#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fja s TYR 3 N 0.00 1.01 -0.44 3.52 5.04 -1.26 -5.09 117.35 120.13 2fja s TYR 3 Ca 0.00 -0.35 0.03 0.00 -2.44 0.00 0.00 57.07 54.31 2fja s TYR 3 Cb 0.00 -0.84 0.13 0.00 0.35 0.00 0.00 41.96 41.59 2fja s TYR 3 CO 0.00 -0.25 0.21 1.52 -1.34 0.00 0.00 175.55 175.68 2fja s TYR 4 N 0.97 2.59 0.44 4.97 -0.85 -1.26 -5.07 117.35 119.14 2fja s TYR 4 Ca -0.10 -2.69 -0.26 0.00 -0.52 0.00 0.00 57.07 53.51 2fja s TYR 4 Cb -0.14 -2.32 -0.09 0.00 0.38 0.00 0.00 41.96 39.78 2fja s TYR 4 CO 0.00 -0.80 1.43 -1.25 -1.52 0.00 0.00 175.55 173.42 2fja s PRO 5 N 0.33 3.77 0.13 -3.49 0.04 -1.26 -4.92 135.00 129.60 2fja s PRO 5 Ca 0.16 2.44 -0.13 0.00 0.04 0.00 0.00 61.00 63.50 2fja s PRO 5 Cb -0.24 -2.71 -0.02 0.00 0.04 0.00 0.00 34.50 31.57 2fja s PRO 5 CO -0.03 -0.76 1.53 -0.22 0.04 0.00 0.00 177.00 177.56 2fja h LYS 6 N 2.45 0.80 -3.42 4.56 1.63 -2.00 -3.46 116.57 117.13 2fja h LYS 6 Ca -0.51 -0.31 -0.08 0.00 -0.85 0.00 0.00 60.65 58.90 2fja h LYS 6 Cb 1.26 -0.04 -0.15 0.00 -0.60 0.00 0.00 32.23 32.69 2fja h LYS 6 CO 0.62 0.93 -0.23 -1.59 -3.45 0.00 0.00 179.45 175.72 2fja s LYS 7 N -4.78 0.87 0.62 1.90 0.00 -1.26 -5.16 119.74 111.93 2fja s LYS 7 Ca -0.12 -0.64 -0.16 0.00 0.00 0.00 0.00 55.97 55.04 2fja s LYS 7 Cb 0.10 0.37 -0.02 0.00 0.00 0.00 0.00 37.83 38.29 2fja s LYS 7 CO 0.82 -0.29 1.11 0.71 0.00 0.00 0.00 175.35 177.70 2fja s TYR 8 N -3.09 2.68 -0.45 1.78 4.12 -1.26 -4.86 117.35 116.26 2fja s TYR 8 Ca -0.01 1.55 0.06 0.00 0.02 0.00 0.00 57.07 58.69 2fja s TYR 8 Cb 0.01 -3.18 0.22 0.00 -1.52 0.00 0.00 41.96 37.49 2fja s TYR 8 CO -0.07 -1.59 0.65 -1.91 0.02 0.00 0.00 175.55 172.65 2fja n GLU 9 N -2.07 0.60 -4.16 -0.62 2.13 -0.33 -4.99 120.64 111.20 2fja n GLU 9 Ca 0.10 -2.49 -0.35 0.00 0.66 0.00 0.00 57.16 55.09 2fja n GLU 9 Cb 0.52 -1.43 -0.08 0.00 0.27 0.00 0.00 31.44 30.72 2fja n GLU 9 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2fja s LEU 10 N -0.37 3.90 -0.01 4.31 1.43 -1.26 -3.89 118.68 122.79 2fja s LEU 10 Ca 0.33 0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.63 2fja s LEU 10 Cb 0.13 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.33 2fja s LEU 10 CO -0.16 0.36 0.08 -0.31 0.23 0.00 0.00 176.35 176.55 2fja s TYR 11 N -1.01 0.02 -0.04 0.29 1.51 -1.26 -5.14 117.35 111.71 2fja s TYR 11 Ca 0.16 -0.03 -0.08 0.00 -1.01 0.00 0.00 57.07 56.11 2fja s TYR 11 Cb -0.12 -0.04 -0.05 0.00 -0.11 0.00 0.00 41.96 41.65 2fja s TYR 11 CO 0.06 -0.15 0.25 0.15 -1.11 0.00 0.00 175.55 174.75 2fja s LYS 12 N -0.69 3.59 0.24 -0.62 1.02 -1.26 -4.51 119.74 117.51 2fja s LYS 12 Ca -0.08 -0.00 -0.14 0.00 0.02 0.00 0.00 55.97 55.78 2fja s LYS 12 Cb -0.05 -3.15 0.30 0.00 -0.52 0.00 0.00 37.83 34.42 2fja s LYS 12 CO 0.00 0.70 1.58 0.00 -0.92 0.00 0.00 175.35 176.72 2fja h ALA 13 N 4.48 0.37 0.00 5.17 0.00 -1.87 0.22 119.26 127.64 2fja h ALA 13 Ca -0.52 0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2fja h ALA 13 Cb 1.21 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2fja h ALA 13 CO 0.62 -0.50 0.00 -0.44 0.00 0.00 0.00 179.25 178.94 2fja h ASP 14 N -0.03 0.00 0.58 0.00 3.32 -1.94 -1.43 116.42 116.92 2fja h ASP 14 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 2fja h ASP 14 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 2fja h ASP 14 CO -0.87 0.00 -0.65 -0.62 -1.72 0.00 0.00 179.24 175.37 2fja n GLU 15 N -2.49 0.14 -3.09 3.56 1.02 0.77 -4.88 120.64 115.66 2fja