c44 h SER 43 Cb 1.19 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 2c44 h SER 43 CO 0.65 0.03 0.00 -0.62 -0.53 0.00 0.00 176.83 176.37 2c44 n GLU 44 N -5.10 0.00 -0.34 2.24 1.02 -1.26 -1.13 120.64 116.07 2c44 n GLU 44 Ca 0.08 0.37 0.10 0.00 -0.02 0.00 0.00 57.16 57.68 2c44 n GLU 44 Cb 0.30 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.49 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 -1.51 3.36 -4.16 1.62 8.00 -0.14 -4.76 116.55 118.97 2c44 n ASP 45 Ca 0.02 -2.05 -0.31 0.00 0.71 0.00 0.00 54.79 53.16 2c44 n ASP 45 Cb 0.09 -0.42 -0.17 0.00 -0.02 0.00 0.00 41.12 40.60 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 -1.26 1.90 -0.12 2.53 1.01 -0.28 -4.95 120.40 119.23 2c44 s VAL 46 Ca 0.41 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 2c44 s VAL 46 Cb 0.22 -1.68 -0.13 0.00 0.00 0.00 0.00 36.38 34.79 2c44 s VAL 46 CO 0.27 0.52 0.38 0.15 0.00 0.00 0.00 175.10 176.42 2c44 h PHE 47 N 7.13 0.00 -3.75 5.22 -0.00 -1.43 -3.44 116.94 120.67 2c44 h PHE 47 Ca -0.28 0.00 -0.65 0.00 -0.00 0.00 0.00 57.97 57.04 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 0.51 -0.77 0.42 -0.00 0.00 0.00 178.31 178.94 2c44 s ILE 48 N -1.90 2.04 -0.75 1.41 1.01 -1.18 -4.94 121.20 116.89 2c44 s ILE 48 Ca -0.10 -1.75 -0.20 0.00 0.00 0.00 0.00 60.65 58.60 2c44 s ILE 48 Cb -0.01 -2.28 0.10 0.00 0.01 0.00 0.00 42.46 40.28 2c44 s ILE 48 CO 0.35 -0.23 0.97 -0.62 0.00 0.00 0.00 174.94 175.41 2c44 s ASP 49 N 1.12 6.36 -0.31 3.58 3.68 -1.26 -1.82 116.67 128.02 2c44 s ASP 49 Ca -0.02 -1.53 0.10 0.00 2.13 0.00 0.00 52.55 53.24 2c44 s ASP 49 Cb -0.19 -2.38 0.76 0.00 -1.45 0.00 0.00 42.92 39.66 2c44 s ASP 49 CO -0.07 -1.21 1.81 0.18 0.13 0.00 0.00 175.17 176.01 2c44 n LEU 50 N 6.88 6.07 -0.30 -1.34 4.77 0.12 -4.56 117.00 128.64 2c44 n LEU 50 Ca 0.06 -3.19 0.03 0.00 -0.03 0.00 0.00 56.01 52.88 2c44 n LEU 50 Cb 0.46 -0.74 0.16 0.00 -2.33 0.00 0.00 43.42 40.98 2c44 n LEU 50 CO 0.57 0.79 1.16 0.25 -1.33 0.00 0.00 177.39 178.83 2c44 h LEU 51 N 2.89 0.74 -7.01 2.23 5.85 -1.60 -2.46 115.31 115.95 2c44 h LEU 51 Ca 0.23 0.04 0.17 0.00 0.84 0.00 0.00 57.88 59.16 2c44 h LEU 51 Cb 2.30 -0.11 -0.17 0.00 0.37 0.00 0.00 40.66 43.05 2c44 h LEU 51 CO 0.71 0.44 0.63 0.28 -0.34 0.00 0.00 178.44 180.16 2c44 s THR 52 N -6.04 0.00 -2.69 1.05 -1.32 -1.26 -4.42 115.64 100.96 2c44 s THR 52 Ca -0.12 -0.01 0.24 0.00 -1.21 0.00 0.00 61.69 60.58 2c44 s THR 52 Cb 0.19 -1.03 0.33 0.00 -1.51 0.00 0.00 72.50 70.49 2c44 s THR 52 CO 0.79 0.00 1.37 -0.90 -2.21 0.00 0.00 174.62 173.66 2c44 n ASP 53 N -0.19 3.12 -4.57 8.08 5.75 -1.26 -4.49 116.55 122.99 2c44 n ASP 53 Ca -0.05 -1.97 -0.42 0.00 -0.01 0.00 0.00 54.79 52.35 2c44 n ASP 53 Cb 0.60 -0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.54 2c44 n ASP 53 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2c44 s SER 54 N -1.73 6.35 -0.43 -1.12 0.15 -1.26 -3.76 113.70 111.90 2c44 s SER 54 Ca 0.34 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.01 2c44 s SER 54 Cb 0.21 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2c44 s SER 54 CO 0.31 -1.59 0.00 0.61 1.20 0.00 0.00 173.24 173.77 2c44 n GLY 55 N 5.15 0.65 0.23 9.45 0.00 0.76 -4.89 105.19 116.55 2c44 n GLY 55 Ca 0.08 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.83 2c44 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c44 n THR 56 N -2.67 0.00 -2.08 2.61 -2.24 -1.25 -4.51 114.28 104.14 2c44 n THR 56 Ca -0.04 -0.40 -0.28 0.00 -2.27 0.00 0.00 64.05 61.06 2c44 n THR 56 Cb 0.24 1.12 0.19 0.00 -2.10 0.00 0.00 70.33 69.77 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 0.87 -1.03 3.92 3.38 0.00 -1.26 -4.81 105.19 106.27 2c44 n GLY 57 Ca 0.04 -1.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.02 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 3.22 0.35 4.61 0.00 -0.04 -4.86 121.76 121.24 2c44 s ALA 58 Ca 0.73 -0.82 0.07 0.00 0.00 0.00 0.00 51.96 51.94 2c44 s ALA 58 Cb -0.02 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.42 2c44 s ALA 58 CO 0.51 -1.09 -0.01 0.14 0.00 0.00 0.00 175.76 175.31 2c44 s VAL 59 N -3.14 1.77 0.38 0.00 -7.23 -1.26 -4.85 120.40 106.06 2c44 s VAL 59 Ca 0.58 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 2c44 s VAL 59 Cb -0.11 -2.79 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 2c44 s VAL 59 CO 0.45 -0.09 0.54 0.42 -0.31 0.00 0.00 175.10 176.11 2c44 s THR 60 N -2.89 4.06 0.20 5.32 -4.23 -1.26 -4.94 115.64 111.89 2c44 s THR 60 Ca 0.34 -0.81 -0.11 0.00 -1.18 0.00 0.00 61.69 59.93 2c44 s THR 60 Cb 0.07 -3.44 0.12 0.00 1.34 0.00 0.00 72.50 70.59 2c44 s THR 60 CO 0.16 -0.22 1.75 1.56 -0.54 0.00 0.00 174.62 177.33 2c44 h GLN 61 N 0.71 0.40 -0.99 3.99 4.20 -2.00 -0.93 115.11 120.48 2c44 h GLN 61 Ca -0.46 -0.02 0.11 0.00 0.06 0.00 0.00 58.65 58.33 2c44 h GLN 61 Cb 1.25 -0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.87 2c44 h GLN 61 CO 0.55 0.26 0.63 0.77 -0.67 0.00 0.00 178.83 180.36 2c44 h SER 62 N 0.41 0.94 -0.17 1.46 0.02 -1.98 0.31 113.55 114.54 2c44 h SER 62 Ca 0.27 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.22 2c44 h SER 62 Cb 0.30 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 2c44 h SER 62 CO -0.26 0.53 -0.06 0.24 -1.14 0.00 0.00 176.83 176.13 2c44 h MET 63 N 1.03 0.34 -0.49 3.45 2.86 -1.61 0.43 114.93 120.93 2c44 h MET 63 Ca 0.48 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.94 2c44 h MET 63 Cb 0.40 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2c44 h MET 63 CO -0.24 0.63 0.15 0.37 1.06 0.00 0.00 176.91 178.87 2c44 h GLN 64 N 0.03 0.73 -0.46 1.72 4.15 -0.53 -1.81 115.11 118.94 2c44 h GLN 64 Ca 0.04 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.26 2c44 h GLN 64 Cb 0.52 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 2c44 h GLN 64 CO 0.02 0.64 0.01 0.00 -1.93 0.00 0.00 178.83 177.57 2c44 h ALA 65 N 1.45 0.62 -0.78 3.38 0.00 -0.20 -2.86 119.26 120.88 2c44 h ALA 65 Ca 0.17 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2c44 h ALA 65 Cb 0.22 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2c44 h ALA 65 CO -0.01 0.42 0.51 0.00 0.00 0.00 0.00 179.25 180.17 2c44 h ALA 66 N 0.92 1.45 -0.00 0.00 0.00 -0.33 -0.83 119.26 120.47 2c44 h ALA 66 Ca 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c44 h ALA 66 Cb 0.49 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2c44 h ALA 66 CO 0.02 0.51 0.05 1.98 0.00 0.00 0.00 179.25 181.81 2c44 h MET 67 N 1.05 0.00 0.00 0.00 -1.53 -1.11 -1.91 114.93 111.43 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 -0.11 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 30.94 2c44 h MET 67 CO -0.06 0.00 -0.27 -1.33 0.14 0.00 0.00 176.91 175.39 2c44 n MET 68 N -3.12 0.03 -2.52 0.39 2.81 -0.32 -4.30 117.12 110.10 2c44 n MET 68 Ca -0.03 0.02 -0.21 0.00 -1.81 0.00 0.00 57.70 55.67 2c44 n MET 68 Cb 0.12 -1.53 0.01 0.00 -0.71 0.00 0.00 33.22 31.11 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 -1.58 2.76 -3.29 0.03 1.85 -0.72 -5.08 116.66 110.63 2c44 n ARG 69 Ca 0.06 -4.12 -0.32 0.00 -1.00 0.00 0.00 57.85 52.48 2c44 n ARG 69 Cb 0.35 -1.95 -0.05 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 2.22 -0.47 2.89 0.00 -1.26 -4.89 107.32 102.37 2c44 s GLY 70 Ca 0.42 -0.23 -0.15 0.00 0.00 0.00 0.00 44.72 44.76 2c44 s GLY 70 CO -0.11 -0.07 0.40 -0.35 0.00 0.00 0.00 173.10 172.96 2c44 s ASP 71 N -2.50 6.12 0.00 1.64 2.15 -1.26 -4.68 116.67 118.13 2c44 s ASP 71 Ca 0.49 -1.38 0.00 0.00 0.43 0.00 0.00 52.55 52.09 2c44 s ASP 71 Cb -0.11 -2.17 0.00 0.00 -0.30 0.00 0.00 42.92 40.34 2c44 s ASP 71 CO 0.22 -0.66 0.54 -0.62 -0.17 0.00 0.00 175.17 174.48 2c44 n GLU 72 N 5.19 0.89 -1.65 4.34 -0.58 -1.26 -4.30 120.64 123.26 2c44 n GLU 72 Ca -0.12 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.22 2c44 n GLU 72 Cb 0.43 -1.35 0.03 0.00 -0.57 0.00 0.00 31.44 29.98 2c44 n GLU 72 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2c44 n ALA 73 N -0.06 0.68 0.12 0.62 0.00 -1.26 -4.89 120.51 115.71 2c44 n ALA 73 Ca 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.57 2c44 n ALA 73 Cb 0.18 -2.18 0.09 0.00 0.00 0.00 0.00 19.45 17.54 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 1.32 0.00 -3.80 0.00 3.20 -1.99 -3.42 116.97 112.28 2c44 h TYR 74 Ca -0.48 0.00 -0.26 0.00 3.14 0.00 0.00 58.73 61.13 2c44 h TYR 74 Cb 1.33 0.00 -0.28 0.00 1.54 0.00 0.00 36.73 39.32 2c44 h TYR 74 CO 0.43 0.70 -0.73 -1.12 -1.64 0.00 0.00 178.16 175.79 2c44 s SER 75 N -6.72 0.23 -1.56 -2.11 0.01 -1.26 -4.75 113.70 97.53 2c44 s SER 75 Ca 0.00 -0.05 -0.01 0.00 1.31 0.00 0.00 55.95 57.20 2c44 s SER 75 Cb 0.11 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.32 2c44 s SER 75 CO 0.77 0.01 0.20 0.61 0.41 0.00 0.00 173.24 175.24 2c44 n GLY 76 N 2.99 -0.42 3.77 3.44 0.00 -1.26 -4.95 105.19 108.76 2c44 n GLY 76 Ca -0.13 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 2c44 n GLY 76 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2c44 n SER 77 N -1.83 3.77 0.27 1.61 2.88 -1.26 -4.87 113.62 114.19 2c44 n SER 77 Ca -0.18 1.23 0.15 0.00 -1.33 0.00 0.00 58.87 58.73 2c44 n SER 77 Cb 0.65 -1.62 0.72 0.00 -0.75 0.00 0.00 64.21 63.21 2c44 n SER 77 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2c44 h ARG 78 N 2.94 0.00 -0.10 -1.46 0.11 -1.92 -1.17 114.38 112.78 2c44 h ARG 78 Ca -0.51 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.47 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 0.64 0.09 -0.40 0.77 0.10 0.00 0.00 179.97 181.18 2c44 h SER 79 N 0.00 0.22 -0.21 0.08 0.02 -1.89 -1.23 113.55 110.55 2c44 h SER 79 Ca -0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 2c44 h SER 79 Cb 0.44 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2c44 h SER 79 CO 0.01 0.60 0.06 0.22 -1.14 0.00 0.00 176.83 176.59 2c44 h TYR 80 N 0.18 0.33 -0.25 3.45 3.20 -1.45 -2.09 116.97 120.35 2c44 h TYR 80 Ca 0.02 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 2c44 h TYR 80 Cb 0.78 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2c44 h TYR 80 CO 0.01 0.42 0.03 1.88 -1.64 0.00 0.00 178.16 178.86 2c44 h TYR 81 N 0.16 0.36 -0.33 -3.82 0.05 -1.32 0.12 116.97 112.19 2c44 h TYR 81 Ca 0.07 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 2c44 h TYR 81 Cb 0.24 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 2c44 h TYR 81 CO 0.00 0.35 0.11 0.00 -1.05 0.00 0.00 178.16 177.57 2c44 h ALA 82 N 1.69 0.43 -0.31 3.88 0.00 -0.89 0.88 119.26 124.93 2c44 h ALA 82 Ca 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2c44 h ALA 82 Cb 0.19 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2c44 h ALA 82 CO 0.00 0.05 0.11 1.25 0.00 0.00 0.00 179.25 180.67 2c44 h LEU 83 N 0.37 0.44 -0.98 0.00 5.85 -0.67 -2.03 115.31 118.28 2c44 h LEU 83 Ca 0.11 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.71 2c44 h LEU 83 Cb 0.23 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 2c44 h LEU 83 CO -0.01 0.50 0.63 0.00 -0.34 0.00 0.00 178.44 179.22 2c44 h ALA 84 N 0.96 1.36 -0.69 1.25 0.00 -0.55 -1.29 119.26 120.29 2c44 h ALA 84 Ca 0.10 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2c44 h ALA 84 Cb 0.20 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2c44 h ALA 84 CO -0.01 0.43 0.18 1.05 0.00 0.00 0.00 179.25 180.90 2c44 h GLU 85 N 1.16 1.10 -0.60 0.00 -0.00 -0.43 -0.38 114.58 115.43 2c44 h GLU 85 Ca 0.42 -0.26 -0.04 0.00 -0.00 0.00 0.00 59.36 59.49 2c44 h GLU 85 Cb 0.15 -0.15 -0.03 0.00 -0.00 0.00 0.00 28.75 28.73 2c44 h GLU 85 CO -0.17 0.97 0.23 0.77 -0.00 0.00 0.00 179.01 180.81 2c44 h SER 86 N 1.04 0.83 -0.50 3.06 0.02 -0.66 -1.00 113.55 116.33 2c44 h SER 86 Ca 0.22 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2c44 h SER 86 Cb 0.35 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 2c44 h SER 86 CO 0.00 0.78 0.19 0.58 -1.14 0.00 0.00 176.83 177.24 2c44 h VAL 87 N 0.83 1.22 -0.54 2.27 2.07 -0.91 -0.42 116.25 120.77 2c44 h VAL 87 Ca 0.20 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 2c44 h VAL 87 Cb 0.21 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2c44 h VAL 87 CO -0.01 0.26 0.29 0.11 0.02 0.00 0.00 177.57 178.23 2c44 h LYS 88 N 0.68 0.75 -0.21 1.57 6.56 -0.79 -0.52 116.57 124.61 2c44 h LYS 88 Ca 0.17 -0.09 -0.08 0.00 -1.06 0.00 0.00 60.65 59.59 2c44 h LYS 88 Cb 0.21 -0.15 -0.00 0.00 -0.57 0.00 0.00 32.23 31.72 2c44 h LYS 88 CO -0.01 0.58 -0.18 -0.91 -2.06 0.00 0.00 179.45 176.87 2c44 h ASN 89 N 0.72 0.53 0.04 0.86 2.35 -1.00 -0.74 115.58 118.34 2c44 h ASN 89 Ca 0.19 -0.46 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 2c44 h ASN 89 Cb 0.05 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2c44 h ASN 89 CO -0.03 0.88 -0.02 0.40 -1.65 0.00 0.00 177.43 177.01 2c44 h ILE 90 N 0.18 1.32 0.00 2.81 2.04 -1.04 -3.38 117.51 119.44 2c44 h ILE 90 Ca 0.04 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.27 2c44 h ILE 90 Cb 0.72 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 39.12 2c44 h ILE 90 CO 0.05 0.39 -1.49 0.49 0.00 0.00 0.00 178.15 177.58 2c44 n PHE 91 N -4.77 0.08 -1.10 1.37 3.72 -0.23 -3.95 117.46 112.58 2c44 n PHE 91 Ca -0.08 0.02 -0.03 0.00 -0.05 0.00 0.00 57.45 57.31 2c44 n PHE 91 Cb 0.33 -0.35 -0.01 0.00 -0.94 0.00 0.00 39.48 38.51 2c44 n PHE 91 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c44 n GLY 92 N 1.35 0.64 3.74 1.37 0.00 -0.28 -4.83 105.19 107.18 2c44 n GLY 92 Ca -0.00 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.12 3.50 -0.10 1.61 1.51 -1.24 -4.91 117.35 115.61 2c44 s TYR 93 Ca 0.00 0.67 0.14 0.00 -1.01 0.00 0.00 57.07 56.88 2c44 s TYR 93 Cb 0.00 -2.35 -0.06 0.00 -0.11 0.00 0.00 41.96 39.44 2c44 s TYR 93 CO 0.00 0.29 1.17 -0.56 -1.11 0.00 0.00 175.55 175.34 2c44 h GLN 94 N 6.41 0.00 -5.15 -0.62 3.07 -1.31 -3.25 115.11 114.26 2c44 h GLN 94 Ca -0.43 0.00 -0.65 0.00 0.09 0.00 0.00 58.65 57.67 2c44 h GLN 94 Cb 1.17 0.00 -0.24 0.00 0.08 0.00 0.00 27.48 28.50 2c44 h GLN 94 CO 0.73 0.50 -0.68 0.71 0.09 0.00 0.00 178.83 180.18 2c44 s TYR 95 N -2.89 3.00 -0.03 0.06 2.02 -0.84 -5.00 117.35 113.68 2c44 s TYR 95 Ca 0.01 -0.52 0.04 0.00 -0.37 0.00 0.00 57.07 56.23 2c44 s TYR 95 Cb 0.08 -2.05 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 2c44 s TYR 95 CO 0.78 -0.25 -0.16 0.99 -1.57 0.00 0.00 175.55 175.34 2c44 s THR 96 N 0.92 1.27 -0.14 -0.71 2.01 -1.26 -0.95 115.64 116.78 2c44 s THR 96 Ca 0.00 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.33 2c44 s THR 96 Cb -0.14 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.33 2c44 s THR 96 CO 0.01 0.37 0.01 -0.63 -0.69 