n GLU 15 Ca -0.01 0.02 -0.40 0.00 -0.02 0.00 0.00 57.16 56.76 2fja n GLU 15 Cb 0.12 -1.57 -0.05 0.00 -0.02 0.00 0.00 31.44 29.92 2fja n GLU 15 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2fja s VAL 16 N -3.09 5.05 0.37 2.62 1.01 -0.54 -4.96 120.40 120.86 2fja s VAL 16 Ca 0.08 1.31 -0.25 0.00 0.00 0.00 0.00 61.98 63.12 2fja s VAL 16 Cb 0.16 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.46 2fja s VAL 16 CO 0.73 0.20 1.05 -2.16 0.00 0.00 0.00 175.10 174.92 2fja s PRO 17 N 1.20 4.27 -0.14 2.72 0.04 -1.26 -4.81 135.00 137.03 2fja s PRO 17 Ca 0.33 1.54 -0.07 0.00 0.04 0.00 0.00 61.00 62.85 2fja s PRO 17 Cb -0.17 -2.67 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 2fja s PRO 17 CO 0.14 -0.05 0.10 0.99 0.04 0.00 0.00 177.00 178.22 2fja s THR 18 N -1.57 5.15 -0.20 1.26 2.01 -1.26 -1.07 115.64 119.95 2fja s THR 18 Ca 0.55 0.08 -0.00 0.00 0.31 0.00 0.00 61.69 62.63 2fja s THR 18 Cb -0.23 -3.26 0.02 0.00 0.01 0.00 0.00 72.50 69.03 2fja s THR 18 CO 0.29 0.56 -0.15 -0.70 -0.69 0.00 0.00 174.62 173.94 2fja s GLU 19 N -0.56 3.01 -0.14 4.92 2.12 0.83 -4.94 118.70 123.94 2fja s GLU 19 Ca 0.12 -0.83 -0.13 0.00 0.36 0.00 0.00 54.97 54.48 2fja s GLU 19 Cb -0.12 -2.71 -0.05 0.00 0.26 0.00 0.00 34.13 31.52 2fja s GLU 19 CO 0.02 -0.24 0.29 0.08 -0.54 0.00 0.00 175.26 174.87 2fja s VAL 20 N 1.32 5.29 -0.17 3.70 1.01 -1.26 -1.58 120.40 128.72 2fja s VAL 20 Ca 0.04 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.57 2fja s VAL 20 Cb -0.14 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.65 2fja s VAL 20 CO -0.10 0.43 -0.14 -0.69 0.00 0.00 0.00 175.10 174.60 2fja s VAL 21 N 0.18 1.65 -0.18 2.92 1.01 0.23 -4.96 120.40 121.25 2fja s VAL 21 Ca 0.17 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.28 2fja s VAL 21 Cb -0.13 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 2fja s VAL 21 CO 0.05 0.38 0.09 -1.61 0.00 0.00 0.00 175.10 174.01 2fja s GLU 22 N 1.44 4.01 0.36 2.72 2.02 -1.26 -0.35 118.70 127.64 2fja s GLU 22 Ca 0.03 -0.29 -0.05 0.00 0.02 0.00 0.00 54.97 54.68 2fja s GLU 22 Cb -0.14 -3.28 0.02 0.00 0.10 0.00 0.00 34.13 30.83 2fja s GLU 22 CO -0.10 0.32 0.55 -0.08 0.02 0.00 0.00 175.26 175.97 2fja s THR 23 N 0.27 0.00 -0.22 3.63 -1.32 -0.49 -4.97 115.64 112.54 2fja s THR 23 Ca 0.06 -1.46 -0.10 0.00 -1.21 0.00 0.00 61.69 58.98 2fja s THR 23 Cb -0.12 -2.71 -0.10 0.00 -1.51 0.00 0.00 72.50 68.07 2fja s THR 23 CO -0.00 0.00 -0.27 0.47 -2.21 0.00 0.00 174.62 172.60 2fja n ASP 24 N -1.44 1.65 -4.18 8.08 8.00 -0.73 -3.86 116.55 124.07 2fja n ASP 24 Ca -0.01 0.23 -0.34 0.00 0.71 0.00 0.00 54.79 55.38 2fja n ASP 24 Cb 0.61 -0.61 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 2fja n ASP 24 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2fja s ILE 25 N -2.40 2.48 -0.21 0.53 1.01 -0.86 -0.66 121.20 121.09 2fja s ILE 25 Ca -0.30 -0.80 -0.04 0.00 0.00 0.00 0.00 60.65 59.50 2fja s ILE 25 Cb 0.11 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.49 2fja s ILE 25 CO 0.40 0.50 -0.02 -0.22 0.00 0.00 0.00 174.94 175.60 2fja s LEU 26 N 1.35 3.06 -0.30 2.97 2.96 0.23 -0.62 118.68 128.33 2fja s LEU 26 Ca 0.05 -0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 53.56 2fja s LEU 26 Cb -0.13 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 2fja s LEU 26 CO -0.10 0.01 0.15 -0.63 -1.32 0.00 0.00 176.35 174.46 2fja s ILE 27 N 1.30 4.68 -0.49 6.68 1.01 0.86 -0.02 121.20 135.21 2fja s ILE 27 Ca 0.04 -0.32 -0.17 0.00 0.00 0.00 0.00 60.65 60.21 2fja s ILE 27 Cb -0.14 -3.34 0.07 0.00 0.01 0.00 0.00 42.46 39.05 2fja s ILE 27 CO -0.00 0.12 0.47 -0.63 0.00 0.00 0.00 174.94 174.90 2fja s ILE 28 N 1.64 5.12 0.00 2.92 1.01 0.05 -1.29 121.20 130.65 2fja s ILE 28 Ca 0.05 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.76 2fja s ILE 28 Cb -0.17 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.11 2fja s ILE 28 CO 0.07 -0.68 0.00 0.61 0.00 0.00 0.00 174.94 174.94 2fja n GLY 29 N 5.20 2.49 2.42 6.18 0.00 -0.21 -0.38 105.19 120.90 2fja n GLY 29 Ca -0.11 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 2fja n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fja n GLY 30 N 0.58 5.86 0.00 -0.02 0.00 -1.25 -3.89 105.19 106.47 2fja n GLY 30 Ca 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 46.02 43.63 2fja n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fja n GLY 31 N -0.81 1.37 0.14 -0.02 0.00 -1.26 -4.60 105.19 100.01 2fja n GLY 31 Ca 0.59 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 2fja n GLY 31 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2fja h PHE 32 N 0.00 0.48 -0.49 1.61 -1.00 -1.92 -1.25 116.94 114.37 2fja h PHE 32 Ca 0.00 -0.15 -0.10 0.00 2.81 0.00 0.00 57.97 60.53 2fja h PHE 32 Cb 0.00 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 2fja h PHE 32 CO 0.00 0.79 -0.10 0.66 -1.61 0.00 0.00 178.31 178.05 2fja h SER 33 N 0.04 0.93 -0.43 2.17 4.64 -1.89 -1.70 113.55 117.31 2fja h SER 33 Ca 0.02 -0.35 -0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2fja h SER 33 Cb 0.71 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 2fja h SER 33 CO 0.04 1.07 0.25 1.23 -0.87 0.00 0.00 176.83 178.56 2fja h GLY 34 N 0.79 0.63 1.84 -0.77 0.00 -1.67 -0.83 103.07 103.06 2fja h GLY 34 Ca 0.13 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 2fja h GLY 34 CO 0.04 0.26 -0.26 0.00 0.00 0.00 0.00 176.54 176.59 2fja h GLY 36 N 0.94 1.01 0.96 0.00 0.00 -0.69 -0.96 103.07 104.34 2fja h GLY 36 Ca 0.03 -0.74 -0.13 0.00 0.00 0.00 0.00 47.33 46.49 2fja h GLY 36 CO 0.04 0.68 -0.34 0.00 0.00 0.00 0.00 176.54 176.92 2fja h ALA 37 N 1.09 0.38 -0.67 3.60 0.00 -0.49 -2.50 119.26 120.68 2fja h ALA 37 Ca 0.15 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2fja h ALA 37 Cb 0.56 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2fja h ALA 37 CO 0.03 0.43 0.42 0.00 0.00 0.00 0.00 179.25 180.14 2fja h ALA 38 N 0.66 0.85 0.67 0.00 0.00 -0.85 0.18 119.26 120.77 2fja h ALA 38 Ca 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2fja h ALA 38 Cb 0.92 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2fja h ALA 38 CO 0.08 0.30 -0.32 -0.92 0.00 0.00 0.00 179.25 178.39 2fja h TYR 39 N 0.91 -0.83 -0.50 0.00 3.20 -1.16 -2.32 116.97 116.26 2fja h TYR 39 Ca 0.24 -0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.99 2fja h TYR 39 Cb -0.07 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2fja h TYR 39 CO -0.02 -0.52 -0.10 1.49 -1.64 0.00 0.00 178.16 177.37 2fja h GLU 40 N -0.90 0.95 -0.76 1.82 4.57 -1.37 -3.07 114.58 115.82 2fja h GLU 40 Ca -0.09 -0.35 0.05 0.00 -1.18 0.00 0.00 59.36 57.79 2fja h GLU 40 Cb 0.69 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.16 2fja h GLU 40 CO 0.15 1.02 0.46 0.00 -1.18 0.00 0.00 179.01 179.46 2fja h ALA 41 N 0.90 1.03 -0.61 2.92 0.00 -0.65 -1.81 119.26 121.03 2fja h ALA 41 Ca 0.13 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.11 2fja h ALA 41 Cb 