0.00 0.00 174.62 173.69 2c44 s ILE 97 N -0.14 0.52 0.41 1.82 1.01 -0.22 -5.00 121.20 119.61 2c44 s ILE 97 Ca 0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 60.65 60.16 2c44 s ILE 97 Cb -0.09 -0.85 -0.10 0.00 0.01 0.00 0.00 42.46 41.43 2c44 s ILE 97 CO 0.01 0.02 0.97 -2.16 0.00 0.00 0.00 174.94 173.77 2c44 s PRO 98 N 1.89 4.24 0.10 2.79 0.04 -1.26 -1.23 135.00 141.56 2c44 s PRO 98 Ca 0.02 1.22 0.02 0.00 0.04 0.00 0.00 61.00 62.30 2c44 s PRO 98 Cb -0.15 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 2c44 s PRO 98 CO -0.07 -0.03 -0.08 0.95 0.04 0.00 0.00 177.00 177.82 2c44 s THR 99 N -2.01 0.76 0.40 1.26 -4.23 -0.82 -3.73 115.64 107.27 2c44 s THR 99 Ca 0.60 -1.78 0.11 0.00 -1.18 0.00 0.00 61.69 59.43 2c44 s THR 99 Cb -0.13 -1.50 0.17 0.00 1.34 0.00 0.00 72.50 72.38 2c44 s THR 99 CO 0.17 -0.74 1.93 1.12 -0.54 0.00 0.00 174.62 176.56 2c44 h HIS 100 N 3.25 0.20 -1.97 3.99 2.07 -1.50 0.15 115.15 121.34 2c44 h HIS 100 Ca -0.36 -0.02 0.05 0.00 -2.85 0.00 0.00 60.37 57.19 2c44 h HIS 100 Cb 1.18 -0.06 -0.01 0.00 2.57 0.00 0.00 27.41 31.09 2c44 h HIS 100 CO 0.61 0.33 0.21 0.00 -3.07 0.00 0.00 177.93 176.01 2c44 n GLN 101 N -4.29 0.25 -0.04 5.12 10.64 -1.26 -0.39 117.38 127.41 2c44 n GLN 101 Ca -0.01 -0.56 -0.04 0.00 -1.83 0.00 0.00 57.00 54.55 2c44 n GLN 101 Cb 0.26 0.76 -0.03 0.00 -0.86 0.00 0.00 30.24 30.37 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 0.72 -1.65 2.00 2.61 0.00 -1.77 -1.00 103.07 103.98 2c44 h GLY 102 Ca -0.10 0.80 0.00 0.00 0.00 0.00 0.00 47.33 48.03 2c44 h GLY 102 CO 0.14 -0.54 0.00 -0.96 0.00 0.00 0.00 176.54 175.17 2c44 n ARG 103 N -3.55 0.04 -0.01 4.80 1.85 -1.26 -0.58 116.66 117.95 2c44 n ARG 103 Ca -0.01 0.53 -0.16 0.00 -1.00 0.00 0.00 57.85 57.21 2c44 n ARG 103 Cb 0.11 -1.64 -0.06 0.00 -1.05 0.00 0.00 32.46 29.82 2c44 n ARG 103 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2c44 h GLY 104 N 0.10 0.82 1.45 2.89 0.00 -1.59 -2.57 103.07 104.17 2c44 h GLY 104 Ca 0.00 -1.16 -0.25 0.00 0.00 0.00 0.00 47.33 45.92 2c44 h GLY 104 CO 0.00 1.04 -1.04 0.00 0.00 0.00 0.00 176.54 176.54 2c44 h ALA 105 N 0.60 0.24 -0.29 3.60 0.00 -0.67 -3.31 119.26 119.43 2c44 h ALA 105 Ca -0.05 -0.73 -0.00 0.00 0.00 0.00 0.00 54.91 54.12 2c44 h ALA 105 Cb 1.40 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2c44 h ALA 105 CO 0.16 0.79 0.16 0.93 0.00 0.00 0.00 179.25 181.29 2c44 h GLU 106 N 0.25 0.40 0.00 0.00 5.08 -1.42 -1.56 114.58 117.33 2c44 h GLU 106 Ca -0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2c44 h GLU 106 Cb 1.69 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.86 2c44 h GLU 106 CO 0.19 0.34 0.00 0.00 -1.00 0.00 0.00 179.01 178.53 2c44 n GLN 107 N -4.83 0.13 -0.05 2.33 10.64 -0.97 -2.19 117.38 122.44 2c44 n GLN 107 Ca -0.02 0.14 -0.09 0.00 -1.83 0.00 0.00 57.00 55.20 2c44 n GLN 107 Cb 0.07 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 27.92 2c44 n GLN 107 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 2c44 n ILE 108 N -1.18 1.34 -0.06 -0.39 5.41 -0.67 -4.57 119.36 119.24 2c44 n ILE 108 Ca 0.04 0.13 -0.03 0.00 1.00 0.00 0.00 62.75 63.88 2c44 n ILE 108 Cb 0.04 -2.03 0.20 0.00 -0.71 0.00 0.00 39.64 37.14 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 -0.68 0.71 0.24 1.39 -0.00 -1.29 -2.70 116.97 114.65 2c44 h TYR 109 Ca -0.10 -0.10 0.00 0.00 -0.00 0.00 0.00 58.73 58.53 2c44 h TYR 109 Cb 0.83 -0.19 -0.01 0.00 -0.00 0.00 0.00 36.73 37.35 2c44 h TYR 109 CO -0.24 0.70 -0.21 0.82 -0.00 0.00 0.00 178.16 179.23 2c44 h ILE 110 N 0.62 0.54 -0.41 -0.90 2.04 -1.68 0.43 117.51 118.14 2c44 h ILE 110 Ca 0.12 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2c44 h ILE 110 Cb 0.47 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2c44 h ILE 110 CO 0.02 0.00 0.26 -0.65 0.00 0.00 0.00 178.15 177.78 2c44 h PRO 111 N -0.47 0.55 -0.04 2.37 0.11 -1.79 -1.58 132.00 131.15 2c44 h PRO 111 Ca -0.01 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.08 2c44 h PRO 111 Cb 0.43 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 2c44 h PRO 111 CO -0.03 0.39 -0.08 0.28 -0.21 0.00 0.00 178.00 178.35 2c44 h VAL 112 N 0.55 0.79 -0.75 3.15 2.07 -1.19 -1.65 116.25 119.21 2c44 h VAL 112 Ca 0.15 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.63 2c44 h VAL 112 Cb -0.02 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2c44 h VAL 112 CO -0.03 0.00 0.30 -0.07 0.02 0.00 0.00 177.57 177.79 2c44 h LEU 113 N -0.12 1.03 0.26 2.57 3.38 -0.04 -1.72 115.31 120.66 2c44 h LEU 113 Ca 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2c44 h LEU 113 Cb 0.18 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2c44 h LEU 113 CO -0.11 0.91 -0.12 0.40 0.09 0.00 0.00 178.44 179.61 2c44 h ILE 114 N 1.09 0.77 -0.89 1.22 2.04 -1.03 -2.38 117.51 118.33 2c44 h ILE 114 Ca 0.25 -0.14 0.11 0.00 1.00 0.00 0.00 64.86 66.09 2c44 h ILE 114 Cb 0.21 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 37.07 2c44 h ILE 114 CO -0.02 0.03 0.57 0.11 0.00 0.00 0.00 178.15 178.84 2c44 h LYS 115 N -0.41 0.80 0.49 2.37 1.57 -1.18 -1.86 116.57 118.35 2c44 h LYS 115 Ca -0.04 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2c44 h LYS 115 Cb 0.31 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2c44 h LYS 115 CO 0.06 0.53 -0.37 -0.22 -0.57 0.00 0.00 179.45 178.88 2c44 h LYS 116 N 0.82 -0.81 0.00 3.15 3.64 -0.82 0.25 116.57 122.80 2c44 h LYS 116 Ca 0.42 0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.82 2c44 h LYS 116 Cb 0.50 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2c44 h LYS 116 CO -0.19 -0.54 -0.16 -0.09 -2.27 0.00 0.00 179.45 176.20 2c44 h ARG 117 N -0.84 0.00 0.30 1.90 2.43 -1.20 0.15 114.38 117.11 2c44 h ARG 117 Ca -0.05 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2c44 h ARG 117 Cb 0.71 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2c44 h ARG 117 CO 0.01 0.16 -0.14 0.93 -1.51 0.00 0.00 179.97 179.42 2c44 h GLU 118 N 0.00 -0.38 0.00 0.20 5.08 -0.75 0.13 114.58 118.85 2c44 h GLU 118 Ca -0.00 0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 2c44 h GLU 118 Cb 0.41 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2c44 h GLU 118 CO 0.02 -0.10 -0.31 -0.56 -1.00 0.00 0.00 179.01 177.06 2c44 h GLN 119 N -0.65 0.00 0.01 2.33 -0.00 -0.55 -2.41 115.11 113.84 2c44 h GLN 119 Ca -0.04 0.00 -0.38 0.00 -0.00 0.00 0.00 58.65 58.23 2c44 h GLN 119 Cb 0.46 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.88 2c44 h GLN 119 CO 0.07 0.31 -2.40 -0.85 -0.00 0.00 0.00 178.83 175.96 2c44 n GLU 120 N -3.50 0.67 -0.02 0.06 0.28 0.50 -4.67 120.64 113.96 2c44 n GLU 120 Ca -0.00 0.13 0.01 0.00 -0.16 0.00 0.00 57.16 57.14 2c44 n GLU 120 Cb 0.47 -1.54 0.02 0.00 1.43 0.00 0.00 31.44 31.81 2c44 n GLU 120 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2c44 n LYS 121 N -3.17 2.37 -3.08 3.44 5.02 0.38 -5.00 118.16 118.12 2c44 n LYS 121 Ca -0.41 -1.50 -0.14 0.00 -2.02 0.00 0.00 58.31 54.24 2c44 n LYS 121 Cb 1.03 -0.99 0.04 0.00 -0.02 0.00 0.00 35.03 35.09 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 -0.54 0.04 3.67 0.72 0.00 -0.90 -4.89 105.19 103.29 2c44 n GLY 122 Ca 0.02 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 2c44 n GLY 122 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2c44 n LEU 123 N -3.07 4.42 -4.15 0.99 0.00 -0.83 -4.92 117.00 109.44 2c44 n LEU 123 Ca -0.01 0.88 -0.38 0.00 0.00 0.00 0.00 56.01 56.51 2c44 n LEU 123 Cb 0.54 -1.46 -0.10 0.00 0.00 0.00 0.00 43.42 42.40 2c44 n LEU 123 CO 0.37 -1.34 -0.05 -0.62 0.00 0.00 0.00 177.39 175.75 2c44 s ASP 124 N -1.12 5.44 0.44 1.96 -1.08 -1.26 -4.69 116.67 116.37 2c44 s ASP 124 Ca 0.74 -2.25 0.29 0.00 -0.52 0.00 0.00 52.55 50.81 2c44 s ASP 124 Cb -0.43 -1.90 1.38 0.00 -1.46 0.00 0.00 42.92 40.51 2c44 s ASP 124 CO 0.48 -0.54 1.66 0.03 0.52 0.00 0.00 175.17 177.32 2c44 h ARG 125 N 7.87 0.14 0.00 4.34 3.08 -1.94 0.96 114.38 128.82 2c44 h ARG 125 Ca -0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2c44 h ARG 125 Cb 1.03 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2c44 h ARG 125 CO 0.75 0.09 0.00 -1.13 -1.07 0.00 0.00 179.97 178.61 2c44 n SER 126 N -4.60 0.27 0.00 7.04 3.41 -1.26 -3.40 113.62 115.08 2c44 n SER 126 Ca 0.34 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.50 2c44 n SER 126 Cb 1.34 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 64.67 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 -1.78 1.42 -2.41 4.33 4.01 0.32 -5.09 118.16 118.96 2c44 n LYS 127 Ca 0.04 -0.97 -0.39 0.00 -0.51 0.00 0.00 58.31 56.48 2c44 n LYS 127 Cb 0.27 -0.77 -0.04 0.00 -0.51 0.00 0.00 35.03 33.98 2c44 n LYS 127 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2c44 s MET 128 N -0.49 4.42 -0.01 1.97 0.00 -0.25 -4.93 119.30 120.01 2c44 s MET 128 Ca 0.00 1.81 -0.00 0.00 0.00 0.00 0.00 55.69 57.50 2c44 s MET 128 Cb 0.00 -2.97 0.01 0.00 0.00 0.00 0.00 34.83 31.87 2c44 s MET 128 CO 0.00 0.01 0.02 0.08 0.00 0.00 0.00 175.02 175.13 2c44 s VAL 129 N -1.29 -0.03 0.08 5.16 1.01 -0.39 -2.77 120.40 122.17 2c44 s VAL 129 Ca 0.49 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.62 2c44 s VAL 129 Cb -0.31 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 2c44 s VAL 129 CO 0.40 0.04 -0.01 0.00 0.00 0.00 0.00 175.10 175.52 2c44 s ALA 130 N 0.47 3.25 0.26 5.51 0.00 0.00 -4.15 121.76 127.11 2c44 s ALA 130 Ca -0.04 -1.12 0.12 0.00 0.00 0.00 0.00 51.96 50.92 2c44 s ALA 130 Cb -0.06 -1.17 -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 -1.28 2.29 -0.07 0.00 0.40 -1.17 -1.52 117.98 116.63 2c44 s PHE 131 Ca 0.25 -0.34 -0.29 0.00 -0.60 0.00 0.00 56.93 55.94 2c44 s PHE 131 Cb -0.12 -1.02 0.11 0.00 0.51 0.00 0.00 43.02 42.50 2c44 s PHE 131 CO 0.17 0.67 0.88 0.45 0.70 0.00 0.00 175.22 178.09 2c44 s SER 132 N -3.34 -0.43 0.57 1.36 0.15 -1.08 -0.56 113.70 110.37 2c44 s SER 132 Ca 0.28 0.31 0.35 0.00 0.70 0.00 0.00 55.95 57.58 2c44 s SER 132 Cb -0.06 0.39 1.71 0.00 -1.71 0.00 0.00 66.02 66.35 2c44 s SER 132 CO 0.14 -0.52 2.13 -0.55 1.20 0.00 0.00 173.24 175.64 2c44 h ASN 133 N 2.42 0.00 0.00 5.45 -1.07 -1.82 0.45 115.58 121.02 2c44 h ASN 133 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.15 2c44 h ASN 133 Cb 1.19 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.44 2c44 h ASN 133 CO 0.33 0.05 0.00 0.00 0.07 0.00 0.00 177.43 177.87 2c44 n TYR 134 N -3.27 0.00 -2.36 4.14 4.19 -1.26 -3.78 117.16 114.82 2c44 n TYR 134 Ca -0.01 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 60.81 2c44 n TYR 134 Cb 0.22 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 40.02 2c44 n TYR 134 CO 0.00 0.00 0.00 -0.06 0.91 0.00 0.00 176.86 177.71 2c44 s PHE 135 N 0.00 3.19 0.67 2.98 0.08 -1.26 -4.70 117.98 118.95 2c44 s PHE 135 Ca 0.00 1.59 -0.11 0.00 0.12 0.00 0.00 56.93 58.53 2c44 s PHE 135 Cb 0.00 -3.35 -0.01 0.00 -0.57 0.00 0.00 43.02 39.09 2c44 s PHE 135 CO 0.00 -1.10 1.06 -0.59 -0.10 0.00 0.00 175.22 174.49 2c44 s PHE 136 N -1.39 3.38 0.23 0.36 -0.00 -1.26 -4.82 117.98 114.48 2c44 s PHE 136 Ca 0.54 1.24 -0.06 0.00 -0.00 0.00 0.00 56.93 58.65 2c44 s PHE 136 Cb -0.30 -2.88 0.36 0.00 -0.00 0.00 0.00 43.02 40.20 2c44 s PHE 136 CO 0.38 -1.02 1.79 0.38 -0.00 0.00 0.00 175.22 176.75 2c44 h ASP 137 N -0.56 0.54 0.36 1.98 -0.00 -1.96 -0.72 116.42 116.07 2c44 h ASP 137 Ca -0.44 0.06 -0.14 0.00 -0.00 0.00 0.00 57.03 56.50 2c44 h ASP 137 Cb 1.22 -0.04 -0.01 0.00 -0.00 0.00 0.00 39.33 40.49 2c44 h ASP 137 CO 0.61 0.31 -0.57 0.71 -0.00 0.00 0.00 179.24 180.30 2c44 h THR 138 N 0.67 1.38 -0.21 1.15 1.35 -1.98 0.33 112.91 115.59 2c44 h THR 138 Ca 0.37 -1.90 -0.06 0.00 -0.55 0.00 0.00 66.41 64.27 2c44 h THR 138 Cb 0.37 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.73 2c44 h THR 138 CO -0.26 0.56 -0.09 0.74 -0.25 0.00 0.00 175.52 176.22 2c44 h THR 139 N 0.17 1.30 -0.72 6.82 2.02 -1.79 -0.99 112.91 119.72 2c44 h THR 139 Ca -0.00 -1.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.02 2c44 h THR 139 Cb 1.05 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 69.03 2c44 h THR 139 CO 0.09 0.35 0.38 -0.61 0.37 0.00 0.00 175.52 176.10 2c44 h GLN 140 N 0.15 1.01 0.26 6.66 4.15 -1.06 -1.21 115.11 125.07 2c44 h GLN 140 Ca 0.05 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.34 2c44 h GLN 140 Cb 0.58 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 2c44 h GLN 140 CO 0.03 0.77 -0.18 0.78 -1.93 0.00 0.00 178.83 178.29 2c44 h GLY 141 N 1.00 -0.45 1.73 2.39 0.00 -0.71 -0.94 103.07 106.09 2c44 h GLY 141 Ca 0.25 0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.74 2c44 h GLY 141 CO -0.04 -0.18 -0.10 0.45 0.00 0.00 0.00 176.54 176.67 2c44 h HIS 142 N -0.44 0.35 0.46 5.60 3.86 -1.08 0.72 115.15 124.61 2c44 h HIS 142 Ca -0.02 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2c44 h HIS 142 Cb 0.38 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.76 2c44 h HIS 142 CO -0.11 0.43 -0.22 0.77 0.86 0.00 0.00 177.93 179.66 2c44 h SER 143 N 0.31 -0.52 -0.63 2.45 0.02 -0.94 -1.98 113.55 112.26 2c44 h SER 143 Ca 0.06 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2c44 h SER 143 Cb 0.37 0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 2c44 h SER 143 CO 0.02 -0.25 0.39 1.56 -1.14 0.00 0.00 176.83 177.41 2c44 h GLN 144 N -0.79 0.86 0.00 3.45 4.20 -0.97 0.10 115.11 121.96 2c44 h GLN 144 Ca -0.06 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 2c44 h GLN 144 Cb 0.55 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 2c44 h GLN 144 CO 0.10 0.61 -0.12 0.82 -0.67 0.00 0.00 178.83 179.57 2c44 h ILE 145 N 0.88 0.72 -0.46 2.54 2.04 -0.73 -0.28 117.51 122.22 2c44 h ILE 145 Ca 0.23 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2c44 h ILE 145 Cb -0.04 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2c44 h ILE 145 CO -0.04 0.12 0.00 0.59 0.00 0.00 0.00 178.15 178.82 2c44 n ASN 146 N -3.86 3.25 -0.37 1.72 3.02 -0.11 -4.91 115.26 114.00 2c44 n ASN 146 Ca -0.02 -2.23 -0.05 0.00 -0.03 0.00 0.00 54.58 52.25 2c44 n ASN 146 Cb 0.22 -0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 38.93 2c44 n ASN 146 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c44 n GLY 147 N 0.99 0.74 3.48 7.41 0.00 -0.11 -5.02 105.19 112.68 2c44 n GLY 147 Ca 0.18 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 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 0.75 4.46 0.22 0.00 2.01 -1.12 -2.73 115.64 119.23 2c44 s THR 149 Ca -0.00 1.33 0.11 0.00 0.31 0.00 0.00 61.69 63.44 2c44 s THR 149 Cb -0.14 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.66 