0.65 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2fja h ALA 41 CO 0.05 0.20 0.41 0.00 0.00 0.00 0.00 179.25 179.90 2fja h ALA 42 N 1.36 1.88 0.22 0.00 0.00 -1.32 0.13 119.26 121.54 2fja h ALA 42 Ca 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2fja h ALA 42 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2fja h ALA 42 CO -0.16 0.00 -0.10 -0.92 0.00 0.00 0.00 179.25 178.07 2fja h TYR 43 N 0.53 -0.27 0.00 0.00 3.20 -1.31 -3.34 116.97 115.78 2fja h TYR 43 Ca 0.27 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 2fja h TYR 43 Cb 0.39 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 2fja h TYR 43 CO -0.00 0.08 -0.64 -1.49 -1.64 0.00 0.00 178.16 174.47 2fja h TRP 44 N -0.67 0.00 -0.84 -3.82 4.06 -1.34 -3.33 115.95 110.01 2fja h TRP 44 Ca -0.03 0.00 0.20 0.00 2.06 0.00 0.00 58.89 61.12 2fja h TRP 44 Cb 0.47 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.58 2fja h TRP 44 CO 0.04 0.64 0.57 0.00 -3.56 0.00 0.00 178.44 176.13 2fja h ALA 45 N 1.36 2.37 -0.67 1.49 0.00 -0.85 -0.98 119.26 121.99 2fja h ALA 45 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 2fja h ALA 45 Cb 1.48 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 2fja h ALA 45 CO 0.08 -0.63 0.47 0.87 0.00 0.00 0.00 179.25 180.05 2fja h LYS 46 N 0.27 0.13 0.00 0.00 1.57 -1.71 -0.36 116.57 116.47 2fja h LYS 46 Ca 0.42 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 2fja h LYS 46 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2fja h LYS 46 CO -0.11 0.09 0.18 -0.07 -0.57 0.00 0.00 179.45 178.97 2fja h LEU 47 N 0.13 0.00 -1.22 2.94 3.38 -1.44 -2.48 115.31 116.62 2fja h LEU 47 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2fja h LEU 47 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2fja h LEU 47 CO -0.04 0.00 -0.11 0.61 0.09 0.00 0.00 178.44 178.98 2fja n GLY 48 N -1.22 -2.16 2.45 0.83 0.00 -0.26 -4.99 105.19 99.85 2fja n GLY 48 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 2fja n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fja n GLY 49 N 0.00 0.47 3.77 -0.02 0.00 -0.53 -4.93 105.19 103.94 2fja n GLY 49 Ca 0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2fja n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fja s LEU 50 N -5.18 4.11 -0.17 0.99 1.43 -0.74 -4.99 118.68 114.13 2fja s LEU 50 Ca 0.00 2.57 -0.15 0.00 -1.03 0.00 0.00 54.13 55.52 2fja s LEU 50 Cb 0.00 -4.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.14 2fja s LEU 50 CO 0.00 -0.96 0.35 -0.75 0.23 0.00 0.00 176.35 175.22 2fja s LYS 51 N -2.45 4.23 -0.12 1.70 2.20 -1.26 -4.74 119.74 119.30 2fja s LYS 51 Ca 0.61 0.16 -0.02 0.00 -0.36 0.00 0.00 55.97 56.36 2fja s LYS 51 Cb -0.36 -3.48 -0.03 0.00 -1.51 0.00 0.00 37.83 32.46 2fja s LYS 51 CO 0.45 0.11 -0.05 0.08 -0.36 0.00 0.00 175.35 175.58 2fja s VAL 52 N 0.84 3.84 -0.04 4.02 1.01 -1.26 -1.76 120.40 127.04 2fja s VAL 52 Ca 0.18 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.79 2fja s VAL 52 Cb -0.14 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.61 2fja s VAL 52 CO 0.06 0.54 -0.12 -0.89 0.00 0.00 0.00 175.10 174.70 2fja s THR 53 N -0.17 1.03 -0.16 3.92 2.01 0.21 -4.82 115.64 117.66 2fja s THR 53 Ca 0.03 -0.46 0.00 0.00 0.31 0.00 0.00 61.69 61.57 2fja s THR 53 Cb -0.13 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.46 2fja s THR 53 CO 0.03 0.32 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.89 2fja s LEU 54 N 0.37 2.40 -0.09 4.42 2.96 -0.05 -0.10 118.68 128.60 2fja s LEU 54 Ca -0.08 -0.51 0.03 0.00 -0.22 0.00 0.00 54.13 53.34 2fja s LEU 54 Cb -0.12 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.00 2fja s LEU 54 CO 0.02 0.06 -0.16 0.54 -1.32 0.00 0.00 176.35 175.49 2fja s VAL 55 N 0.96 2.81 -0.02 1.68 0.11 -0.41 -0.13 120.40 125.40 2fja s VAL 55 Ca -0.03 -0.78 0.01 0.00 -2.93 0.00 0.00 61.98 58.25 2fja s VAL 55 Cb -0.15 -2.12 0.01 0.00 -1.53 0.00 0.00 36.38 32.59 2fja s VAL 55 CO -0.03 0.56 -0.04 -0.70 -3.33 0.00 0.00 175.10 171.56 2fja s GLU 56 N -0.14 0.47 0.39 1.54 2.56 0.95 -1.04 118.70 123.42 2fja s GLU 56 Ca -0.02 -0.11 0.20 0.00 0.00 0.00 0.00 54.97 55.04 2fja s GLU 56 Cb -0.14 -0.49 0.73 0.00 2.00 0.00 0.00 34.13 36.23 2fja s GLU 56 CO 0.04 0.02 1.75 1.57 -0.56 0.00 0.00 175.26 178.08 2fja h LYS 57 N 6.49 0.00 0.00 4.30 2.10 -1.81 0.60 116.57 128.25 2fja h LYS 57 Ca -0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 2fja h LYS 57 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 2fja h LYS 57 CO 0.49 0.33 0.00 0.00 -2.00 0.00 0.00 179.45 178.27 2fja n ALA 58 N -2.27 0.00 -3.74 0.07 0.00 -1.26 -3.09 120.51 110.22 2fja n ALA 58 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2fja n ALA 58 Cb 0.49 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.78 2fja n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fja s ALA 59 N -2.21 2.22 0.49 0.00 0.00 -1.26 -1.57 121.76 119.43 2fja s ALA 59 Ca 0.00 -1.08 0.25 0.00 0.00 0.00 0.00 51.96 51.12 2fja s ALA 59 Cb 0.00 -1.01 1.31 0.00 0.00 0.00 0.00 23.12 23.42 2fja s ALA 59 CO 0.00 -0.09 1.91 0.28 0.00 0.00 0.00 175.76 177.86 2fja h VAL 60 N 5.86 0.66 -0.97 0.00 2.07 -1.94 0.11 116.25 122.04 2fja h VAL 60 Ca -0.35 -0.05 0.19 0.00 0.82 0.00 0.00 66.70 67.31 2fja h VAL 60 Cb 1.18 0.49 -0.09 0.00 -1.52 0.00 0.00 31.29 31.35 2fja h VAL 60 CO 0.56 0.03 0.61 -0.08 0.02 0.00 0.00 177.57 178.71 2fja h GLU 61 N 0.15 0.63 0.00 1.57 4.81 -1.91 -3.25 114.58 116.59 2fja h GLU 61 Ca 0.39 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2fja h GLU 61 Cb 1.31 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2fja h GLU 61 CO -0.06 0.42 0.00 0.54 -0.73 0.00 0.00 179.01 179.18 2fja n ARG 62 N -4.65 0.41 -2.04 1.92 5.12 -0.95 -2.42 116.66 114.05 2fja n ARG 62 Ca 0.21 -0.53 -0.36 0.00 -1.93 0.00 0.00 57.85 55.24 2fja n ARG 62 Cb 0.60 -0.66 0.03 0.00 -1.16 0.00 0.00 32.46 31.27 2fja n ARG 62 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2fja s SER 63 N -0.18 5.31 0.00 0.55 1.04 -0.02 -3.65 113.70 116.76 2fja s SER 63 Ca 0.00 2.40 0.00 0.00 0.48 0.00 0.00 55.95 58.83 2fja s SER 63 Cb 0.00 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.52 2fja s SER 63 CO 0.00 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.32 2fja n GLY 64 N 0.50 -2.01 0.33 7.32 0.00 -1.26 -4.43 105.19 105.64 2fja n GLY 64 Ca 0.13 -1.69 0.18 0.00 0.00 0.00 0.00 46.02 44.63 2fja n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fja h ALA 65 N 0.00 1.56 -0.51 4.61 0.00 -1.94 -2.46 119.26 120.52 2fja h ALA 65 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2fja h ALA 65 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2fja h ALA 65 CO 0.00 -0.20 0.01 0.28 0.00 0.00 0.00 179.25 179.35 2fja n VAL 66 N -3.57 2.40 -0.31 0.00 0.31 -1.26 -4.56 118.33 111.33 2fja n VAL 66 Ca -0.00 -1.22 0.09 0.00 -0.01 0.00 0.00 64.34 63.19 2fja n VAL 66 Cb 0.25 -0.32 0.25 0.00 -0.91 0.00 0.00 33.84 33.11 2fja n VAL 66 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fja h ALA 67 N 3.67 1.39 0.00 3.52 0.00 -1.51 -0.24 119.26 126.09 2fja h ALA 67 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2fja h ALA 67 Cb 1.81 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.55 2fja h ALA 67 CO 0.44 -0.05 -0.48 1.04 0.00 0.00 0.00 179.25 180.19 2fja n GLN 68 N -4.82 0.13 0.00 0.00 6.02 -1.26 -4.95 117.38 112.49 2fja n GLN 68 Ca 0.19 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 2fja n GLN 68 Cb 0.46 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 30.13 2fja n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fja n GLY 69 N 1.43 -3.02 3.11 1.08 0.00 -0.10 -4.20 105.19 103.48 2fja n GLY 69 Ca 0.05 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.85 2fja n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fja s LEU 70 N 0.00 2.44 0.00 0.99 1.43 -0.69 -4.22 118.68 118.64 2fja s LEU 70 Ca 0.00 -0.89 0.22 0.00 -1.03 0.00 0.00 54.13 52.43 2fja s LEU 70 Cb 0.00 0.02 -0.05 0.00 0.03 0.00 0.00 46.19 46.19 2fja s LEU 70 CO 0.00 -0.46 1.03 -1.20 0.23 0.00 0.00 176.35 175.95 2fja n SER 71 N 0.38 1.13 -3.68 2.29 7.64 -1.26 -2.74 113.62 117.39 2fja n SER 71 Ca -0.15 -1.00 -0.09 0.00 1.01 0.00 0.00 58.87 58.63 2fja n SER 71 Cb 0.59 0.77 -0.03 0.00 -1.01 0.00 0.00 64.21 64.54 2fja n SER 71 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fja s ALA 72 N -2.88 -1.26 -0.35 -0.43 0.00 -1.26 -1.47 121.76 114.11 2fja s ALA 72 Ca 0.11 -0.02 -0.07 0.00 0.00 0.00 0.00 51.96 51.98 2fja s ALA 72 Cb 0.17 0.87 0.04 0.00 0.00 0.00 0.00 23.12 24.19 2fja s ALA 72 CO 0.78 -0.88 0.13 0.42 0.00 0.00 0.00 175.76 176.20 2fja s ILE 73 N -3.85 3.96 -0.99 0.00 1.01 0.07 -4.88 121.20 116.52 2fja s ILE 73 Ca 0.07 -1.07 0.18 0.00 0.00 0.00 0.00 60.65 59.83 2fja s ILE 73 Cb -0.03 -3.24 0.15 0.00 0.01 0.00 0.00 42.46 39.35 2fja s ILE 73 CO -0.03 -0.19 1.57 0.59 0.00 0.00 0.00 174.94 176.88 2fja n ASN 74 N 4.85 0.01 -3.70 3.58 3.02 -1.26 -1.67 115.26 120.10 2fja n ASN 74 Ca -0.12 0.50 -0.29 0.00 -0.03 0.00 0.00 54.58 54.64 2fja n ASN 74 Cb 0.45 -0.51 -0.16 0.00 -0.61 0.00 0.00 39.78 38.96 2fja n ASN 74 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2fja s THR 75 N -3.01 0.55 -0.24 3.41 2.01 -1.23 -3.99 115.64 113.14 2fja s THR 75 Ca 0.08 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.16 2fja s THR 75 Cb 0.12 -1.26 0.12 0.00 0.01 0.00 0.00 72.50 71.49 2fja s THR 75 CO 0.32 -0.47 0.32 -0.47 -0.69 0.00 0.00 174.62 173.63 2fja s TYR 76 N 1.81 -0.61 0.01 4.92 5.04 -0.28 -4.73 117.35 123.51 2fja s TYR 76 Ca 0.05 0.42 -0.25 0.00 -2.44 0.00 0.00 57.07 54.84 2fja s TYR 76 Cb -0.17 -0.20 -0.18 0.00 0.35 0.00 0.00 41.96 41.75 2fja s TYR 76 CO -0.19 -0.75 1.36 0.82 -1.34 0.00 0.00 175.55 175.45 2fja h ILE 77 N 6.23 1.17 -3.82 3.14 1.08 -1.90 -3.42 117.51 119.99 2fja h ILE 77 Ca -0.17 -0.80 0.00 0.00 -0.39 0.00 0.00 64.86 63.50 2fja h ILE 77 Cb 1.14 1.69 0.00 0.00 -3.07 0.00 0.00 36.82 36.58 2fja h ILE 77 CO 0.29 0.20 -0.30 -0.67 -0.69 0.00 0.00 178.15 176.98 2fja n ASP 78 N -4.96 -4.26 -0.55 1.72 2.03 -1.26 -2.96 116.55 106.30 2fja n ASP 78 Ca -0.08 0.41 0.13 0.00 0.52 0.00 0.00 54.79 55.77 2fja n ASP 78 Cb 0.21 -2.65 0.38 0.00 -0.72 0.00 0.00 41.12 38.34 2fja n ASP 78 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2fja n LEU 79 N -0.01 1.79 0.00 -2.67 4.77 -1.26 -2.34 117.00 117.28 2fja n LEU 79 Ca 0.02 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 