2c44 s THR 149 CO 0.02 -0.53 -0.22 0.68 -0.69 0.00 0.00 174.62 173.88 2c44 s VAL 150 N -2.43 2.43 -0.09 3.82 -7.23 -1.26 -0.82 120.40 114.82 2c44 s VAL 150 Ca 0.60 -2.11 -0.04 0.00 -1.81 0.00 0.00 61.98 58.62 2c44 s VAL 150 Cb -0.10 -2.20 0.05 0.00 0.56 0.00 0.00 36.38 34.70 2c44 s VAL 150 CO 0.23 -0.19 0.18 -0.13 -0.31 0.00 0.00 175.10 174.88 2c44 s ARG 151 N -2.90 0.07 -0.28 4.82 0.52 -0.58 -4.91 118.95 115.69 2c44 s ARG 151 Ca 0.23 0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 55.83 2c44 s ARG 151 Cb -0.07 -0.22 -0.03 0.00 0.52 0.00 0.00 34.95 35.15 2c44 s ARG 151 CO 0.11 -0.27 0.45 -0.80 0.02 0.00 0.00 175.30 174.81 2c44 s ASN 152 N 2.06 6.33 -0.97 0.23 0.01 -1.26 -2.65 114.94 118.70 2c44 s ASN 152 Ca -0.00 0.35 -0.02 0.00 -0.71 0.00 0.00 52.86 52.48 2c44 s ASN 152 Cb -0.12 -2.25 0.28 0.00 0.41 0.00 0.00 41.25 39.58 2c44 s ASN 152 CO -0.06 -0.26 1.20 1.33 -1.51 0.00 0.00 177.10 177.79 2c44 n VAL 153 N 5.17 4.32 -2.69 1.60 0.24 0.15 -4.95 118.33 122.17 2c44 n VAL 153 Ca -0.06 -5.62 -0.25 0.00 -2.04 0.00 0.00 64.34 56.36 2c44 n VAL 153 Cb 0.50 -2.17 0.02 0.00 -1.47 0.00 0.00 33.84 30.72 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 -2.40 3.29 0.48 6.34 -0.85 -1.25 -0.61 117.35 122.36 2c44 s TYR 154 Ca 0.33 0.49 -0.10 0.00 -0.52 0.00 0.00 57.07 57.26 2c44 s TYR 154 Cb 0.04 -2.49 -0.05 0.00 0.38 0.00 0.00 41.96 39.84 2c44 s TYR 154 CO 0.03 -0.54 0.86 0.96 -1.52 0.00 0.00 175.55 175.34 2c44 s ILE 155 N -2.76 4.76 0.44 -3.49 -4.36 -1.25 -4.54 121.20 110.00 2c44 s ILE 155 Ca 0.50 0.66 0.22 0.00 -0.26 0.00 0.00 60.65 61.78 2c44 s ILE 155 Cb -0.10 -3.79 0.42 0.00 1.25 0.00 0.00 42.46 40.24 2c44 s ILE 155 CO 0.42 -0.75 1.82 0.07 0.24 0.00 0.00 174.94 176.73 2c44 h LYS 156 N 0.63 0.28 0.00 0.37 2.10 -1.97 -0.68 116.57 117.31 2c44 h LYS 156 Ca -0.46 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.12 2c44 h LYS 156 Cb 1.19 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.45 2c44 h LYS 156 CO 0.62 0.19 -0.25 0.93 -2.00 0.00 0.00 179.45 178.94 2c44 h GLU 157 N 0.29 0.00 -0.87 0.07 3.07 -1.95 -3.39 114.58 111.80 2c44 h GLU 157 Ca 0.53 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 59.48 2c44 h GLU 157 Cb 1.54 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 29.34 2c44 h GLU 157 CO -0.18 0.25 -0.50 0.00 -1.40 0.00 0.00 179.01 177.18 2c44 n ALA 158 N -2.17 -0.51 -1.15 3.43 0.00 -0.26 -1.79 120.51 118.06 2c44 n ALA 158 Ca 0.03 0.75 -0.13 0.00 0.00 0.00 0.00 53.44 54.09 2c44 n ALA 158 Cb 0.61 -0.15 0.25 0.00 0.00 0.00 0.00 19.45 20.16 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 -5.11 2.56 -3.24 0.00 3.01 -1.26 -4.80 117.46 108.63 2c44 n PHE 159 Ca 0.02 -1.49 -0.46 0.00 1.01 0.00 0.00 57.45 56.53 2c44 n PHE 159 Cb 0.24 -0.77 -0.03 0.00 -0.01 0.00 0.00 39.48 38.91 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 -1.29 6.62 0.00 4.37 -1.08 -0.74 -4.87 116.67 119.68 2c44 s ASP 160 Ca 0.55 -2.36 0.10 0.00 -0.52 0.00 0.00 52.55 50.32 2c44 s ASP 160 Cb 0.45 -2.25 0.50 0.00 -1.46 0.00 0.00 42.92 40.16 2c44 s ASP 160 CO 0.11 -0.74 1.27 0.35 0.52 0.00 0.00 175.17 176.68 2c44 n THR 161 N 4.53 0.96 1.00 1.71 -2.24 -1.26 -2.01 114.28 116.96 2c44 n THR 161 Ca 0.10 0.24 0.11 0.00 -2.27 0.00 0.00 64.05 62.23 2c44 n THR 161 Cb 0.46 -1.06 0.01 0.00 -2.10 0.00 0.00 70.33 67.63 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 -0.41 -1.07 3.36 3.38 0.00 -1.26 -4.63 105.19 104.56 2c44 n GLY 162 Ca 0.04 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 2c44 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c44 s VAL 163 N -2.99 2.18 0.10 1.61 1.01 -0.85 -5.13 120.40 116.33 2c44 s VAL 163 Ca 0.09 -1.57 -0.03 0.00 0.00 0.00 0.00 61.98 60.47 2c44 s VAL 163 Cb 0.17 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 2c44 s VAL 163 CO 0.81 0.22 0.30 -0.13 0.00 0.00 0.00 175.10 176.30 2c44 s ARG 164 N -1.65 3.54 -0.26 2.72 0.52 -1.26 -4.85 118.95 117.70 2c44 s ARG 164 Ca 0.13 -0.24 -0.22 0.00 -0.52 0.00 0.00 55.73 54.88 2c44 s ARG 164 Cb -0.10 -2.93 0.07 0.00 0.52 0.00 0.00 34.95 32.51 2c44 s ARG 164 CO 0.04 0.53 0.69 -0.47 0.02 0.00 0.00 175.30 176.11 2c44 s TYR 165 N -1.59 -0.84 0.37 -0.53 5.04 -1.26 -5.08 117.35 113.47 2c44 s TYR 165 Ca 0.38 1.93 0.04 0.00 -2.44 0.00 0.00 57.07 56.98 2c44 s TYR 165 Cb -0.13 0.35 0.71 0.00 0.35 0.00 0.00 41.96 43.25 2c44 s TYR 165 CO 0.26 -0.41 2.01 -0.44 -1.34 0.00 0.00 175.55 175.63 2c44 h ASP 166 N 5.56 0.60 -2.11 4.32 5.19 -1.98 -3.36 116.42 124.65 2c44 h ASP 166 Ca -0.29 -0.03 -0.57 0.00 -0.62 0.00 0.00 57.03 55.52 2c44 h ASP 166 Cb 1.18 -0.15 -0.39 0.00 0.18 0.00 0.00 39.33 40.15 2c44 h ASP 166 CO 0.09 0.47 -1.04 0.49 -3.12 0.00 0.00 179.24 176.13 2c44 n PHE 167 N -4.43 -0.18 0.50 4.55 3.01 -1.26 -4.70 117.46 114.95 2c44 n PHE 167 Ca 0.04 -3.56 0.06 0.00 1.01 0.00 0.00 57.45 55.01 2c44 n PHE 167 Cb 0.07 -0.24 0.28 0.00 -0.01 0.00 0.00 39.48 39.59 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 1.68 0.11 0.00 -1.08 5.02 -1.24 -1.94 118.16 120.71 2c44 n LYS 168 Ca 0.23 0.22 0.13 0.00 -2.02 0.00 0.00 58.31 56.87 2c44 n LYS 168 Cb 0.51 -1.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.40 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 -0.29 -0.54 3.58 0.72 0.00 -0.63 -4.42 105.19 103.61 2c44 n GLY 169 Ca 0.05 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.56 0.10 -4.82 1.61 3.02 -0.82 -4.71 115.26 109.08 2c44 n ASN 170 Ca 0.13 0.65 -0.33 0.00 -0.03 0.00 0.00 54.58 55.00 2c44 n ASN 170 Cb 0.35 -1.36 -0.06 0.00 -0.61 0.00 0.00 39.78 38.10 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 -1.85 3.26 -0.90 3.10 0.40 -1.26 -3.80 117.98 116.93 2c44 s PHE 171 Ca 0.71 1.58 -0.18 0.00 -0.60 0.00 0.00 56.93 58.44 2c44 s PHE 171 Cb -0.35 -2.89 0.14 0.00 0.51 0.00 0.00 43.02 40.44 2c44 s PHE 171 CO 0.52 -0.31 1.06 0.34 0.70 0.00 0.00 175.22 177.53 2c44 s ASP 172 N -2.29 6.62 0.18 1.36 -1.08 0.22 -4.75 116.67 116.94 2c44 s ASP 172 Ca 0.63 -2.09 -0.17 0.00 -0.52 0.00 0.00 52.55 50.39 2c44 s ASP 172 Cb -0.11 -2.37 0.13 0.00 -1.46 0.00 0.00 42.92 39.11 2c44 s ASP 172 CO 0.18 -1.01 1.64 -0.07 0.52 0.00 0.00 175.17 176.43 2c44 h LEU 173 N 10.06 -0.54 -0.12 -1.34 3.38 -1.93 0.29 115.31 125.10 2c44 h LEU 173 Ca 0.13 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2c44 h LEU 173 Cb 1.03 0.33 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2c44 h LEU 173 CO 1.06 -0.19 0.08 -0.33 0.09 0.00 0.00 178.44 179.15 2c44 h GLU 174 N -0.05 0.15 -0.78 1.13 5.08 -1.99 -1.72 114.58 116.39 2c44 h GLU 174 Ca 0.22 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.65 2c44 h GLU 174 Cb 0.39 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.53 2c44 h GLU 174 CO -0.49 0.10 0.45 0.78 -1.00 0.00 0.00 179.01 178.85 2c44 h GLY 175 N 0.16 1.20 0.97 -3.84 0.00 -1.72 0.92 103.07 100.74 2c44 h GLY 175 Ca 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2c44 h GLY 175 CO -0.02 0.15 0.22 -2.00 0.00 0.00 0.00 176.54 174.89 2c44 h LEU 176 N 0.78 0.53 -0.14 3.11 5.85 -0.06 0.11 115.31 125.49 2c44 h LEU 176 Ca 0.37 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2c44 h LEU 176 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2c44 h LEU 176 CO -0.22 0.49 0.03 -0.08 -0.34 0.00 0.00 178.44 178.31 2c44 h GLU 177 N 0.54 0.22 -0.62 1.25 4.81 -0.68 -0.74 114.58 119.36 2c44 h GLU 177 Ca 0.15 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2c44 h GLU 177 Cb 0.08 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 2c44 h GLU 177 CO -0.02 0.39 0.35 0.00 -0.73 0.00 0.00 179.01 179.00 2c44 h ARG 178 N 0.01 0.65 -0.42 1.92 3.08 -0.68 -0.98 114.38 117.96 2c44 h ARG 178 Ca 0.04 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2c44 h ARG 178 Cb 0.27 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2c44 h ARG 178 CO 0.00 0.43 0.25 0.78 -1.07 0.00 0.00 179.97 180.36 2c44 h GLY 179 N 0.67 0.61 1.26 0.04 0.00 -0.59 0.51 103.07 105.56 2c44 h GLY 179 Ca 0.27 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 2c44 h GLY 179 CO -0.15 0.25 0.22 -2.22 0.00 0.00 0.00 176.54 174.64 2c44 h ILE 180 N 0.55 1.23 -0.21 2.60 2.04 -0.64 -1.04 117.51 122.05 2c44 h ILE 180 Ca 0.15 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 2c44 h ILE 180 Cb 0.00 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2c44 h ILE 180 CO -0.03 0.30 -0.01 -0.33 0.00 0.00 0.00 178.15 178.08 2c44 h GLU 181 N 0.92 0.37 0.02 2.37 5.08 -0.77 0.19 114.58 122.77 2c44 h GLU 181 Ca 0.21 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 2c44 h GLU 181 Cb 0.22 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2c44 h GLU 181 CO -0.01 0.57 -0.14 1.49 -1.00 0.00 0.00 179.01 179.92 2c44 h GLU 182 N 0.13 -0.24 -0.02 2.33 4.81 -0.56 -3.05 114.58 117.99 2c44 h GLU 182 Ca 0.06 0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.15 2c44 h GLU 182 Cb 0.41 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 2c44 h GLU 182 CO 0.01 -0.16 -0.70 0.28 -0.73 0.00 0.00 179.01 177.71 2c44 h VAL 183 N -0.25 1.47 -0.15 0.32 2.07 -1.20 -3.50 116.25 115.02 2c44 h VAL 183 Ca 0.04 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.25 2c44 h VAL 183 Cb 0.30 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2c44 h VAL 183 CO -0.12 0.67 0.00 0.61 0.02 0.00 0.00 177.57 178.75 2c44 n GLY 184 N 0.47 0.59 0.55 2.17 0.00 0.66 -4.64 105.19 105.00 2c44 n GLY 184 Ca -0.02 -1.03 0.37 0.00 0.00 0.00 0.00 46.02 45.35 2c44 n GLY 184 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c44 h PRO 185 N 0.00 0.00 0.00 1.61 0.13 -1.83 0.28 132.00 132.18 2c44 h PRO 185 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2c44 h PRO 185 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2c44 h PRO 185 CO 0.00 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 176.86 2c44 h ASN 186 N 0.00 0.00 -0.71 1.44 2.35 -1.90 -3.03 115.58 113.73 2c44 h ASN 186 Ca 0.60 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.35 2c44 h ASN 186 Cb 2.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.88 2c44 h ASN 186 CO -0.01 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.36 2c44 n ASN 187 N -2.96 3.83 -4.20 5.81 3.02 0.98 -3.87 115.26 117.86 2c44 n ASN 187 Ca 0.01 -2.02 -0.40 0.00 -0.03 0.00 0.00 54.58 52.14 2c44 n ASN 187 Cb 0.33 -0.48 -0.09 0.00 -0.61 0.00 0.00 39.78 38.93 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 -1.09 4.12 0.39 2.41 1.01 -1.15 -1.27 120.40 124.83 2c44 s VAL 188 Ca 0.47 -1.94 0.18 0.00 0.00 0.00 0.00 61.98 60.69 2c44 s VAL 188 Cb 0.25 -3.72 0.17 0.00 0.00 0.00 0.00 36.38 33.09 2c44 s VAL 188 CO 0.32 -0.79 1.93 1.55 0.00 0.00 0.00 175.10 178.11 2c44 h PRO 189 N 8.26 0.00 -1.58 2.72 0.13 -1.86 -3.45 132.00 136.22 2c44 h PRO 189 Ca -0.17 0.00 0.25 0.00 -0.87 0.00 0.00 66.00 65.21 2c44 h PRO 189 Cb 1.06 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.02 2c44 h PRO 189 CO 0.83 0.25 0.77 1.52 -0.23 0.00 0.00 178.00 181.14 2c44 s TYR 190 N -4.28 -0.13 -0.08 1.56 -0.85 -1.26 -4.30 117.35 108.01 2c44 s TYR 190 Ca -0.03 0.05 0.03 0.00 -0.52 0.00 0.00 57.07 56.60 2c44 s TYR 190 Cb 0.14 0.53 0.00 0.00 0.38 0.00 0.00 41.96 43.02 2c44 s TYR 190 CO 0.68 -0.28 -0.19 0.42 -1.52 0.00 0.00 175.55 174.66 2c44 s ILE 191 N -2.52 1.67 -0.22 -3.49 1.01 -0.48 -3.02 121.20 114.15 2c44 s ILE 191 Ca 0.10 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 59.90 2c44 s ILE 191 Cb 0.00 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 2c44 s ILE 191 CO -0.05 0.47 0.03 -0.69 0.00 0.00 0.00 174.94 174.71 2c44 s VAL 192 N 0.45 4.09 -0.41 2.92 1.01 0.28 -0.77 120.40 127.97 2c44 s VAL 192 Ca -0.16 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.40 2c44 s VAL 192 Cb -0.17 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.35 2c44 s VAL 192 CO 0.07 0.39 0.35 0.00 0.00 0.00 0.00 175.10 175.90 2c44 s ALA 193 N 1.29 3.46 -0.69 5.51 0.00 0.50 -3.38 121.76 128.45 2c44 s ALA 193 Ca 0.04 -1.63 -0.21 0.00 0.00 0.00 0.00 51.96 50.16 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 0.02 -1.48 0.94 0.99 0.00 0.00 0.00 175.76 176.23 2c44 s THR 194 N 1.84 4.49 -0.62 0.00 2.01 -1.26 -0.30 115.64 121.80 2c44 s THR 194 Ca 0.08 -0.70 -0.26 0.00 0.31 0.00 0.00 61.69 61.12 2c44 s THR 194 Cb -0.18 -4.66 -0.04 0.00 0.01 0.00 0.00 72.50 67.63 2c44 s THR 194 CO 0.11 -1.40 2.02 -0.63 -0.69 0.00 0.00 174.62 174.03 2c44 s ILE 195 N 3.55 3.27 0.00 1.82 -1.09 -0.60 -2.95 121.20 125.21 2c44 s ILE 195 Ca 0.22 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.73 2c44 s ILE 195 Cb -0.16 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.02 2c44 s ILE 195 CO 0.06 -0.68 0.00 0.41 -1.23 0.00 0.00 174.94 173.50 2c44 n THR 196 N 7.52 -1.11 -2.15 2.92 -1.04 -1.26 -3.79 114.28 115.37 2c44 n THR 196 Ca 0.27 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.85 2c44 n THR 196 Cb 0.52 -1.41 -0.02 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 6.03 0.08 8.00 0.15 0.27 -4.81 113.70 123.42 2c44 s SER 197 Ca 0.00 1.02 -0.33 0.00 0.70 0.00 0.00 55.95 57.34 2c44 s SER 197 Cb 0.00 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 61.61 2c44 s SER 197 CO 0.00 -1.64 1.61 -1.13 1.20 0.00 0.00 173.24 173.27 2c44 h ASN 198 N 12.09 -0.98 0.18 5.45 -0.73 -1.87 0.10 115.58 129.83 2c44 h ASN 198 Ca -0.31 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 57.89 2c44 h ASN 198 Cb 1.14 0.29 -0.00 0.00 0.27 0.00 0.00 38.32 40.02 2c44 h ASN 198 CO 1.07 -0.59 -0.17 0.28 -0.37 0.00 0.00 177.43 177.66 2c44 h SER 199 N -0.92 0.00 0.67 1.15 0.02 -1.90 -0.58 113.55 111.98 2c44 h SER 199 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2c44 h SER 199 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 2c44 h SER 199 CO 0.05 0.17 0.00 0.00 -1.14 0.00 0.00 176.83 175.91 2c44 n ALA 200 N -2.49 1.71 0.00 3.77 0.00 -1.16 -4.82 120.51 117.53 2c44 n ALA 200 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2c44 n ALA 200 Cb 0.23 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 0.10 1.48 2.77 0.00 0.00 -0.26 -4.55 105.19 104.72 2c44 n GLY 201 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 2c44 n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c44 n GLY 202 N -0.22 -0.29 3.78 -0.02 0.00 0.32 -4.06 105.19 104.70 2c44 n GLY 202 Ca 0.00 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2c44 n GLY 202 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c44 s GLN 203 N -5.47 4.43 0.65 1.61 -1.52 -0.97 -2.09 119.66 116.31 2c44 s GLN 203 Ca 0.24 1.00 -0.14 0.00 -1.95 0.00 0.00 55.36 54.51 2c44 s GLN 203 Cb -0.11 -3.27 -0.01 0.00 -0.22 0.00 0.00 33.01 29.41 2c44 s GLN 203 CO 0.30 0.56 1.07 -1.25 -0.25 0.00 0.00 175.29 175.72 2c44 s PRO 204 N -0.99 2.99 -0.18 2.91 0.04 -1.26 -0.57 135.00 137.95 2c44 s PRO 204 Ca 0.34 1.16 -0.01 0.00 0.04 0.00 0.00 61.00 62.52 2c44 s PRO 204 Cb -0.21 -1.99 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 2c44 s PRO 204 CO 0.23 -1.07 -0.12 0.08 0.04 0.00 0.00 177.00 176.17 2c44 s VAL 205 N -2.66 2.89 0.65 -0.36 1.01 -1.26 -1.60 120.40 119.07 2c44 s VAL 205 Ca 0.62 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.77 2c44 s VAL 205 Cb -0.16 -2.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.96 2c44 s VAL 205 CO 0.45 0.49 1.12 -0.94 0.00 0.00 0.00 175.10 176.22 2c44 s SER 206 N 1.03 5.11 0.25 3.32 1.04 -1.26 -4.90 113.70 118.29 2c44 s SER 206 Ca -0.01 2.05 -0.00 0.00 0.48 0.00 0.00 55.95 58.47 2c44 s SER 206 Cb -0.15 -2.56 0.30 0.00 0.10 0.00 0.00 66.02 63.72 2c44 s SER 206 CO -0.02 -1.63 1.67 0.25 0.98 0.00 0.00 173.24 174.49 2c44 h LEU 207 N 0.14 0.59 -0.49 2.42 5.85 -1.97 -2.30 115.31 119.55 2c44 h LEU 207 Ca -0.47 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.03 2c44 h LEU 207 Cb 1.25 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 2c44 h LEU 207 CO 0.54 0.85 0.31 0.00 -0.34 0.00 0.00 178.44 179.80 2c44 h ALA 208 N 1.20 0.62 -0.83 1.25 0.00 -2.00 -1.25 119.26 118.25 2c44 h ALA 208 Ca 0.07 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2c44 h ALA 208 Cb 0.73 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2c44 h ALA 208 CO 0.06 0.10 0.55 -0.97 0.00 0.00 0.00 179.25 178.98 2c44 h ASN 209 N 0.66 0.95 -0.63 0.00 -0.73 -1.87 -1.46 115.58 112.50 2c44 h ASN 209 Ca 0.18 -0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.28 2c44 h ASN 209 Cb -0.04 -0.24 -0.03 0.00 0.27 0.00 0.00 38.32 38.29 2c44 h ASN 209 CO -0.04 0.69 0.22 -0.07 -0.37 0.00 0.00 177.43 177.86 2c44 h LEU 210 N 1.12 0.91 -0.22 0.34 3.38 -0.92 -0.01 115.31 119.90 2c44 h LEU 210 Ca 0.31 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c44 h LEU 210 Cb -0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.38 2c44 h LEU 210 CO -0.07 0.86 0.14 0.11 0.09 0.00 0.00 178.44 179.57 2c44 h LYS 211 N 0.90 0.28 -0.27 1.13 1.57 -0.66 0.10 116.57 119.63 2c44 h LYS 211 Ca 0.21 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2c44 h LYS 211 Cb 0.26 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2c44 h LYS 211 CO -0.01 0.19 0.18 0.00 -0.57 0.00 0.00 179.45 179.23 2c44 h ALA 212 N 1.09 0.34 -0.29 3.86 0.00 -1.07 -0.32 119.26 122.87 2c44 h ALA 212 Ca 0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2c44 h ALA 212 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2c44 h ALA 212 CO -0.03 -0.19 0.18 1.98 0.00 0.00 0.00 179.25 181.19 2c44 h MET 213 N 0.36 0.39 -0.29 0.00 1.85 -0.69 -1.57 114.93 114.98 2c44 h MET 213 Ca 0.10 -0.03 -0.04 0.00 -0.61 0.00 0.00 59.70 59.12 2c44 h MET 213 Cb -0.04 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 31.89 2c44 h MET 213 CO -0.02 0.30 0.02 -0.92 -0.40 0.00 0.00 176.91 175.89 2c44 h TYR 214 N 0.37 0.43 -0.44 1.39 3.20 -0.60 -1.07 116.97 120.25 2c44 h TYR 214 Ca 0.10 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 2c44 h TYR 214 Cb 0.00 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 2c44 h TYR 214 CO -0.04 0.42 0.19 1.03 -1.64 0.00 0.00 178.16 178.11 2c44 h SER 215 N 0.41 0.60 -0.49 -2.11 0.87 -0.44 0.21 113.55 112.60 2c44 h SER 215 Ca 0.10 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2c44 h SER 215 Cb 0.24 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 2c44 h SER 215 CO 0.00 0.59 0.21 0.40 -0.53 0.00 0.00 176.83 177.49 2c44 h ILE 216 N 0.57 1.21 -0.60 2.23 2.04 -0.60 -1.86 117.51 120.49 2c44 h ILE 216 Ca 0.15 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 2c44 h ILE 216 Cb 0.16 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2c44 h ILE 216 CO -0.01 0.24 0.29 0.00 0.00 0.00 0.00 178.15 178.66 2c44 h ALA 217 N 1.05 0.78 -0.80 1.87 0.00 -0.80 -2.42 119.26 118.94 2c44 h ALA 217 Ca 0.17 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2c44 h ALA 217 Cb 0.18 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2c44 h ALA 217 CO -0.02 0.34 0.52 1.57 0.00 0.00 0.00 179.25 181.67 2c44 h LYS 218 N 0.83 1.00 -0.59 0.00 -0.00 -0.35 0.15 116.57 117.61 2c44 h LYS 218 Ca 0.21 -0.06 0.11 0.00 -0.00 0.00 0.00 60.65 60.91 2c44 h LYS 218 Cb 0.12 -0.23 -0.09 0.00 -0.00 0.00 0.00 32.23 32.04 2c44 h LYS 218 CO -0.03 0.66 0.10 -0.22 -0.00 0.00 0.00 179.45 179.96 2c44 h LYS 219 N 1.03 0.21 -0.49 0.07 3.64 -0.85 -0.95 116.57 119.24 2c44 h LYS 219 Ca 0.31 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 2c44 h LYS 219 Cb -0.04 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2c44 h LYS 219 CO -0.09 0.14 0.00 0.66 -2.27 0.00 0.00 179.45 177.89 2c44 n TYR 220 N -5.16 0.64 -3.71 1.91 4.02 -0.88 -4.95 117.16 109.04 2c44 n TYR 220 Ca 0.09 -0.32 -0.24 0.00 -0.01 0.00 0.00 57.90 57.42 2c44 n TYR 220 Cb 0.32 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.69 2c44 n TYR 220 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2c44 n ASP 221 N 1.21 -3.47 -4.66 7.72 2.03 0.35 -4.94 116.55 114.79 2c44 n ASP 221 Ca 0.19 -0.72 -0.37 0.00 0.52 0.00 0.00 54.79 54.42 2c44 n ASP 221 Cb 0.51 -4.35 -0.09 0.00 -0.72 0.00 0.00 41.12 36.47 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 -3.44 5.35 0.29 5.18 1.01 -0.16 -5.01 121.20 124.42 2c44 s ILE 222 Ca 0.33 0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.88 2c44 s ILE 222 Cb -0.16 -3.51 -0.12 0.00 0.01 0.00 0.00 42.46 38.68 2c44 s ILE 222 CO 0.79 0.34 1.45 -2.65 0.00 0.00 0.00 174.94 174.87 2c44 n PRO 223 N 4.32 2.31 -3.97 2.79 -0.02 -1.26 -4.61 135.00 134.56 2c44 n PRO 223 Ca -0.15 0.82 -0.34 0.00 -2.02 0.00 0.00 63.50 61.81 2c44 n PRO 223 Cb 0.52 -2.51 -0.15 0.00 -0.02 0.00 0.00 33.50 31.35 2c44 n PRO 223 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c44 s VAL 224 N -0.30 2.97 -0.23 -1.45 1.01 -1.26 -1.38 120.40 119.76 2c44 s VAL 224 Ca 0.63 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 2c44 s VAL 224 Cb -0.57 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 2c44 s VAL 224 CO 0.53 0.42 0.05 -0.69 0.00 0.00 0.00 175.10 175.41 2c44 s VAL 225 N 1.41 4.31 -0.53 2.92 1.01 0.05 -0.83 120.40 128.75 2c44 s VAL 225 Ca 0.05 -0.18 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 2c44 s VAL 225 Cb -0.14 -2.99 0.06 0.00 0.00 0.00 0.00 36.38 33.30 2c44 s VAL 225 CO -0.06 0.38 0.73 -0.32 0.00 0.00 0.00 175.10 175.83 2c44 s MET 226 N 1.29 3.17 -0.38 2.72 1.75 -0.20 -0.37 119.30 127.27 2c44 s MET 226 Ca 0.05 -0.75 -0.29 0.00 -1.25 0.00 0.00 55.69 53.45 2c44 s MET 226 Cb -0.15 -4.10 0.00 0.00 2.84 0.00 0.00 34.83 33.42 2c44 s MET 226 CO 0.03 -1.35 1.45 0.34 -0.65 0.00 0.00 175.02 174.85 2c44 s ASP 227 N 2.85 6.32 -0.24 1.11 -1.08 0.59 -1.93 116.67 124.30 2c44 s ASP 227 Ca 0.19 0.96 0.14 0.00 -0.52 0.00 0.00 52.55 53.32 2c44 s ASP 227 Cb -0.18 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 39.41 2c44 s ASP 227 CO 0.13 -1.42 1.60 -1.20 0.52 0.00 0.00 175.17 174.81 2c44 n SER 228 N 8.84 4.54 -0.30 -0.34 7.64 -0.49 -1.55 113.62 131.96 2c44 n SER 228 Ca 0.17 -3.10 0.13 0.00 1.01 0.00 0.00 58.87 57.09 2c44 n SER 228 Cb 0.48 -0.64 0.30 0.00 -1.01 0.00 0.00 64.21 63.34 2c44 n SER 228 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2c44 h ALA 229 N 2.57 1.38 -1.37 -0.43 0.00 -1.80 -2.64 119.26 116.97 2c44 h ALA 229 Ca 0.07 0.18 -0.56 0.00 0.00 0.00 0.00 54.91 54.60 2c44 h ALA 229 Cb 1.81 0.21 -0.42 0.00 0.00 0.00 0.00 17.79 19.38 2c44 h ALA 229 CO 0.42 -0.39 -0.78 0.54 0.00 0.00 0.00 179.25 179.04 2c44 n ARG 230 N -5.11 3.24 -0.03 0.00 1.74 -1.25 -2.19 116.66 113.07 2c44 n ARG 230 Ca 0.22 -4.35 -0.00 0.00 -0.77 0.00 0.00 57.85 52.94 2c44 n ARG 230 Cb 0.66 -2.16 0.29 0.00 -1.02 0.00 0.00 32.46 30.23 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 2.57 0.60 -0.31 -1.55 -0.00 -1.63 -2.83 116.94 113.80 2c44 h PHE 231 Ca 0.27 -0.05 -0.04 0.00 -0.00 0.00 0.00 57.97 58.15 2c44 h PHE 231 Cb 1.02 -0.18 -0.01 0.00 -0.00 0.00 0.00 35.95 36.78 2c44 h PHE 231 CO 0.79 0.55 0.04 0.00 -0.00 0.00 0.00 178.31 179.70 2c44 h ALA 232 N 1.49 0.41 -0.72 12.09 0.00 -1.88 -1.21 119.26 129.45 2c44 h ALA 232 Ca 0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2c44 h ALA 232 Cb 0.29 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2c44 h ALA 232 CO 0.00 0.12 0.25 0.93 0.00 0.00 0.00 179.25 180.55 2c44 h GLU 233 N 0.34 1.09 -0.64 0.00 5.08 -1.89 -1.14 114.58 117.42 2c44 h GLU 233 Ca 0.09 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2c44 h GLU 233 Cb 0.36 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2c44 h GLU 233 CO 0.01 0.91 0.33 -0.97 -1.00 0.00 0.00 179.01 178.29 2c44 h ASN 234 N 1.06 0.81 -0.56 1.42 -1.24 -1.34 -1.27 115.58 114.46 2c44 h ASN 234 Ca 0.24 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.14 2c44 h ASN 234 Cb 0.25 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.07 2c44 h ASN 234 CO -0.01 0.69 0.36 0.00 -1.29 0.00 0.00 177.43 177.18 2c44 h ALA 235 N 1.15 1.58 -0.18 1.57 0.00 -0.52 -1.36 119.26 121.50 2c44 h ALA 235 Ca 0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2c44 h ALA 235 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2c44 h ALA 235 CO -0.03 0.38 0.01 -0.92 0.00 0.00 0.00 179.25 178.69 2c44 h TYR 236 N 0.77 0.34 -0.69 0.00 3.20 -0.24 -1.67 116.97 118.68 2c44 h TYR 236 Ca 0.21 -0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 2c44 h TYR 236 Cb -0.07 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 2c44 h TYR 236 CO 0.00 0.50 0.23 0.74 -1.64 0.00 0.00 178.16 177.99 2c44 h PHE 237 N 0.08 1.07 -0.43 -3.82 0.04 -0.85 -1.18 116.94 111.84 2c44 h PHE 237 Ca 0.05 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.73 2c44 h PHE 237 Cb 0.36 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 2c44 h PHE 237 CO 0.03 0.84 0.27 0.82 -0.60 0.00 0.00 178.31 179.67 2c44 h ILE 238 N 1.01 1.12 -0.06 -0.55 2.04 -1.16 0.25 117.51 120.17 2c44 h ILE 238 Ca 0.23 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 2c44 h ILE 238 Cb 0.26 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 2c44 h ILE 238 CO -0.01 0.12 -0.11 0.50 0.00 0.00 0.00 178.15 178.65 2c44 h LYS 239 N 0.57 0.09 0.00 2.37 3.64 -0.58 0.16 116.57 122.83 2c44 h LYS 239 Ca 0.16 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.37 2c44 h LYS 239 Cb -0.04 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2c44 h LYS 239 CO -0.03 0.20 -1.42 1.04 -2.27 0.00 0.00 179.45 176.97 2c44 n GLN 240 N -4.36 0.62 -0.02 1.90 1.13 -0.52 -4.00 117.38 112.13 2c44 n GLN 240 Ca -0.02 0.19 -0.01 0.00 -1.94 0.00 0.00 57.00 55.22 2c44 n GLN 240 Cb 0.21 -1.79 -0.05 0.00 0.11 0.00 0.00 30.24 28.71 2c44 n GLN 240 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2c44 n ARG 241 N -2.84 1.99 -3.15 -1.09 1.74 0.83 -4.92 116.66 109.23 2c44 n ARG 241 Ca -0.09 -0.02 -0.44 0.00 -0.77 0.00 0.00 57.85 56.52 2c44 n ARG 241 Cb 0.81 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 31.02 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 -2.28 3.07 0.20 5.56 2.12 0.55 -4.96 118.70 122.95 2c44 s GLU 242 Ca -0.03 -1.17 -0.05 0.00 0.36 0.00 0.00 54.97 54.08 2c44 s GLU 242 Cb 0.03 -4.20 0.33 0.00 0.26 0.00 0.00 34.13 30.56 2c44 s GLU 242 CO 0.28 -1.39 1.08 0.00 -0.54 0.00 0.00 175.26 174.69 2c44 n ALA 243 N 6.19 0.18 0.13 6.30 0.00 -1.26 -0.52 120.51 131.53 2c44 n ALA 243 Ca -0.09 0.76 0.04 0.00 0.00 0.00 0.00 53.44 54.16 2c44 n ALA 243 Cb 0.44 -0.46 0.21 0.00 0.00 0.00 0.00 19.45 19.64 2c44 n ALA 243 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2c44 n GLU 244 N -5.11 0.05 0.00 0.00 0.28 -1.26 -2.62 120.64 111.97 2c44 n GLU 244 Ca 0.11 0.50 0.00 0.00 -0.16 0.00 0.00 57.16 57.61 2c44 n GLU 244 Cb 0.36 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.60 2c44 n GLU 244 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2c44 n TYR 245 N -1.73 0.00 -0.35 -1.84 4.01 0.32 -4.79 117.16 112.79 2c44 n TYR 245 Ca 0.00 -0.35 0.24 0.00 -0.16 0.00 0.00 57.90 57.63 2c44 n TYR 245 Cb 0.04 -0.04 0.48 0.00 -0.31 0.00 0.00 39.34 39.52 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 0.00 0.34 -0.68 -0.72 6.56 -1.47 0.06 116.57 120.66 2c44 h LYS 246 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2c44 h LYS 246 Cb 0.52 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 2c44 h LYS 246 CO 0.00 0.22 0.00 -0.25 -2.06 0.00 0.00 179.45 177.36 2c44 n ASP 247 N -4.94 4.33 -4.91 0.86 8.00 -1.26 -4.90 116.55 113.73 2c44 n ASP 247 Ca 0.31 -2.27 -0.27 0.00 0.71 0.00 0.00 54.79 53.27 2c44 n ASP 247 Cb 0.98 -0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 41.54 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 -1.54 3.53 0.44 1.24 0.52 0.00 -5.08 118.94 118.06 2c44 s TRP 248 Ca 0.49 0.72 -0.04 0.00 0.02 0.00 0.00 56.10 57.29 2c44 s TRP 248 Cb 0.29 -2.21 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 2c44 s TRP 248 CO 0.27 -0.13 0.72 0.95 0.02 0.00 0.00 176.95 178.78 2c44 s THR 249 N -2.55 4.96 0.25 2.01 -4.23 -1.26 -4.89 115.64 109.93 2c44 s THR 249 Ca 0.46 0.02 -0.04 0.00 -1.18 0.00 0.00 61.69 60.94 2c44 s THR 249 Cb -0.10 -3.86 0.22 0.00 1.34 0.00 0.00 72.50 70.09 2c44 s THR 249 CO 0.40 -0.76 1.82 0.40 -0.54 0.00 0.00 174.62 175.94 2c44 h ILE 250 N 0.39 0.94 -0.54 2.99 1.08 -1.91 0.44 117.51 120.89 2c44 h ILE 250 Ca -0.48 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2c44 h ILE 250 Cb 1.21 0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 2c44 h ILE 250 CO 0.62 0.15 0.32 -0.33 -0.69 0.00 0.00 178.15 178.22 2c44 h GLU 251 N 0.85 0.74 -0.29 2.37 3.07 -1.93 -0.36 114.58 119.03 2c44 h GLU 251 Ca 0.40 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.36 59.14 2c44 h GLU 251 Cb 0.32 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 2c44 h GLU 251 CO -0.23 0.55 0.01 1.96 -1.40 0.00 0.00 179.01 179.90 2c44 h GLN 252 N 0.73 0.51 -0.91 2.33 4.20 -1.65 -1.81 115.11 118.50 2c44 h GLN 252 Ca 0.19 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2c44 h GLN 252 Cb 0.01 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 2c44 h GLN 252 CO -0.03 0.65 0.53 0.82 -0.67 0.00 0.00 178.83 180.13 2c44 h ILE 253 N 0.30 1.25 -0.12 2.54 2.04 -0.78 -1.49 117.51 121.26 2c44 h ILE 253 Ca 0.08 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2c44 h ILE 253 Cb 0.42 