2fja n LEU 79 Cb 0.07 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2fja n LEU 79 CO 0.17 0.30 -0.39 0.35 -1.33 0.00 0.00 177.39 176.50 2fja n THR 80 N 0.30 0.00 0.00 -5.08 -2.24 -1.26 -4.99 114.28 101.00 2fja n THR 80 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2fja n THR 80 Cb 0.41 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 2fja n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fja n GLY 81 N 2.02 1.61 0.18 3.38 0.00 -1.26 -5.00 105.19 106.12 2fja n GLY 81 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2fja n GLY 81 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fja h ARG 82 N 0.00 0.00 -5.87 1.61 3.08 -1.93 -3.46 114.38 107.81 2fja h ARG 82 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 2fja h ARG 82 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2fja h ARG 82 CO 0.00 0.00 -0.30 -1.54 -1.07 0.00 0.00 179.97 177.06 2fja s SER 83 N -5.59 4.58 0.12 7.04 1.04 -1.26 -0.46 113.70 119.17 2fja s SER 83 Ca 0.08 -1.33 0.19 0.00 0.48 0.00 0.00 55.95 55.37 2fja s SER 83 Cb 0.08 0.57 0.78 0.00 0.10 0.00 0.00 66.02 67.55 2fja s SER 83 CO 0.64 -1.17 1.57 -0.62 0.98 0.00 0.00 173.24 174.65 2fja n GLU 84 N -1.79 0.09 -3.67 4.02 1.02 -0.80 -4.63 120.64 114.88 2fja n GLU 84 Ca -0.03 0.33 -0.12 0.00 -0.02 0.00 0.00 57.16 57.32 2fja n GLU 84 Cb 0.65 -1.67 -0.12 0.00 -0.02 0.00 0.00 31.44 30.27 2fja n GLU 84 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2fja s ARG 85 N -3.15 0.21 0.22 3.49 3.52 -1.26 -5.03 118.95 116.95 2fja s ARG 85 Ca 0.06 0.78 -0.14 0.00 -0.13 0.00 0.00 55.73 56.29 2fja s ARG 85 Cb 0.09 0.03 -0.08 0.00 -1.56 0.00 0.00 34.95 33.43 2fja s ARG 85 CO 0.32 -0.25 0.61 -0.65 -0.81 0.00 0.00 175.30 174.52 2fja s GLN 86 N 2.20 3.97 0.22 5.12 -0.21 -1.26 -4.78 119.66 124.93 2fja s GLN 86 Ca -0.02 0.52 0.00 0.00 0.02 0.00 0.00 55.36 55.88 2fja s GLN 86 Cb -0.11 -2.74 -0.05 0.00 1.00 0.00 0.00 33.01 31.11 2fja s GLN 86 CO -0.10 0.36 0.10 -0.80 -2.12 0.00 0.00 175.29 172.73 2fja s ASN 87 N -2.01 0.74 0.24 5.90 0.01 -0.99 -5.05 114.94 113.78 2fja s ASN 87 Ca 0.45 -1.37 0.08 0.00 -0.71 0.00 0.00 52.86 51.31 2fja s ASN 87 Cb -0.13 0.25 -0.04 0.00 0.41 0.00 0.00 41.25 41.74 2fja s ASN 87 CO 0.20 -0.77 0.05 0.42 -1.51 0.00 0.00 177.10 175.49 2fja s THR 88 N -3.93 3.77 0.27 1.60 -4.23 -1.26 -4.52 115.64 107.35 2fja s THR 88 Ca 0.37 -1.65 0.04 0.00 -1.18 0.00 0.00 61.69 59.26 2fja s THR 88 Cb 0.07 -2.99 0.03 0.00 1.34 0.00 0.00 72.50 70.95 2fja s THR 88 CO 0.12 -0.30 1.67 -0.07 -0.54 0.00 0.00 174.62 175.50 2fja h LEU 89 N 2.01 0.38 -0.76 4.79 3.38 -1.97 -2.64 115.31 120.49 2fja h LEU 89 Ca -0.46 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.28 2fja h LEU 89 Cb 1.23 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 2fja h LEU 89 CO 0.60 0.74 0.15 -0.33 0.09 0.00 0.00 178.44 179.68 2fja h GLU 90 N 0.30 1.08 -0.35 1.13 3.07 -1.96 -1.11 114.58 116.75 2fja h GLU 90 Ca 0.03 -0.26 -0.09 0.00 -0.50 0.00 0.00 59.36 58.53 2fja h GLU 90 Cb 0.83 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 2fja h GLU 90 CO 0.07 0.97 -0.17 -0.44 -1.40 0.00 0.00 179.01 178.03 2fja h ASP 91 N 1.03 0.64 -0.20 1.42 3.32 -1.87 -1.68 116.42 119.07 2fja h ASP 91 Ca 0.21 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 2fja h ASP 91 Cb 0.38 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2fja h ASP 91 CO 0.00 0.82 -0.09 0.22 -1.72 0.00 0.00 179.24 178.48 2fja h TYR 92 N 