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2c44 h ILE 253 CO 0.01 0.27 0.04 0.74 0.00 0.00 0.00 178.15 179.21 2c44 h THR 254 N 1.26 1.18 -0.68 -0.27 2.02 -0.93 0.85 112.91 116.34 2c44 h THR 254 Ca 0.32 -0.55 0.08 0.00 0.77 0.00 0.00 66.41 67.03 2c44 h THR 254 Cb -0.03 1.33 -0.06 0.00 -1.74 0.00 0.00 68.15 67.64 2c44 h THR 254 CO -0.06 0.16 0.35 -0.09 0.37 0.00 0.00 175.52 176.25 2c44 h ARG 255 N 0.00 0.60 0.17 6.66 9.65 -1.06 -1.53 114.38 128.87 2c44 h ARG 255 Ca 0.04 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2c44 h ARG 255 Cb 0.22 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 2c44 h ARG 255 CO -0.00 0.40 -0.08 1.49 2.80 0.00 0.00 179.97 184.57 2c44 h GLU 256 N 0.62 -0.23 -0.71 0.20 4.57 -1.05 -3.15 114.58 114.83 2c44 h GLU 256 Ca 0.33 0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.68 2c44 h GLU 256 Cb 0.30 0.05 -0.12 0.00 -0.16 0.00 0.00 28.75 28.82 2c44 h GLU 256 CO -0.24 -0.01 0.04 1.15 -1.18 0.00 0.00 179.01 178.78 2c44 h THR 257 N -0.42 0.42 0.00 0.32 2.02 -0.28 -1.48 112.91 113.49 2c44 h THR 257 Ca -0.02 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2c44 h THR 257 Cb 0.32 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 2c44 h THR 257 CO 0.04 0.03 0.00 -1.22 0.37 0.00 0.00 175.52 174.73 2c44 n TYR 258 N -5.29 0.00 0.91 3.16 4.01 -0.63 -2.19 117.16 117.14 2c44 n TYR 258 Ca 0.12 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.99 2c44 n TYR 258 Cb 0.44 0.00 0.40 0.00 -0.31 0.00 0.00 39.34 39.87 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 -0.62 0.06 -1.70 -0.72 5.02 -0.56 -3.97 118.16 115.67 2c44 n LYS 259 Ca 0.04 0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 56.04 2c44 n LYS 259 Cb 0.02 -1.55 0.05 0.00 -0.02 0.00 0.00 35.03 33.53 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 -1.64 3.09 -3.48 2.13 4.01 -0.93 -4.93 117.16 115.40 2c44 n TYR 260 Ca 0.06 -2.72 -0.11 0.00 -0.16 0.00 0.00 57.90 54.97 2c44 n TYR 260 Cb 0.36 -1.01 -0.02 0.00 -0.31 0.00 0.00 39.34 38.36 2c44 n TYR 260 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2c44 s ALA 261 N -3.78 -1.52 -0.06 -0.72 0.00 -1.25 -4.68 121.76 109.74 2c44 s ALA 261 Ca 0.58 0.37 0.21 0.00 0.00 0.00 0.00 51.96 53.11 2c44 s ALA 261 Cb 0.46 0.88 -0.31 0.00 0.00 0.00 0.00 23.12 24.15 2c44 s ALA 261 CO -0.08 -0.80 0.40 -0.25 0.00 0.00 0.00 175.76 175.03 2c44 n ASP 262 N -0.38 0.15 -3.83 0.00 8.00 -0.01 -4.89 116.55 115.59 2c44 n ASP 262 Ca -0.15 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.27 2c44 n ASP 262 Cb 0.64 1.80 -0.02 0.00 -0.02 0.00 0.00 41.12 43.52 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 -3.30 1.75 0.02 -1.24 0.23 -1.07 -1.14 119.30 114.54 2c44 s MET 263 Ca -0.08 -0.95 0.02 0.00 -1.03 0.00 0.00 55.69 53.65 2c44 s MET 263 Cb 0.12 0.61 -0.01 0.00 -1.53 0.00 0.00 34.83 34.02 2c44 s MET 263 CO 0.87 -0.80 -0.08 -0.48 -2.03 0.00 0.00 175.02 172.50 2c44 s LEU 264 N -2.91 2.11 -0.11 0.18 0.05 0.92 -1.04 118.68 117.89 2c44 s LEU 264 Ca 0.10 -0.31 0.02 0.00 0.05 0.00 0.00 54.13 54.00 2c44 s LEU 264 Cb -0.06 -0.32 0.01 0.00 -2.05 0.00 0.00 46.19 43.78 2c44 s LEU 264 CO 0.05 -0.02 -0.16 0.00 -0.55 0.00 0.00 176.35 175.68 2c44 s ALA 265 N -0.65 1.73 0.00 1.48 0.00 -0.81 -0.90 121.76 122.61 2c44 s ALA 265 Ca -0.02 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2c44 s ALA 265 Cb -0.06 -0.82 -0.00 0.00 0.00 0.00 0.00 23.12 22.25 2c44 s ALA 265 CO 0.00 -0.02 -0.01 1.41 0.00 0.00 0.00 175.76 177.14 2c44 s MET 266 N 0.89 0.04 -0.67 0.00 0.00 0.76 -1.39 119.30 118.94 2c44 s MET 266 Ca -0.08 -0.03 -0.17 0.00 0.00 0.00 0.00 55.69 55.40 2c44 s MET 266 Cb -0.15 -0.03 0.14 0.00 0.00 0.00 0.00 34.83 34.79 2c44 s MET 266 CO -0.00 0.01 0.70 0.45 0.00 0.00 0.00 175.02 176.18 2c44 s SER 267 N -0.06 6.36 0.15 1.11 0.15 -1.26 -0.51 113.70 119.64 2c44 s SER 267 Ca -0.00 -1.88 0.12 0.00 0.70 0.00 0.00 55.95 54.88 2c44 s SER 267 Cb -0.00 -2.26 0.61 0.00 -1.71 0.00 0.00 66.02 62.65 2c44 s SER 267 CO -0.00 -0.92 1.37 0.00 1.20 0.00 0.00 173.24 174.90 2c44 n ALA 268 N 5.51 1.16 0.44 5.45 0.00 -0.10 -2.99 120.51 129.98 2c44 n ALA 268 Ca -0.02 0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.53 2c44 n ALA 268 Cb 0.43 -1.19 0.20 0.00 0.00 0.00 0.00 19.45 18.90 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 -1.86 0.22 0.00 0.00 5.02 -1.20 -3.39 118.16 116.95 2c44 n LYS 269 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2c44 n LYS 269 Cb 0.05 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2c44 n LYS 269 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2c44 n LYS 270 N -0.98 0.00 0.03 1.97 4.01 -1.16 -0.17 118.16 121.86 2c44 n LYS 270 Ca 0.05 0.00 0.10 0.00 -0.51 0.00 0.00 58.31 57.95 2c44 n LYS 270 Cb 0.02 0.00 0.54 0.00 -0.51 0.00 0.00 35.03 35.09 2c44 n LYS 270 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2c44 h ASP 271 N 0.00 0.25 0.40 4.39 5.19 -1.65 0.17 116.42 125.18 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 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.46 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 1.60 -1.42 3.45 0.00 -1.22 -4.34 120.51 116.05 2c44 n ALA 272 Ca 0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2c44 n ALA 272 Cb 0.25 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.47 -1.16 -3.85 0.00 2.81 0.61 -4.20 117.12 109.86 2c44 n MET 273 Ca 0.03 1.00 -0.31 0.00 -1.81 0.00 0.00 57.70 56.61 2c44 n MET 273 Cb 0.14 -5.18 -0.04 0.00 -0.71 0.00 0.00 33.22 27.43 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 -2.46 5.33 -0.76 2.03 -7.23 -1.23 -4.57 120.40 111.52 2c44 s VAL 274 Ca 0.00 -0.24 0.21 0.00 -1.81 0.00 0.00 61.98 60.13 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 1.63 -0.81 -0.31 0.00 0.00 175.10 175.75 2c44 n PRO 275 N 0.33 0.10 -3.63 4.82 -0.04 -1.26 -4.07 135.00 131.24 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 -1.68 -0.07 0.00 -0.04 0.00 0.00 33.50 32.22 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 -3.14 0.80 0.00 0.54 -2.45 -1.26 -4.63 119.30 109.16 2c44 s MET 276 Ca 0.07 1.00 0.00 0.00 -1.25 0.00 0.00 55.69 55.50 2c44 s MET 276 Cb 0.10 0.36 0.00 0.00 1.25 0.00 0.00 34.83 36.55 2c44 s MET 276 CO 0.37 -0.10 0.00 0.41 1.05 0.00 0.00 175.02 176.75 2c44 n GLY 277 N 2.86 4.47 3.52 2.11 0.00 0.48 -4.85 105.19 113.78 2c44 n GLY 277 Ca -0.15 -0.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 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 0.47 -0.03 -0.02 0.00 0.52 -0.92 107.32 107.33 2c44 s GLY 278 Ca 0.00 -0.82 -0.08 0.00 0.00 0.00 0.00 44.72 43.83 2c44 s GLY 278 CO 0.00 -0.64 0.18 1.08 0.00 0.00 0.00 173.10 173.72 2c44 s LEU 279 N -2.99 1.36 -0.23 0.66 1.43 0.33 -1.94 118.68 117.29 2c44 s LEU 279 Ca 0.20 0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2c44 s LEU 279 Cb 0.00 0.72 0.08 0.00 0.03 0.00 0.00 46.19 47.02 2c44 s LEU 279 CO 0.06 -0.24 0.07 -0.22 0.23 0.00 0.00 176.35 176.26 2c44 s LEU 280 N -0.69 1.18 0.05 1.79 2.96 -0.37 -0.17 118.68 123.44 2c44 s LEU 280 Ca -0.08 -1.06 0.05 0.00 -0.22 0.00 0.00 54.13 52.83 2c44 s LEU 280 Cb -0.05 -0.56 -0.02 0.00 0.50 0.00 0.00 46.19 46.06 2c44 s LEU 280 CO 0.01 -0.36 -0.15 0.00 -1.32 0.00 0.00 176.35 174.54 2c44 s MET 282 N -1.33 2.93 0.10 0.00 -1.94 -0.12 -0.06 119.30 118.88 2c44 s MET 282 Ca 0.01 -0.56 -0.28 0.00 -1.71 0.00 0.00 55.69 53.15 2c44 s MET 282 Cb -0.09 -2.63 -0.13 0.00 2.01 0.00 0.00 34.83 34.00 2c44 s MET 282 CO 0.02 0.56 1.66 -0.22 -0.01 0.00 0.00 175.02 177.02 2c44 h LYS 283 N 5.60 -0.48 0.00 2.03 3.64 -1.44 -2.21 116.57 123.72 2c44 h LYS 283 Ca -0.44 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 58.91 2c44 h LYS 283 Cb 1.18 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 2c44 h LYS 283 CO 0.54 -0.32 -0.01 -0.40 -2.27 0.00 0.00 179.45 176.99 2c44 n ASP 284 N -5.35 -0.48 -0.35 4.20 5.68 -1.26 -1.98 116.55 117.01 2c44 n ASP 284 Ca -0.09 -1.55 0.25 0.00 -0.50 0.00 0.00 54.79 52.90 2c44 n ASP 284 Cb 0.26 0.87 0.52 0.00 -1.14 0.00 0.00 41.12 41.62 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 0.60 0.44 0.00 -1.12 2.03 -2.00 -0.39 116.42 115.98 2c44 h ASP 285 Ca -0.09 0.11 0.00 0.00 -0.73 0.00 0.00 57.03 56.32 2c44 h ASP 285 Cb 0.36 0.05 0.00 0.00 -0.83 0.00 0.00 39.33 38.91 2c44 h ASP 285 CO 0.12 0.02 0.06 0.77 -1.03 0.00 0.00 179.24 179.18 2c44 h SER 286 N 0.35 0.00 -0.14 4.15 4.64 -2.00 0.67 113.55 121.22 2c44 h SER 286 Ca 0.65 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 2c44 h SER 286 Cb 1.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 2c44 h SER 286 CO -0.37 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.08 2c44 n PHE 287 N -2.75 0.40 -0.30 4.77 3.72 -0.16 -4.69 117.46 118.46 2c44 n PHE 287 Ca -0.02 -0.83 0.10 0.00 -0.05 0.00 0.00 57.45 56.64 2c44 n PHE 287 Cb 0.11 -0.18 0.32 0.00 -0.94 0.00 0.00 39.48 38.79 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 0.90 0.95 -0.47 1.38 3.57 -0.88 -1.56 116.94 120.83 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 1.07 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 2c44 h PHE 288 CO 0.21 0.36 0.20 -0.44 -2.23 0.00 0.00 178.31 176.41 2c44 h ASP 289 N 0.82 0.65 0.30 0.41 3.32 -1.83 -0.71 116.42 119.37 2c44 h ASP 289 Ca 0.46 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.27 2c44 h ASP 289 Cb 0.61 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2c44 h ASP 289 CO -0.23 0.63 -0.37 -0.37 -1.72 0.00 0.00 179.24 177.19 2c44 h VAL 290 N 0.62 1.28 0.43 -1.35 -1.51 -1.74 -1.09 116.25 112.89 2c44 h VAL 290 Ca 0.16 -1.34 -0.02 0.00 -1.23 0.00 0.00 66.70 64.27 2c44 h VAL 290 Cb 0.18 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2c44 h VAL 290 CO -0.01 0.39 -0.20 0.22 -1.23 0.00 0.00 177.57 176.73 2c44 h TYR 291 N 0.09 -0.53 0.00 5.19 5.03 -0.60 0.31 116.97 126.46 2c44 h TYR 291 Ca 0.01 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.25 2c44 h TYR 291 Cb 0.70 0.18 -0.01 0.00 1.55 0.00 0.00 36.73 39.14 2c44 h TYR 291 CO 0.01 -0.32 -0.26 1.79 -1.32 0.00 0.00 178.16 178.06 2c44 h THR 292 N -0.59 0.87 -0.25 1.81 1.35 -0.97 -0.61 112.91 114.52 2c44 h THR 292 Ca -0.06 -1.00 -0.14 0.00 -0.55 0.00 0.00 66.41 64.66 2c44 h THR 292 Cb 0.45 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.46 2c44 h THR 292 CO 0.10 0.25 -0.43 -0.33 -0.25 0.00 0.00 175.52 174.86 2c44 h GLU 293 N 0.00 0.61 0.00 4.72 4.39 -0.71 -2.39 114.58 121.20 2c44 h GLU 293 Ca -0.00 -0.33 -0.12 0.00 0.34 0.00 0.00 59.36 59.25 2c44 h GLU 293 Cb 0.57 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2c44 h GLU 293 CO 0.03 0.92 -0.57 0.00 -1.16 0.00 0.00 179.01 178.24 2c44 h ARG 295 N 0.00 0.66 -0.33 0.00 3.08 -0.81 0.94 114.38 117.92 2c44 h ARG 295 Ca -0.01 -0.26 -0.07 0.00 0.07 0.00 0.00 59.98 59.71 2c44 h ARG 295 Cb 1.02 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 2c44 h ARG 295 CO 0.07 0.84 -0.07 1.15 -1.07 0.00 0.00 179.97 180.89 2c44 h THR 296 N 0.58 1.28 0.00 2.04 2.02 -1.16 -2.72 112.91 114.94 2c44 h THR 296 Ca 0.08 -1.11 -0.11 0.00 0.77 0.00 0.00 66.41 66.04 2c44 h THR 296 Cb 0.70 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2c44 h THR 296 CO 0.05 0.36 -0.53 0.25 0.37 0.00 0.00 175.52 176.03 2c44 h LEU 297 N 0.42 0.00 -0.65 2.58 5.85 -1.29 -3.15 115.31 119.07 2c44 h LEU 297 Ca 0.09 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.71 2c44 h LEU 297 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2c44 h LEU 297 CO 0.03 0.53 -0.04 0.00 -0.34 0.00 0.00 178.44 178.62 2c44 h VAL 299 N 0.91 0.97 0.07 0.00 2.07 -1.44 0.27 116.25 119.11 2c44 h VAL 299 Ca 0.16 -0.21 -0.13 0.00 0.82 0.00 0.00 66.70 67.34 2c44 h VAL 299 Cb 0.59 0.30 0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2c44 h VAL 299 CO 0.04 0.11 -0.54 0.58 0.02 0.00 0.00 177.57 177.78 2c44 h VAL 300 N 0.61 1.57 0.06 2.57 2.07 -1.51 -3.35 116.25 118.27 2c44 h VAL 300 Ca 0.30 -2.36 -0.30 0.00 0.82 0.00 0.00 66.70 65.16 2c44 h VAL 300 Cb 0.38 3.12 -0.03 0.00 -1.52 0.00 0.00 31.29 33.23 2c44 h VAL 300 CO -0.10 0.66 -1.59 1.56 0.02 0.00 0.00 177.57 178.12 2c44 h GLN 301 N -0.49 0.12 0.00 1.57 1.08 -1.01 -3.45 115.11 112.93 2c44 h GLN 301 Ca -0.09 -0.21 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 2c44 h GLN 301 Cb 1.38 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.89 2c44 h GLN 301 CO 0.10 0.87 -0.96 0.39 -0.95 0.00 0.00 178.83 178.28 2c44 n GLU 302 N -3.28 0.00 -2.20 1.46 -0.58 0.79 -5.08 120.64 111.75 2c44 n GLU 302 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2c44 n GLU 302 Cb 1.03 -0.70 0.00 0.00 -0.57 0.00 0.00 31.44 31.20 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 3.15 -0.91 3.66 0.62 0.00 -0.24 -3.51 105.19 107.95 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 1.66 1.96 0.08 1.61 7.35 -1.26 -3.21 117.46 125.64 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 0.02 0.00 0.35 0.00 0.00 39.48 37.47 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 1.21 0.04 -0.16 -7.13 -0.04 -1.26 -0.00 135.00 127.66 2c44 n PRO 305 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 2c44 n PRO 305 Cb 0.33 -1.32 0.18 0.00 -0.04 0.00 0.00 33.50 32.65 2c44 n PRO 305 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c44 n THR 306 N -0.82 0.49 0.00 0.52 -2.24 -1.26 -4.26 114.28 106.71 2c44 n THR 306 Ca 0.01 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 2c44 n THR 306 Cb 0.00 0.97 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 2c44 n THR 306 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c44 n TYR 307 N 1.23 0.00 -3.78 4.78 4.11 -0.85 -4.54 117.16 118.10 2c44 n TYR 307 Ca 0.16 0.00 -0.25 0.00 -0.00 0.00 0.00 57.90 57.81 2c44 n TYR 307 Cb 0.53 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.81 2c44 n TYR 307 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2c44 n GLY 308 N 0.05 -0.15 0.80 -7.48 0.00 1.00 -0.19 105.19 99.21 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 -1.74 0.79 3.38 -0.02 0.00 -1.23 -1.53 105.19 104.83 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 2.40 0.65 0.99 1.43 0.73 -4.46 118.68 120.42 2c44 s LEU 310 Ca 0.00 -0.35 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 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 0.30 1.05 -1.83 0.23 0.00 0.00 176.35 176.10 2c44 s GLU 311 N -0.48 3.16 0.19 1.70 -1.05 -1.26 -4.79 118.70 116.17 2c44 s GLU 311 Ca 0.06 0.99 -0.20 0.00 -0.15 0.00 0.00 54.97 55.67 2c44 s GLU 311 Cb -0.12 -2.02 0.14 0.00 -0.44 0.00 0.00 34.13 31.70 2c44 s GLU 311 CO 0.01 -0.93 1.59 0.78 0.95 0.00 0.00 175.26 177.66 2c44 h GLY 312 N -0.30 -0.05 0.97 -3.83 0.00 -1.91 0.10 103.07 98.07 2c44 h GLY 312 Ca -0.45 0.41 0.09 0.00 0.00 0.00 0.00 47.33 47.38 2c44 h GLY 312 CO 0.58 -0.21 0.47 -1.33 0.00 0.00 0.00 176.54 176.04 2c44 h GLY 313 N -0.15 0.87 1.67 4.60 0.00 -1.83 -0.92 103.07 107.32 2c44 h GLY 313 Ca 0.24 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 2c44 h GLY 313 CO -0.68 0.17 -0.05 0.00 0.00 0.00 0.00 176.54 175.98 2c44 h ALA 314 N 1.63 1.43 -0.02 3.60 0.00 -1.29 0.97 119.26 125.58 2c44 h ALA 314 Ca 0.32 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 2c44 h ALA 314 Cb 0.41 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2c44 h ALA 314 CO -0.11 0.40 -0.92 0.52 0.00 0.00 0.00 179.25 179.14 2c44 h MET 315 N 0.39 0.47 -0.54 0.00 2.86 -0.77 -1.50 114.93 115.85 2c44 h MET 315 Ca 0.08 -0.48 -0.08 0.00 -2.06 0.00 0.00 59.70 57.16 2c44 h MET 315 Cb 0.34 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 2c44 h MET 315 CO 0.01 1.13 0.03 0.93 1.06 0.00 0.00 176.91 180.08 2c44 h GLU 316 N 0.28 0.93 -0.65 1.72 4.39 -0.95 -0.71 114.58 119.59 2c44 h GLU 316 Ca -0.08 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 2c44 h GLU 316 Cb 1.55 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 30.08 2c44 h GLU 316 CO 0.16 0.93 0.29 -0.09 -1.16 0.00 0.00 179.01 179.14 2c44 h ARG 317 N 0.81 0.96 -0.38 2.33 2.43 -0.77 -2.72 114.38 117.05 2c44 h ARG 317 Ca 0.16 -0.16 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 2c44 h ARG 317 Cb 0.49 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 2c44 h ARG 317 CO 0.02 0.79 -0.27 1.25 -1.51 0.00 0.00 179.97 180.24 2c44 h LEU 318 N 0.91 0.82 -1.93 3.80 5.85 -1.06 0.21 115.31 123.91 2c44 h LEU 318 Ca 0.22 -0.32 0.10 0.00 0.84 0.00 0.00 57.88 58.73 2c44 h LEU 318 Cb 0.16 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2c44 h LEU 318 CO -0.02 1.04 0.28 0.00 -0.34 0.00 0.00 178.44 179.40 2c44 h ALA 319 N 1.01 2.27 0.15 1.25 0.00 -0.83 -1.55 119.26 121.57 2c44 h ALA 319 Ca 0.08 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 319 Cb 0.80 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2c44 h ALA 319 CO 0.07 -0.38 -1.82 0.28 0.00 0.00 0.00 179.25 177.40 2c44 h VAL 320 N 0.08 0.81 -0.92 0.00 2.07 -1.18 -3.38 116.25 113.73 2c44 h VAL 320 Ca 0.19 -2.42 0.04 0.00 0.82 0.00 0.00 66.70 65.32 2c44 h VAL 320 Cb 0.65 2.65 -0.06 0.00 -1.52 0.00 0.00 31.29 33.01 2c44 h VAL 320 CO -0.02 0.86 0.60 1.23 0.02 0.00 0.00 177.57 180.26 2c44 h GLY 321 N 0.75 1.36 0.66 2.17 0.00 -0.28 -1.30 103.07 106.44 2c44 h GLY 321 Ca -0.37 -0.45 0.18 0.00 0.00 0.00 0.00 47.33 46.69 2c44 h GLY 321 CO 0.12 0.37 0.49 1.41 0.00 0.00 0.00 176.54 178.93 2c44 h LEU 322 N 1.14 0.14 0.00 3.11 3.38 -1.47 0.10 115.31 121.71 2c44 h LEU 322 Ca 0.38 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.31 2c44 h LEU 322 Cb 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2c44 h LEU 322 CO -0.13 0.07 -0.42 1.88 0.09 0.00 0.00 178.44 179.93 2c44 h TYR 323 N 0.15 0.00 -0.81 1.13 0.05 -1.49 -3.36 116.97 112.64 2c44 h TYR 323 Ca 0.34 0.00 0.18 0.00 0.05 0.00 0.00 58.73 59.30 2c44 h TYR 323 Cb 1.13 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.81 2c44 h TYR 323 CO -0.00 0.49 0.54 -0.44 -1.05 0.00 0.00 178.16 177.70 2c44 h ASP 324 N -1.00 0.34 0.69 3.88 5.19 -1.01 0.13 116.42 124.65 2c44 h ASP 324 Ca -0.07 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2c44 h ASP 324 Cb 0.61 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.08 2c44 h ASP 324 CO -0.04 0.16 0.00 0.61 -3.12 0.00 0.00 179.24 176.85 2c44 n GLY 325 N -1.54 -1.26 0.60 2.75 0.00 0.34 -2.63 105.19 103.45 2c44 n GLY 325 Ca 0.16 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.40 2c44 n GLY 325 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c44 n MET 326 N -2.24 1.68 -1.68 1.61 2.81 0.47 -4.79 117.12 114.97 2c44 n MET 326 Ca 0.02 -1.20 -0.45 0.00 -1.81 0.00 0.00 57.70 54.26 2c44 n MET 326 Cb 0.22 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.22 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 0.39 3.50 -0.18 7.83 2.85 -1.08 -4.78 115.26 123.79 2c44 n ASN 327 Ca 0.15 1.05 -0.08 0.00 -0.11 0.00 0.00 54.58 55.59 2c44 n ASN 327 Cb 0.45 -1.47 0.02 0.00 1.24 0.00 0.00 39.78 40.01 2c44 n ASN 327 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2c44 h LEU 328 N 6.97 0.70 -0.85 1.20 5.85 -1.92 -1.10 115.31 126.15 2c44 h LEU 328 Ca -0.45 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.09 2c44 h LEU 328 Cb 1.24 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2c44 h LEU 328 CO 0.92 0.64 0.39 0.44 -0.34 0.00 0.00 178.44 180.49 2c44 h ASP 329 N 0.70 1.11 0.84 1.25 3.45 -1.99 -1.03 116.42 120.75 2c44 h ASP 329 Ca 0.18 -0.14 -0.04 0.00 0.43 0.00 0.00 57.03 57.45 2c44 h ASP 329 Cb 0.14 -0.29 0.01 0.00 -0.56 0.00 0.00 39.33 38.63 2c44 h ASP 329 CO -0.02 0.95 -0.40 -0.25 -1.57 0.00 0.00 179.24 177.95 2c44 h TRP 330 N 1.21 -1.04 -0.77 4.55 2.91 -1.87 -1.82 115.95 119.11 2c44 h TRP 330 Ca 0.29 -0.02 0.12 0.00 1.13 0.00 0.00 58.89 60.40 2c44 h TRP 330 Cb 0.14 0.34 -0.08 0.00 -0.51 0.00 0.00 29.16 29.05 2c44 h TRP 330 CO 0.02 -0.64 0.38 -0.07 -1.03 0.00 0.00 178.44 177.09 2c44 h LEU 331 N -1.15 0.46 -0.70 0.65 3.38 -1.06 0.11 115.31 117.00 2c44 h LEU 331 Ca -0.11 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2c44 h LEU 331 Cb 0.86 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 2c44 h LEU 331 CO 0.19 0.23 0.44 0.00 0.09 0.00 0.00 178.44 179.38 2c44 h ALA 332 N 1.50 0.89 0.37 1.53 0.00 -1.12 -1.44 119.26 120.98 2c44 h ALA 332 Ca 0.40 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2c44 h ALA 332 Cb 0.51 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2c44 h ALA 332 CO -0.32 0.34 -0.18 -0.92 0.00 0.00 0.00 179.25 178.16 2c44 h TYR 333 N 0.95 -0.46 -0.18 0.00 3.20 -0.26 -1.36 116.97 118.85 2c44 h TYR 333 Ca 0.25 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.16 2c44 h TYR 333 Cb -0.06 0.15 -0.07 0.00 1.54 0.00 0.00 36.73 38.29 2c44 h TYR 333 CO -0.02 -0.16 -0.30 -0.09 -1.64 0.00 0.00 178.16 175.96 2c44 h ARG 334 N -0.76 -0.33 0.00 1.82 1.12 -0.75 -1.05 114.38 114.43 2c44 h ARG 334 Ca -0.05 0.02 -0.06 0.00 -1.11 0.00 0.00 59.98 58.78 2c44 h ARG 334 Cb 0.51 0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.54 2c44 h ARG 334 CO 0.08 -0.22 -0.28 0.82 -3.11 0.00 0.00 179.97 177.27 2c44 h ILE 335 N -0.34 1.17 -0.14 1.20 2.04 -1.33 -2.38 117.51 117.74 2c44 h ILE 335 Ca 0.11 -0.96 -0.13 0.00 1.00 0.00 0.00 64.86 64.88 2c44 h ILE 335 Cb 0.52 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 2c44 h ILE 335 CO -0.37 0.27 -0.48 0.00 0.00 0.00 0.00 178.15 177.57 2c44 h ALA 336 N 1.72 0.91 -0.36 1.87 0.00 -0.45 -1.95 119.26 121.01 2c44 h ALA 336 Ca -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 2c44 h ALA 336 Cb 0.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2c44 h ALA 336 CO 0.04 0.65 0.11 0.37 0.00 0.00 0.00 179.25 180.43 2c44 h GLN 337 N 0.29 0.55 -0.64 0.00 4.15 -0.69 -0.45 115.11 118.33 2c44 h GLN 337 Ca 0.02 -0.12 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 2c44 h GLN 337 Cb 0.96 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.54 2c44 h GLN 337 CO 0.08 0.57 0.35 0.28 -1.93 0.00 0.00 178.83 178.18 2c44 h VAL 338 N 0.43 1.20 -0.71 2.39 2.07 -1.40 -1.69 116.25 118.54 2c44 h VAL 338 Ca 0.12 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.15 2c44 h VAL 338 Cb 0.25 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 2c44 h VAL 338 CO -0.00 0.22 0.44 -0.61 0.02 0.00 0.00 177.57 177.64 2c44 h GLN 339 N 0.87 0.83 -0.40 1.57 5.75 -1.07 -0.61 115.11 122.04 2c44 h GLN 339 Ca 0.22 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.71 2c44 h GLN 339 Cb 0.05 -0.19 -0.04 0.00 1.07 0.00 0.00 27.48 28.37 2c44 h GLN 339 CO -0.04 0.55 0.18 -0.92 -2.65 0.00 0.00 178.83 175.95 2c44 h TYR 340 N 0.85 0.33 -0.37 3.99 3.20 -0.36 0.97 116.97 125.58 2c44 h TYR 340 Ca 0.29 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 2c44 h TYR 340 Cb 0.05 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 2c44 h TYR 340 CO -0.05 0.16 0.10 1.25 -1.64 0.00 0.00 178.16 177.99 2c44 h LEU 341 N 0.37 0.55 -0.41 2.82 5.85 -0.77 -0.57 115.31 123.15 2c44 h LEU 341 Ca 0.18 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 2c44 h LEU 341 Cb 0.11 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2c44 h LEU 341 CO -0.15 0.63 0.24 0.58 -0.34 0.00 0.00 178.44 179.40 2c44 h VAL 342 N 0.45 1.14 -0.48 1.05 2.07 -0.75 -1.00 116.25 118.73 2c44 h VAL 342 Ca 0.12 -0.34 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 2c44 h VAL 342 Cb 0.28 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2c44 h VAL 342 CO -0.00 0.14 -0.02 0.44 0.02 0.00 0.00 177.57 178.15 2c44 h ASP 343 N 0.53 0.79 -0.55 0.57 3.32 -0.71 -0.80 116.42 119.57 2c44 h ASP 343 Ca 0.14 -0.20 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 2c44 h ASP 343 Cb 0.02 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2c44 h ASP 343 CO -0.03 0.87 0.21 1.23 -1.72 0.00 0.00 179.24 179.81 2c44 h GLY 344 N 0.98 0.88 0.86 2.75 0.00 -0.76 -0.75 103.07 107.03 2c44 h GLY 344 Ca 0.14 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2c44 h GLY 344 CO 0.02 0.46 -0.02 1.41 0.00 0.00 0.00 176.54 178.42 2c44 h LEU 345 N 0.75 0.46 -1.90 3.11 3.38 -0.97 -2.67 115.31 117.47 2c44 h LEU 345 Ca 0.18 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.84 2c44 h LEU 345 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2c44 h LEU 345 CO -0.01 0.68 0.10 -0.08 0.09 0.00 0.00 178.44 179.22 2c44 h GLU 346 N 0.24 0.13 -0.48 1.13 4.57 -0.97 -1.47 114.58 117.72 2c44 h GLU 346 Ca 0.07 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.18 2c44 h GLU 346 Cb 0.45 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 2c44 h GLU 346 CO 0.02 0.09 0.02 0.93 -1.18 0.00 0.00 179.01 178.88 2c44 h GLU 347 N 0.13 0.78 -0.50 1.92 4.39 -0.79 -2.53 114.58 117.99 2c44 h GLU 347 Ca 0.06 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.56 2c44 h GLU 347 Cb 0.09 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2c44 h GLU 347 CO -0.01 0.77 0.00 0.44 -1.16 0.00 0.00 179.01 179.05 2c44 n ILE 348 N -4.23 0.79 -0.52 3.13 -5.35 -0.71 -4.89 119.36 107.58 2c44 n ILE 348 Ca 0.03 -0.61 0.00 0.00 -0.27 0.00 0.00 62.75 61.90 2c44 n ILE 348 Cb 0.28 0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 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 0.96 0.70 3.29 3.28 0.00 -0.95 -5.02 105.19 107.45 2c44 n GLY 349 Ca 0.14 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 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 4.55 0.20 1.61 1.01 -0.64 -5.00 120.40 120.13 2c44 s VAL 350 Ca 0.00 -1.40 -0.30 0.00 0.00 0.00 0.00 61.98 60.27 2c44 s VAL 350 Cb 0.00 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.47 2c44 s VAL 350 CO 0.00 -0.61 1.43 -0.69 0.00 0.00 0.00 175.10 175.23 2c44 s VAL 351 N 1.48 2.87 0.23 2.92 1.01 -1.26 -3.25 120.40 124.40 2c44 s VAL 351 Ca 0.04 0.69 0.03 0.00 0.00 0.00 0.00 61.98 62.74 2c44 s VAL 351 Cb -0.25 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2c44 s VAL 351 CO 0.03 0.09 0.01 0.00 0.00 0.00 0.00 175.10 175.23 2c44 s GLN 353 N -3.88 2.97 0.42 0.00 2.00 -0.50 -4.80 119.66 115.87 2c44 s GLN 353 Ca 0.29 1.49 -0.26 0.00 -2.00 0.00 0.00 55.36 54.88 2c44 s GLN 353 Cb 0.06 -1.96 -0.09 0.00 0.80 0.00 0.00 33.01 31.81 2c44 s GLN 353 CO 0.09 -1.13 1.46 1.14 -0.50 0.00 0.00 175.29 176.35 2c44 s GLN 354 N -3.79 3.84 -0.23 1.67 -2.07 -1.26 -4.66 119.66 113.16 2c44 s GLN 354 Ca 0.70 2.50 -0.42 0.00 -1.82 0.00 0.00 55.36 56.32 2c44 s GLN 354 Cb -0.22 -2.77 -0.18 0.00 -1.09 0.00 0.00 33.01 28.74 2c44 s GLN 354 CO 0.36 -0.73 1.47 0.00 -1.32 0.00 0.00 175.29 175.07 2c44 n ALA 355 N 0.04 -1.57 -2.21 2.60 0.00 -1.26 -4.96 120.51 113.15 2c44 n ALA 355 Ca 0.04 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2c44 n ALA 355 Cb 0.41 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.87 2c44 n ALA 355 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c44 n GLY 356 N 3.21 2.76 0.12 0.00 0.00 -1.26 -4.99 105.19 105.03 2c44 n GLY 356 Ca 0.25 -1.93 -0.18 0.00 0.00 0.00 0.00 46.02 44.16 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 0.23 -0.18 -0.02 0.00 -1.65 -3.43 103.07 98.01 2c44 h GLY 357 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2c44 h GLY 357 CO 0.00 0.52 -0.11 -2.39 0.00 0.00 0.00 176.54 174.56 2c44 n HIS 358 N -3.37 0.00 -3.57 5.60 1.44 -1.26 -4.56 115.22 109.49 2c44 n HIS 358 Ca -0.27 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.37 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 -0.94 -1.81 -0.19 1.59 0.00 -1.26 -1.60 121.76 117.55 2c44 s ALA 359 Ca 0.04 0.83 -0.14 0.00 0.00 0.00 0.00 51.96 52.68 2c44 s ALA 359 Cb 0.04 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 2c44 s ALA 359 CO 0.12 -0.78 0.31 0.00 0.00 0.00 0.00 175.76 175.42 2c44 s ALA 360 N -3.10 3.58 -0.42 0.00 0.00 -1.02 -4.20 121.76 116.61 2c44 s ALA 360 Ca 0.07 -0.56 -0.09 0.00 0.00 0.00 0.00 51.96 51.38 2c44 s ALA 360 Cb -0.01 -2.48 0.07 0.00 0.00 0.00 0.00 23.12 20.71 2c44 s ALA 360 CO -0.06 -0.12 0.26 -0.06 0.00 0.00 0.00 175.76 175.78 2c44 s PHE 361 N 0.91 3.33 0.15 0.00 0.40 -1.26 -0.54 117.98 120.96 2c44 s PHE 361 Ca 0.16 -1.46 -0.30 0.00 -0.60 0.00 0.00 56.93 54.72 2c44 s PHE 361 Cb -0.14 -2.91 -0.07 0.00 0.51 0.00 0.00 43.02 40.41 2c44 s PHE 361 CO 0.06 -0.83 1.04 0.08 0.70 0.00 0.00 175.22 176.26 2c44 s VAL 362 N 1.44 4.16 -1.01 -0.44 1.01 0.36 -1.41 120.40 124.52 2c44 s VAL 362 Ca 0.03 1.83 -0.19 0.00 0.00 0.00 0.00 61.98 63.64 2c44 s VAL 362 Cb -0.23 -4.17 0.11 0.00 0.00 0.00 0.00 36.38 32.10 2c44 s VAL 362 CO 0.03 0.30 1.29 -0.62 0.00 0.00 0.00 175.10 176.09 2c44 s ASP 363 N -0.06 6.65 0.39 3.32 3.68 -0.54 -0.20 116.67 129.92 2c44 s ASP 363 Ca 0.48 -2.00 0.09 0.00 2.13 0.00 0.00 52.55 53.24 2c44 s ASP 363 Cb -0.27 -2.46 0.86 0.00 -1.45 0.00 0.00 42.92 39.60 2c44 s ASP 363 CO 0.32 -1.16 1.98 0.00 0.13 0.00 0.00 175.17 176.45 2c44 h ALA 364 N 8.85 1.80 -0.21 3.66 0.00 -1.33 -1.31 119.26 130.72 2c44 h ALA 364 Ca 0.20 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2c44 h ALA 364 Cb 0.99 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2c44 h ALA 364 CO 1.24 0.09 -0.01 0.78 0.00 0.00 0.00 179.25 181.36 2c44 h GLY 365 N 0.61 0.20 1.76 0.00 0.00 -1.80 0.47 103.07 104.30 2c44 h GLY 365 Ca 0.27 0.03 -0.14 0.00 0.00 0.00 0.00 47.33 47.49 2c44 h GLY 365 CO -0.08 -0.04 -0.56 0.50 0.00 0.00 0.00 176.54 176.36 2c44 h LYS 366 N 0.06 0.26 0.01 4.80 1.57 -1.70 -2.90 116.57 118.67 2c44 h LYS 366 Ca 0.10 -0.16 -0.20 0.00 -1.87 0.00 0.00 60.65 58.52 2c44 h LYS 366 Cb 0.13 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2c44 h LYS 366 CO -0.18 0.74 -0.90 1.25 -0.57 0.00 0.00 179.45 179.80 2c44 h LEU 367 N 0.20 0.23 -5.96 2.94 5.85 -0.82 -3.37 115.31 114.39 2c44 h LEU 367 Ca 0.00 -0.20 -0.58 0.00 0.84 0.00 0.00 57.88 57.95 2c44 h LEU 367 Cb 1.04 -0.07 -0.41 0.00 0.37 0.00 0.00 40.66 41.59 2c44 h LEU 367 CO 0.09 1.02 -0.77 0.18 -0.34 0.00 0.00 178.44 178.61 2c44 n LEU 368 N -3.63 2.85 0.32 2.25 4.77 0.16 -4.79 117.00 118.94 2c44 n LEU 368 Ca -0.03 -5.29 0.22 0.00 -0.03 0.00 0.00 56.01 50.88 2c44 n LEU 368 Cb 0.82 -0.23 1.13 0.00 -2.33 0.00 0.00 43.42 42.82 2c44 n LEU 368 CO 0.48 2.14 1.15 1.55 -1.33 0.00 0.00 177.39 181.38 2c44 h PRO 369 N 3.80 0.00 0.00 3.23 0.13 -1.68 -2.68 132.00 134.79 2c44 h PRO 369 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2c44 h PRO 369 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2c44 h PRO 369 CO 0.72 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.10 2c44 n HIS 370 N -3.04 0.76 -3.56 1.56 1.44 -1.26 -4.74 115.22 106.38 2c44 n HIS 370 Ca -0.02 0.24 -0.38 0.00 -2.01 0.00 0.00 57.72 55.55 2c44 n HIS 370 Cb 0.10 -0.89 -0.10 0.00 0.12 0.00 0.00 29.99 29.22 2c44 n HIS 370 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2c44 s ILE 371 N -3.13 5.29 0.40 0.61 1.01 -1.01 -5.05 121.20 119.32 2c44 s ILE 371 Ca 0.10 0.30 -0.25 0.00 0.00 0.00 0.00 60.65 60.80 2c44 s ILE 371 Cb 0.12 -3.57 -0.08 0.00 0.01 0.00 0.00 42.46 38.94 2c44 s ILE 371 CO 0.53 0.27 1.18 -2.16 0.00 0.00 0.00 174.94 174.76 2c44 s PRO 372 N 1.48 4.07 0.33 2.79 0.04 -1.26 -4.75 135.00 137.69 2c44 s PRO 372 Ca 0.10 1.86 0.11 0.00 0.04 0.00 0.00 61.00 63.11 2c44 s PRO 372 Cb -0.15 -2.69 0.97 0.00 0.04 0.00 0.00 34.50 32.67 2c44 s PRO 372 CO 0.08 -0.31 1.69 0.00 0.04 0.00 0.00 177.00 178.50 2c44 h ALA 373 N 2.67 1.83 -0.15 8.56 0.00 -1.97 0.83 119.26 131.03 2c44 h ALA 373 Ca -0.49 0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.63 2c44 h ALA 373 Cb 1.23 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2c44 h ALA 373 CO 0.63 -0.43 0.28 0.38 0.00 0.00 0.00 179.25 180.10 2c44 h ASP 374 N 0.43 0.00 -0.67 0.00 3.04 -1.98 0.18 116.42 117.42 2c44 h ASP 374 Ca 0.68 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.47 2c44 h ASP 374 Cb 1.43 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.72 2c44 h ASP 374 CO -0.55 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 176.65 2c44 n GLN 375 N -3.39 3.59 -3.57 4.15 6.02 0.29 -4.94 117.38 119.54 2c44 n GLN 375 Ca 0.01 -2.87 -0.19 0.00 -0.01 0.00 0.00 57.00 53.95 2c44 n GLN 375 Cb 0.38 -1.85 0.01 0.00 1.02 0.00 0.00 30.24 29.80 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 1.24 -2.29 -0.08 1.08 3.01 0.05 -1.08 117.46 119.39 2c44 n PHE 376 Ca 0.26 0.86 0.08 0.00 1.01 0.00 0.00 57.45 59.66 2c44 n PHE 376 Cb 0.85 -3.25 0.45 0.00 -0.01 0.00 0.00 39.48 37.52 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 -0.31 0.51 -0.03 -1.08 0.13 -1.79 -1.74 132.00 127.68 2c44 h PRO 377 Ca -0.45 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.56 2c44 h PRO 377 Cb 1.27 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2c44 h PRO 377 CO 0.36 0.33 -0.40 0.00 -0.23 0.00 0.00 178.00 178.06 2c44 h ALA 378 N 1.69 1.27 -0.05 -0.56 0.00 -1.88 -0.55 119.26 119.19 2c44 h ALA 378 Ca 0.25 -0.38 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 2c44 h ALA 378 Cb 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2c44 h ALA 378 CO -0.07 0.53 -0.84 1.96 0.00 0.00 0.00 179.25 180.83 2c44 h GLN 379 N 0.05 0.47 -0.42 0.00 1.08 -1.69 -1.76 115.11 112.84 2c44 h GLN 379 Ca 0.00 -0.44 -0.05 0.00 -1.45 0.00 0.00 58.65 56.71 2c44 h GLN 379 Cb 0.74 0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 28.26 2c44 h GLN 379 CO 0.06 1.08 0.09 0.00 -0.95 0.00 0.00 178.83 179.11 2c44 h ALA 380 N 0.77 0.56 -0.84 3.87 0.00 -1.08 -2.23 119.26 120.31 2c44 h ALA 380 Ca -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2c44 h ALA 380 Cb 1.46 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 2c44 h ALA 380 CO 0.15 0.26 0.51 1.25 0.00 0.00 0.00 179.25 181.41 2c44 h LEU 381 N 0.55 1.01 -0.34 0.00 5.85 -1.04 -1.04 115.31 120.30 2c44 h LEU 381 Ca 0.13 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2c44 h LEU 381 Cb 0.34 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2c44 h LEU 381 CO 0.00 0.78 0.20 0.00 -0.34 0.00 0.00 178.44 179.08 2c44 h ALA 382 N 1.40 0.43 -0.40 1.25 0.00 -0.95 0.28 119.26 121.27 2c44 h ALA 382 Ca 0.30 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2c44 h ALA 382 Cb -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2c44 h ALA 382 CO -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 179.25 179.13 2c44 h GLU 384 N 0.62 0.10 -0.60 0.00 4.57 -0.64 -1.59 114.58 117.04 2c44 h GLU 384 Ca 0.12 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.34 2c44 h GLU 384 Cb 0.40 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 2c44 h GLU 384 CO 0.02 0.31 0.30 1.25 -1.18 0.00 0.00 179.01 179.71 2c44 h LEU 385 N -0.14 0.42 0.11 1.64 5.85 -0.67 -1.21 115.31 121.31 2c44 h LEU 385 Ca 0.02 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2c44 h LEU 385 Cb 0.26 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2c44 h LEU 385 CO 0.00 0.27 -0.06 0.22 -0.34 0.00 0.00 178.44 178.54 2c44 h TYR 386 N 0.56 -0.14 -0.40 1.25 3.20 -1.13 -2.12 116.97 118.18 2c44 h TYR 386 Ca 0.27 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.22 2c44 h TYR 386 Cb 0.21 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.45 2c44 h TYR 386 CO -0.10 -0.06 -0.12 0.87 -1.64 0.00 0.00 178.16 177.10 2c44 h LYS 387 N -0.19 -0.03 -0.08 1.82 1.57 -0.95 0.18 116.57 118.88 2c44 h LYS 387 Ca -0.02 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2c44 h LYS 387 Cb 0.15 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 2c44 h LYS 387 CO 0.03 -0.02 -0.10 0.28 -0.57 0.00 0.00 179.45 179.06 2c44 h VAL 388 N -0.03 0.71 0.00 0.50 2.07 -0.93 -3.39 116.25 115.18 2c44 h VAL 388 Ca 0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 2c44 h VAL 388 Cb 0.33 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2c44 h VAL 388 CO -0.43 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.16 2c44 n ALA 389 N -2.43 0.93 -1.27 1.67 0.00 -0.83 -5.00 120.51 113.58 2c44 n ALA 389 Ca -0.04 -0.41 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 2c44 n ALA 389 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.61 2c44 n ALA 389 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c44 n GLY 390 N -0.06 0.42 3.76 0.00 0.00 0.61 -4.81 105.19 105.10 2c44 n GLY 390 Ca 0.00 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.04 5.37 -0.15 -0.61 1.01 -1.26 -1.40 121.20 122.12 2c44 s ILE 391 Ca 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 60.65 60.96 2c44 s ILE 391 Cb 0.00 -3.53 -0.03 0.00 0.01 0.00 0.00 42.46 38.91 2c44 s ILE 391 CO 0.00 0.46 -0.03 -0.60 0.00 0.00 0.00 174.94 174.76 2c44 s ARG 392 N 0.12 3.66 0.29 2.79 3.52 -0.75 -3.01 118.95 125.56 2c44 s ARG 392 Ca 0.13 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 55.25 2c44 s ARG 392 Cb -0.12 -2.92 -0.04 0.00 -1.56 0.00 0.00 34.95 30.32 2c44 s ARG 392 CO 0.02 0.26 0.17 0.00 -0.81 0.00 0.00 175.30 174.94 2c44 s ALA 393 N 0.31 1.80 0.19 6.12 0.00 -1.26 0.10 121.76 129.02 2c44 s ALA 393 Ca -0.03 -1.80 0.11 0.00 0.00 0.00 0.00 51.96 50.24 2c44 s ALA 393 Cb -0.14 1.25 -0.04 0.00 0.00 0.00 0.00 23.12 24.18 2c44 s ALA 393 CO 0.03 -0.55 -0.22 0.14 0.00 0.00 0.00 175.76 175.16 2c44 s VAL 394 N -3.68 2.21 0.01 0.00 -7.23 -1.14 -4.81 120.40 105.76 2c44 s VAL 394 Ca 0.37 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.48 2c44 s VAL 394 Cb 0.05 -2.04 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 2c44 s VAL 394 CO 0.18 -0.17 0.26 -1.83 -0.31 0.00 0.00 175.10 173.23 2c44 s GLU 395 N -2.70 3.57 -0.51 4.82 4.04 -1.26 0.05 118.70 126.71 2c44 s GLU 395 Ca 0.19 -0.09 0.07 0.00 0.04 0.00 0.00 54.97 55.18 2c44 s GLU 395 Cb -0.07 -3.08 0.29 0.00 0.02 0.00 0.00 34.13 31.29 2c44 s GLU 395 CO 0.09 0.65 0.73 -0.89 -1.84 0.00 0.00 175.26 174.00 2c44 n ILE 396 N 1.10 1.23 0.00 1.83 2.08 0.12 -4.67 119.36 121.05 2c44 n ILE 396 Ca -0.11 -4.86 0.00 0.00 0.56 0.00 0.00 62.75 58.34 2c44 n ILE 396 Cb 0.53 -1.58 0.00 0.00 -0.75 0.00 0.00 39.64 37.84 2c44 n ILE 396 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2c44 n GLY 397 N 0.66 5.29 0.25 7.39 0.00 -1.26 -2.81 105.19 114.72 2c44 n GLY 397 Ca 0.27 -0.77 -0.05 0.00 0.00 0.00 0.00 46.02 45.47 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 0.63 -0.29 1.61 0.02 -1.85 -1.90 113.55 111.77 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 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 2c44 h SER 398 CO 0.00 0.85 0.02 0.15 -1.14 0.00 0.00 176.83 176.72 2c44 h PHE 399 N 0.55 0.03 -0.13 3.45 -0.00 -1.94 -2.94 116.94 115.95 2c44 h PHE 399 Ca 0.08 0.02 -0.23 0.00 -0.00 0.00 0.00 57.97 57.84 2c44 h PHE 399 Cb 0.70 0.03 0.01 0.00 -0.00 0.00 0.00 35.95 36.69 2c44 h PHE 399 CO 0.03 -0.02 -0.81 1.25 -0.00 0.00 0.00 178.31 178.76 2c44 h LEU 400 N 0.12 0.90 -1.51 0.59 6.46 -1.81 -3.30 115.31 116.76 2c44 h LEU 400 Ca 0.14 -0.61 0.12 0.00 -0.12 0.00 0.00 57.88 57.41 2c44 h LEU 400 Cb 0.17 -0.27 -0.05 0.00 -0.73 0.00 0.00 40.66 39.79 2c44 h LEU 400 CO -0.22 1.40 0.48 0.25 -0.62 0.00 0.00 178.44 179.74 2c44 h LEU 401 N 0.50 0.48 0.00 2.25 5.85 -1.20 -3.46 115.31 119.73 2c44 h LEU 401 Ca -0.06 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2c44 h LEU 401 Cb 1.43 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.38 2c44 h LEU 401 CO 0.16 0.27 0.00 0.61 -0.34 0.00 0.00 178.44 179.14 2c44 n GLY 402 N -1.49 -1.86 3.82 3.75 0.00 -1.12 -4.90 105.19 103.38 2c44 n GLY 402 Ca 0.13 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.43 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 2.86 -0.21 1.61 0.52 -1.26 -1.67 118.95 120.80 2c44 s ARG 403 Ca 0.00 -1.12 -0.29 0.00 -0.52 0.00 0.00 55.73 53.80 2c44 s ARG 403 Cb 0.00 -2.53 -0.02 0.00 0.52 0.00 0.00 34.95 32.92 2c44 s ARG 403 CO 0.00 0.34 1.55 0.34 0.02 0.00 0.00 175.30 177.55 2c44 s ASP 404 N -3.86 6.50 0.49 0.23 -1.08 0.12 -4.77 116.67 114.29 2c44 s ASP 404 Ca 0.34 1.64 0.26 0.00 -0.52 0.00 0.00 52.55 54.28 2c44 s ASP 404 Cb -0.07 -2.53 1.44 0.00 -1.46 0.00 0.00 42.92 40.29 2c44 s ASP 404 CO 0.25 -1.16 1.79 1.55 0.52 0.00 0.00 175.17 178.12 2c44 h PRO 405 N 10.19 0.00 0.00 4.34 0.13 -1.96 0.92 132.00 145.63 2c44 h PRO 405 Ca -0.33 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.49 2c44 h PRO 405 Cb 1.14 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.23 2c44 h PRO 405 CO 1.00 0.00 -1.94 1.63 -0.23 0.00 0.00 178.00 178.45 2c44 n LYS 406 N -2.54 0.57 -0.01 0.86 4.01 -1.26 -4.61 118.16 115.17 2c44 n LYS 406 Ca -0.02 0.32 -0.18 0.00 -0.51 0.00 0.00 58.31 57.93 2c44 n LYS 406 Cb 0.21 -1.53 -0.08 0.00 -0.51 0.00 0.00 35.03 33.11 2c44 n LYS 406 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2c44 h THR 407 N -1.00 1.30 0.00 -0.18 1.03 -1.91 -3.47 112.91 108.69 2c44 h THR 407 Ca -0.48 -1.98 0.00 0.00 -0.01 0.00 0.00 66.41 63.94 2c44 h THR 407 Cb 1.39 2.11 0.00 0.00 -1.07 0.00 0.00 68.15 70.58 2c44 h THR 407 CO -0.29 0.62 0.00 0.61 -0.01 0.00 0.00 175.52 176.45 2c44 n GLY 408 N 0.78 0.74 3.93 2.99 0.00 0.32 -4.98 105.19 108.96 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 1.25 0.00 0.00 0.00 173.32 174.57 2c44 s LYS 409 N -0.52 3.52 0.14 1.61 2.36 -1.26 -4.68 119.74 120.90 2c44 s LYS 409 Ca 0.00 -0.34 -0.34 0.00 -2.55 0.00 0.00 55.97 52.74 2c44 s LYS 409 Cb 0.00 -2.86 -0.14 0.00 -1.05 0.00 0.00 37.83 33.78 2c44 s LYS 409 CO 0.00 0.43 1.60 0.94 1.55 0.00 0.00 175.35 179.86 2c44 n GLN 410 N -0.53 2.12 -2.39 4.03 -0.06 -1.26 0.14 117.38 119.43 2c44 n GLN 410 Ca -0.05 0.77 -0.37 0.00 -2.00 0.00 0.00 57.00 55.35 2c44 n GLN 410 Cb 0.53 -2.54 -0.03 0.00 -4.06 0.00 0.00 30.24 24.15 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 1.17 4.13 0.30 1.69 1.43 -0.67 -4.78 118.68 121.96 2c44 s LEU 411 Ca 0.80 2.21 -0.29 0.00 -1.03 0.00 0.00 54.13 55.82 2c44 s LEU 411 Cb -0.69 -4.14 -0.10 0.00 0.03 0.00 0.00 46.19 41.29 2c44 s LEU 411 CO 0.39 -0.66 1.20 -2.16 0.23 0.00 0.00 176.35 175.35 2c44 s PRO 412 N -2.47 4.51 -0.10 1.29 0.04 -1.26 -4.93 135.00 132.08 2c44 s PRO 412 Ca 0.59 2.00 0.03 0.00 0.04 0.00 0.00 61.00 63.66 2c44 s PRO 412 Cb -0.27 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2c44 s PRO 412 CO 0.33 0.02 -0.21 0.00 0.04 0.00 0.00 177.00 177.19 2c44 h PRO 414 N 6.54 0.00 -1.66 0.00 0.13 -1.97 -3.45 132.00 131.59 2c44 h PRO 414 Ca -0.24 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.94 2c44 h PRO 414 Cb 1.22 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.11 2c44 h PRO 414 CO 0.50 0.07 0.44 0.00 -0.23 0.00 0.00 178.00 178.78 2c44 s ALA 415 N -3.94 -1.92 -0.63 -0.56 0.00 -1.26 -4.95 121.76 108.50 2c44 s ALA 415 Ca -0.02 1.69 -0.09 0.00 0.00 0.00 0.00 51.96 53.55 2c44 s ALA 415 Cb 0.11 -0.92 0.16 0.00 0.00 0.00 0.00 23.12 22.47 2c44 s ALA 415 CO 0.54 -0.29 0.50 -1.21 0.00 0.00 0.00 175.76 175.31 2c44 s GLU 416 N -0.52 2.86 -0.03 0.00 0.41 -1.26 -4.29 118.70 115.87 2c44 s GLU 416 Ca -0.01 -2.20 0.01 0.00 -0.41 0.00 0.00 54.97 52.36 2c44 s GLU 416 Cb -0.02 -4.03 -0.03 0.00 -1.78 0.00 0.00 34.13 28.26 2c44 s GLU 416 CO -0.00 -1.22 -0.01 -0.51 -0.49 0.00 0.00 175.26 173.03 2c44 s LEU 417 N 0.59 3.50 -0.30 1.80 1.43 -1.12 -0.89 118.68 123.69 2c44 s LEU 417 Ca 0.13 0.03 -0.08 0.00 -1.03 0.00 0.00 54.13 53.17 2c44 s LEU 417 Cb -0.20 -1.94 -0.00 0.00 0.03 0.00 0.00 46.19 44.08 2c44 s LEU 417 CO -0.04 0.31 0.11 -0.22 0.23 0.00 0.00 176.35 176.75 2c44 s LEU 418 N -1.33 3.90 -0.37 1.79 2.96 0.72 0.16 118.68 126.51 2c44 s LEU 418 Ca 0.17 -0.55 -0.17 0.00 -0.22 0.00 0.00 54.13 53.36 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 -0.17 0.47 -0.60 -1.32 0.00 0.00 176.35 174.81 2c44 s ARG 419 N 1.57 3.46 -1.18 1.98 3.52 0.11 -0.49 118.95 127.92 2c44 s ARG 419 Ca 0.04 -0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 55.14 2c44 s ARG 419 Cb -0.17 -3.85 0.19 0.00 -1.56 0.00 0.00 34.95 29.56 2c44 s ARG 419 CO 0.04 -0.69 1.37 -0.51 -0.81 0.00 0.00 175.30 174.70 2c44 s LEU 420 N 2.28 5.27 0.00 -0.88 1.02 0.29 -2.91 118.68 123.76 2c44 s LEU 420 Ca 0.16 -3.07 -0.30 0.00 0.02 0.00 0.00 54.13 50.93 2c44 s LEU 420 Cb -0.16 -2.37 -0.06 0.00 0.02 0.00 0.00 46.19 43.63 2c44 s LEU 420 CO 0.13 -0.68 1.40 -0.89 0.02 0.00 0.00 176.35 176.34 2c44 s THR 421 N 1.14 3.70 -0.42 5.49 2.01 -0.92 -2.42 115.64 124.21 2c44 s THR 421 Ca 0.40 1.09 -0.14 0.00 0.31 0.00 0.00 61.69 63.35 2c44 s THR 421 Cb -0.04 -3.70 0.04 0.00 0.01 0.00 0.00 72.50 68.80 2c44 s THR 421 CO -0.01 0.00 0.31 -0.63 -0.69 0.00 0.00 174.62 173.59 2c44 s ILE 422 N 2.35 5.10 0.47 1.82 -1.09 -0.63 -4.31 121.20 124.92 2c44 s ILE 422 Ca 0.64 -0.82 -0.24 0.00 -2.23 0.00 0.00 60.65 57.99 2c44 s ILE 422 Cb -0.32 -3.90 -0.07 0.00 -1.58 0.00 0.00 42.46 36.59 2c44 s ILE 422 CO 0.27 -0.37 1.41 -2.84 -1.23 0.00 0.00 174.94 172.17 2c44 s PRO 423 N 1.64 3.55 0.17 2.79 0.02 -1.26 -4.74 135.00 137.17 2c44 s PRO 423 Ca 0.04 2.37 -0.31 0.00 0.02 0.00 0.00 61.00 63.12 2c44 s PRO 423 Cb -0.20 -2.56 -0.10 0.00 0.02 0.00 0.00 34.50 31.66 2c44 s PRO 423 CO 0.08 -0.91 1.51 1.03 -0.33 0.00 0.00 177.00 178.39 2c44 s ARG 424 N -2.56 4.24 -1.59 5.54 0.52 -1.26 -3.41 118.95 120.44 2c44 s ARG 424 Ca 0.64 2.30 -0.11 0.00 -0.52 0.00 0.00 55.73 58.03 2c44 s ARG 424 Cb -0.43 -3.16 0.09 0.00 0.52 0.00 0.00 34.95 31.97 2c44 s ARG 424 CO 0.54 -0.54 0.61 0.00 0.02 0.00 0.00 175.30 175.93 2c44 n ALA 425 N 3.67 -1.58 -0.04 2.13 0.00 -1.26 -0.86 120.51 122.57 2c44 n ALA 425 Ca 0.12 -0.12 -0.06 0.00 0.00 0.00 0.00 53.44 53.37 2c44 n ALA 425 Cb 0.39 -2.62 -0.03 0.00 0.00 0.00 0.00 19.45 17.19 2c44 n ALA 425 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2c44 n THR 426 N -4.41 0.45 -4.26 0.00 -1.04 -1.22 -4.28 114.28 99.52 2c44 n THR 426 Ca -0.09 -0.16 -0.23 0.00 -2.04 0.00 0.00 64.05 61.53 2c44 n THR 426 Cb 0.57 -1.01 -0.07 0.00 -1.82 0.00 0.00 70.33 68.00 2c44 n THR 426 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2c44 s TYR 427 N -2.15 2.69 0.58 -1.42 2.02 -1.26 -5.07 117.35 112.73 2c44 s TYR 427 Ca -0.11 -0.27 0.07 0.00 -0.37 0.00 0.00 57.07 56.40 2c44 s TYR 427 Cb 0.03 -1.31 0.07 0.00 -0.40 0.00 0.00 41.96 40.36 2c44 s TYR 427 CO 0.17 0.55 0.60 0.25 -1.57 0.00 0.00 175.55 175.55 2c44 n THR 428 N -0.95 0.00 0.09 -0.71 -2.24 -1.26 -4.98 114.28 104.23 2c44 n THR 428 Ca -0.06 -2.13 0.03 0.00 -2.27 0.00 0.00 64.05 59.63 2c44 n THR 428 Cb 0.60 -0.22 0.41 0.00 -2.10 0.00 0.00 70.33 69.01 2c44 n THR 428 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2c44 h GLN 429 N 0.00 0.32 -0.67 -0.78 4.15 -1.99 -1.63 115.11 114.51 2c44 h GLN 429 Ca -0.32 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.00 2c44 h GLN 429 Cb 1.29 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.90 2c44 h GLN 429 CO 0.49 0.36 0.26 1.15 -1.93 0.00 0.00 178.83 179.16 2c44 h THR 430 N 0.31 1.23 -0.47 2.39 2.02 -1.99 -0.48 112.91 115.93 2c44 h THR 430 Ca 0.07 -0.75 -0.09 0.00 0.77 0.00 0.00 66.41 66.42 2c44 h THR 430 Cb 0.23 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2c44 h THR 430 CO 0.01 0.30 -0.04 0.45 0.37 0.00 0.00 175.52 176.60 2c44 h HIS 431 N 0.97 0.94 -0.34 3.16 3.86 -1.70 -0.47 115.15 121.58 2c44 h HIS 431 Ca 0.23 -0.18 0.05 0.00 -1.16 0.00 0.00 60.37 59.30 2c44 h HIS 431 Cb 0.20 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 2c44 h HIS 431 CO 0.02 0.91 0.08 0.52 0.86 0.00 0.00 177.93 180.32 2c44 h MET 432 N 0.70 0.20 -0.79 2.45 2.07 -0.74 0.14 114.93 118.96 2c44 h MET 432 Ca 0.13 -0.01 0.01 0.00 -2.07 0.00 0.00 59.70 57.75 2c44 h MET 432 Cb 0.56 -0.04 -0.04 0.00 -1.87 0.00 0.00 31.60 30.21 2c44 h MET 432 CO 0.03 0.13 0.52 -0.44 1.07 0.00 0.00 176.91 178.22 2c44 h ASP 433 N 0.20 0.90 -0.61 1.22 3.45 -0.87 -0.26 116.42 120.46 2c44 h ASP 433 Ca 0.16 -0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.57 2c44 h ASP 433 Cb 0.17 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.69 2c44 h ASP 433 CO -0.20 0.65 0.28 0.15 -1.57 0.00 0.00 179.24 178.56 2c44 h PHE 434 N 1.07 0.89 -0.31 4.55 3.57 0.47 0.00 116.94 127.18 2c44 h PHE 434 Ca 0.29 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 2c44 h PHE 434 Cb -0.12 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.33 2c44 h PHE 434 CO 0.00 0.69 0.10 0.82 -2.23 0.00 0.00 178.31 177.68 2c44 h ILE 435 N 0.84 1.21 -0.62 1.41 2.04 0.14 -1.26 117.51 121.26 2c44 h ILE 435 Ca 0.21 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2c44 h ILE 435 Cb 0.14 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2c44 h ILE 435 CO -0.02 0.23 0.40 0.40 0.00 0.00 0.00 178.15 179.15 2c44 h ILE 436 N 0.35 1.17 -0.96 -0.67 2.04 -0.77 -1.73 117.51 116.93 2c44 h ILE 436 Ca 0.10 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.62 2c44 h ILE 436 Cb 0.25 0.28 -0.05 0.00 -0.74 0.00 0.00 36.82 36.57 2c44 h ILE 436 CO -0.00 0.17 0.63 -0.08 0.00 0.00 0.00 178.15 178.87 2c44 h GLU 437 N 0.85 1.28 -0.49 2.37 4.57 -0.80 -2.16 114.58 120.19 2c44 h GLU 437 Ca 0.23 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.32 2c44 h GLU 437 Cb -0.06 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.22 2c44 h GLU 437 CO -0.05 0.85 0.31 0.00 -1.18 0.00 0.00 179.01 178.94 2c44 h ALA 438 N 1.35 0.63 0.00 2.92 0.00 -0.55 -2.15 119.26 121.45 2c44 h ALA 438 Ca 0.35 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2c44 h ALA 438 Cb -0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2c44 h ALA 438 CO -0.07 0.10 -0.01 0.74 0.00 0.00 0.00 179.25 180.01 2c44 h PHE 439 N 0.66 0.00 -0.66 0.00 0.04 -0.69 -1.44 116.94 114.86 2c44 h PHE 439 Ca 0.18 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.94 2c44 h PHE 439 Cb -0.03 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 2c44 h PHE 439 CO -0.03 0.01 0.36 0.87 -0.60 0.00 0.00 178.31 178.92 2c44 h LYS 440 N 0.00 0.91 -0.29 1.51 1.57 -1.09 0.04 116.57 119.23 2c44 h LYS 440 Ca -0.00 -0.10 -0.15 0.00 -1.87 0.00 0.00 60.65 58.52 2c44 h LYS 440 Cb 0.15 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2c44 h LYS 440 CO 0.00 0.68 -0.41 0.45 -0.57 0.00 0.00 179.45 179.60 2c44 h HIS 441 N 0.90 0.97 -0.41 -1.35 3.86 -1.35 -2.31 115.15 115.46 2c44 h HIS 441 Ca 0.23 -0.32 0.03 0.00 -1.16 0.00 0.00 60.37 59.15 2c44 h HIS 441 Cb 0.03 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 2c44 h HIS 441 CO -0.01 1.12 0.22 0.28 0.86 0.00 0.00 177.93 180.39 2c44 h VAL 442 N 0.55 0.99 -0.12 2.45 2.07 -1.10 -2.45 116.25 118.64 2c44 h VAL 442 Ca 0.03 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 2c44 h VAL 442 Cb 1.01 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2c44 h VAL 442 CO 0.10 0.08 0.07 0.50 0.02 0.00 0.00 177.57 178.34 2c44 h LYS 443 N 0.44 0.16 -0.25 1.57 3.64 -0.98 -1.47 116.57 119.68 2c44 h LYS 443 Ca 0.17 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.61 2c44 h LYS 443 Cb 0.06 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2c44 h LYS 443 CO -0.11 0.15 0.38 1.49 -2.27 0.00 0.00 179.45 179.09 2c44 h GLU 444 N 0.13 0.00 -0.23 1.90 4.57 -1.07 -0.54 114.58 119.34 2c44 h GLU 444 Ca 0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2c44 h GLU 444 Cb 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2c44 h GLU 444 CO -0.01 0.00 0.00 -1.71 -1.18 0.00 0.00 179.01 176.11 2c44 n ASN 445 N -3.44 2.56 -0.20 1.04 5.15 -0.73 -4.77 115.26 114.86 2c44 n ASN 445 Ca 0.04 -1.87 -0.10 0.00 -0.60 0.00 0.00 54.58 52.04 2c44 n ASN 445 Cb 0.51 -0.15 -0.06 0.00 -0.53 0.00 0.00 39.78 39.55 2c44 n ASN 445 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2c44 h ALA 446 N 1.70 -0.50 -0.09 5.20 0.00 -0.09 -1.53 119.26 123.94 2c44 h ALA 446 Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2c44 h ALA 446 Cb 0.63 1.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 2c44 h ALA 446 CO 0.00 -0.92 0.40 0.66 0.00 0.00 0.00 179.25 179.40 2c44 h SER 447 N -0.26 0.00 -0.12 0.00 4.64 -1.86 -1.61 113.55 114.33 2c44 h SER 447 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2c44 h SER 447 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2c44 h SER 447 CO -0.68 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 175.87 2c44 n ASN 448 N -3.03 3.07 -4.68 4.97 3.02 -0.58 -4.94 115.26 113.10 2c44 n ASN 448 Ca 0.00 -1.98 -0.42 0.00 -0.03 0.00 0.00 54.58 52.14 2c44 n ASN 448 Cb 0.48 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 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 -1.87 4.56 0.47 2.41 1.01 -0.61 -5.03 121.20 122.15 2c44 s ILE 449 Ca 0.31 1.85 -0.09 0.00 0.00 0.00 0.00 60.65 62.73 2c44 s ILE 449 Cb 0.21 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 2c44 s ILE 449 CO 0.31 -0.02 0.82 -0.54 0.00 0.00 0.00 174.94 175.51 2c44 s LYS 450 N 2.26 3.66 0.90 2.79 1.02 -1.26 -4.92 119.74 124.19 2c44 s LYS 450 Ca 0.51 0.42 -0.14 0.00 0.02 0.00 0.00 55.97 56.78 2c44 s LYS 450 Cb -0.20 -2.33 0.14 0.00 -0.52 0.00 0.00 37.83 34.92 2c44 s LYS 450 CO 0.18 -0.20 1.20 0.20 -0.92 0.00 0.00 175.35 175.81 2c44 s GLY 451 N -3.71 1.63 0.33 -3.33 0.00 -1.26 -4.83 107.32 96.16 2c44 s GLY 451 Ca 0.50 -0.78 0.08 0.00 0.00 0.00 0.00 44.72 44.53 2c44 s GLY 451 CO 0.40 -0.17 -0.06 1.08 0.00 0.00 0.00 173.10 174.36 2c44 s LEU 452 N -5.88 2.64 -0.14 0.66 1.43 -0.24 -1.28 118.68 115.87 2c44 s LEU 452 Ca 0.66 -1.24 -0.24 0.00 -1.03 0.00 0.00 54.13 52.28 2c44 s LEU 452 Cb -0.10 -0.84 0.06 0.00 0.03 0.00 0.00 46.19 45.34 2c44 s LEU 452 CO 0.52 -0.31 0.61 0.28 0.23 0.00 0.00 176.35 177.68 2c44 s THR 453 N -2.79 0.01 0.64 5.49 -1.32 -0.35 -4.49 115.64 112.82 2c44 s THR 453 Ca 0.32 -0.05 -0.18 0.00 -1.21 0.00 0.00 61.69 60.57 2c44 s THR 453 Cb 0.04 -0.89 -0.03 0.00 -1.51 0.00 0.00 72.50 70.12 2c44 s THR 453 CO 0.15 -0.03 1.11 0.49 -2.21 0.00 0.00 174.62 174.14 2c44 n PHE 454 N 1.93 1.30 0.00 9.09 3.01 -1.26 -0.86 117.46 130.67 2c44 n PHE 454 Ca -0.16 0.42 0.00 0.00 1.01 0.00 0.00 57.45 58.72 2c44 n PHE 454 Cb 0.56 -2.19 0.00 0.00 -0.01 0.00 0.00 39.48 37.84 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 -1.91 0.00 -3.48 4.37 -2.24 -0.40 -4.77 114.28 105.85 2c44 n THR 455 Ca 0.15 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2c44 n THR 455 Cb 0.48 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.97 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 -1.41 -0.16 4.78 5.04 -1.05 -4.97 117.35 119.14 2c44 s TYR 456 Ca 0.00 2.09 -0.01 0.00 -2.44 0.00 0.00 57.07 56.71 2c44 s TYR 456 Cb 0.00 0.70 0.04 0.00 0.35 0.00 0.00 41.96 43.06 2c44 s TYR 456 CO 0.00 -0.73 -0.03 -2.00 -1.34 0.00 0.00 175.55 171.45 2c44 s GLU 457 N 2.87 1.16 0.85 4.97 2.12 -1.26 -1.57 118.70 127.83 2c44 s GLU 457 Ca 0.03 -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 0.11 0.00 0.26 0.00 0.00 34.13 32.50 2c44 s GLU 457 CO -0.19 -0.45 1.12 -2.14 -0.54 0.00 0.00 175.26 173.05 2c44 s PRO 458 N 1.73 1.56 0.27 4.30 0.02 -1.26 -4.95 135.00 136.66 2c44 s PRO 458 Ca 0.01 1.38 0.16 0.00 0.02 0.00 0.00 61.00 62.57 2c44 s PRO 458 Cb -0.15 -1.80 0.06 0.00 0.02 0.00 0.00 34.50 32.63 2c44 s PRO 458 CO -0.07 -2.20 1.39 1.57 -0.33 0.00 0.00 177.00 177.36 2c44 h LYS 459 N -1.55 0.00 -5.40 5.54 -0.00 -2.00 -3.40 116.57 109.75 2c44 h LYS 459 Ca -0.43 0.00 -0.50 0.00 -0.00 0.00 0.00 60.65 59.72 2c44 h LYS 459 Cb 1.25 0.00 -0.29 0.00 -0.00 0.00 0.00 32.23 33.19 2c44 h LYS 459 CO 0.46 0.45 -0.82 0.54 -0.00 0.00 0.00 179.45 180.08 2c44 s VAL 460 N -2.98 1.19 -1.61 0.07 0.11 -1.26 -4.81 120.40 111.11 2c44 s VAL 460 Ca 0.03 -0.66 -0.09 0.00 -2.93 0.00 0.00 61.98 58.33 2c44 s VAL 460 Cb 0.08 -1.00 0.09 0.00 -1.53 0.00 0.00 36.38 34.02 2c44 s VAL 460 CO 0.75 0.32 0.45 0.18 -3.33 0.00 0.00 175.10 173.47 2c44 n LEU 461 N 2.67 -1.51 -0.32 2.54 4.77 -1.26 -4.84 117.00 119.04 2c44 n LEU 461 Ca -0.14 -1.12 0.18 0.00 -0.03 0.00 0.00 56.01 54.90 2c44 n LEU 461 Cb 0.55 -1.92 0.38 0.00 -2.33 0.00 0.00 43.42 40.10 2c44 n LEU 461 CO 0.24 0.35 1.05 0.08 -1.33 0.00 0.00 177.39 177.78 2c44 h ARG 462 N -1.57 0.32 -0.32 3.23 0.11 -1.87 -2.91 114.38 111.37 2c44 h ARG 462 Ca -0.62 -0.02 0.09 0.00 0.10 0.00 0.00 59.98 59.53 2c44 h ARG 462 Cb 1.39 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.38 2c44 h ARG 462 CO 0.74 0.21 0.36 1.12 0.10 0.00 0.00 179.97 182.50 2c44 h HIS 463 N 0.33 0.00 -0.18 4.08 2.07 -1.88 -1.78 115.15 117.78 2c44 h HIS 463 Ca 0.64 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 58.01 2c44 h HIS 463 Cb 1.36 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.33 2c44 h HIS 463 CO -0.11 0.00 -0.53 0.74 -3.07 0.00 0.00 177.93 174.96 2c44 h PHE 464 N 0.00 0.66 0.00 6.12 -1.00 -1.89 -3.38 116.94 117.45 2c44 h PHE 464 Ca 0.15 -0.23 0.00 0.00 2.81 0.00 0.00 57.97 60.70 2c44 h PHE 464 Cb 0.87 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.30 2c44 h PHE 464 CO 0.00 0.94 -0.02 0.25 -1.61 0.00 0.00 178.31 177.87 2c44 n THR 465 N -3.96 0.49 -1.41 -1.55 -2.24 -1.08 -4.68 114.28 99.84 2c44 n THR 465 Ca -0.03 -0.50 -0.31 0.00 -2.27 0.00 0.00 64.05 60.94 2c44 n THR 465 Cb 0.59 0.72 0.08 0.00 -2.10 0.00 0.00 70.33 69.62 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 -0.53 2.34 0.01 6.98 0.00 -0.69 -4.92 121.76 124.95 2c44 s ALA 466 Ca 0.01 0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.12 2c44 s ALA 466 Cb 0.01 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.91 2c44 s ALA 466 CO 0.00 -1.62 -0.15 0.15 0.00 0.00 0.00 175.76 174.14 2c44 s LYS 467 N -5.00 1.15 0.38 0.00 1.02 -0.61 -4.74 119.74 111.95 2c44 s LYS 467 Ca 0.60 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 56.00 2c44 s LYS 467 Cb -0.16 -1.14 -0.03 0.00 -0.52 0.00 0.00 37.83 35.99 2c44 s LYS 467 CO 0.55 0.30 0.15 -0.51 -0.92 0.00 0.00 175.35 174.93 2c44 s LEU 468 N -0.63 1.91 0.06 3.17 1.02 0.21 -1.28 118.68 123.14 2c44 s LEU 468 Ca 0.05 -1.66 -0.08 0.00 0.02 0.00 0.00 54.13 52.46 2c44 s LEU 468 Cb -0.07 0.03 -0.00 0.00 0.02 0.00 0.00 46.19 46.17 2c44 s LEU 468 CO 0.00 -0.93 0.17 -1.59 0.02 0.00 0.00 176.35 174.02 2c44 s LYS 469 N -3.70 0.73 0.07 1.70 -2.85 -0.04 -4.04 119.74 111.62 2c44 s LYS 469 Ca 0.28 -0.78 -0.31 0.00 -1.00 0.00 0.00 55.97 54.16 2c44 s LYS 469 Cb 0.03 0.30 -0.08 0.00 -2.06 0.00 0.00 37.83 36.02 2c44 s LYS 469 CO 0.17 -0.21 1.53 -1.21 0.10 0.00 0.00 175.35 175.72 2c44 s GLU 470 N -3.08 4.24 0.00 1.78 2.02 -1.26 -1.21 118.70 121.20 2c44 s GLU 470 Ca -0.01 2.19 0.12 0.00 0.02 0.00 0.00 54.97 57.29 2c44 s GLU 470 Cb 0.01 -3.47 0.72 0.00 0.10 0.00 0.00 34.13 31.49 2c44 s GLU 470 CO -0.07 -0.63 1.15 1.33 0.02 0.00 0.00 175.26 177.07