0.58 0.48 -0.36 4.55 3.20 -1.10 -0.95 116.97 123.38 2fja h TYR 92 Ca 0.09 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 61.86 2fja h TYR 92 Cb 0.62 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 2fja h TYR 92 CO 0.03 0.70 0.21 0.28 -1.64 0.00 0.00 178.16 177.74 2fja h VAL 93 N 0.13 1.04 -0.42 1.81 2.07 -1.10 -1.30 116.25 118.48 2fja h VAL 93 Ca 0.05 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2fja h VAL 93 Cb 0.57 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 2fja h VAL 93 CO 0.03 0.08 0.19 -0.09 0.02 0.00 0.00 177.57 177.80 2fja h ARG 94 N 0.43 0.38 -0.66 1.57 2.43 -1.27 -1.08 114.38 116.19 2fja h ARG 94 Ca 0.14 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 2fja h ARG 94 Cb -0.00 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.40 2fja h ARG 94 CO -0.06 0.25 0.34 -0.92 -1.51 0.00 0.00 179.97 178.07 2fja h TYR 95 N 0.39 0.61 -0.13 2.20 3.20 -0.63 -0.66 116.97 121.94 2fja h TYR 95 Ca 0.18 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.01 2fja h TYR 95 Cb 0.11 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 2fja h TYR 95 CO -0.11 0.26 -0.20 0.28 -1.64 0.00 0.00 178.16 176.74 2fja h VAL 96 N 0.61 1.36 -0.66 1.81 2.07 -0.78 -1.69 116.25 118.97 2fja h VAL 96 Ca 0.31 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.42 2fja h VAL 96 Cb 0.26 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.98 2fja h VAL 96 CO -0.22 0.42 0.43 0.74 0.02 0.00 0.00 177.57 178.95 2fja h THR 97 N -0.03 1.12 -0.60 2.57 2.02 -1.02 -0.97 112.91 116.01 2fja h THR 97 Ca 0.01 -0.29 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 2fja h THR 97 Cb 0.76 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2fja h THR 97 CO 0.05 0.15 0.01 -0.07 0.37 0.00 0.00 175.52 176.03 2fja h LEU 98 N 0.85 1.01 -1.51 2.58 3.38 -1.12 0.16 115.31 120.66 2fja h LEU 98 Ca 0.26 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2fja h LEU 98 Cb -0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2fja h LEU 98 CO -0.08 1.05 -0.06 -0.78 0.09 0.00 0.00 178.44 178.66 2fja h ASP 99 N 0.95 0.22 -0.12 -0.43 1.82 -0.71 0.19 116.42 118.34 2fja h ASP 99 Ca 0.17 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.78 2fja h ASP 99 Cb 0.53 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.48 2fja h ASP 99 CO 0.03 0.32 0.00 0.23 -1.61 0.00 0.00 179.24 178.21 2fja n MET 100 N -4.34 1.31 -3.23 0.28 2.81 -0.42 -4.45 117.12 109.09 2fja n MET 100 Ca -0.01 -0.45 -0.23 0.00 -1.81 0.00 0.00 57.70 55.20 2fja n MET 100 Cb 0.22 -1.13 0.05 0.00 -0.71 0.00 0.00 33.22 31.64 2fja n MET 100 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2fja n MET 101 N -0.12 -5.74 0.00 0.03 2.81 0.06 -2.81 117.12 111.34 2fja n MET 101 Ca 0.04 0.86 0.00 0.00 -1.81 0.00 0.00 57.70 56.79 2fja n MET 101 Cb 0.12 -5.78 0.00 0.00 -0.71 0.00 0.00 33.22 26.86 2fja n MET 101 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2fja n GLY 102 N -1.66 0.98 3.09 3.03 0.00 0.53 -5.01 105.19 106.15 2fja n GLY 102 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2fja n GLY 102 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fja s LEU 103 N 0.00 4.98 -0.14 0.99 1.43 -1.12 -4.96 118.68 119.86 2fja s LEU 103 Ca 0.00 -2.01 -0.16 0.00 -1.03 0.00 0.00 54.13 50.93 2fja s LEU 103 Cb 0.00 -1.75 0.04 0.00 0.03 0.00 0.00 46.19 44.51 2fja s LEU 103 CO 0.00 -0.47 0.43 0.00 0.23 0.00 0.00 176.35 176.55 2fja s ALA 104 N 1.07 -1.08 -0.99 4.21 0.00 -1.26 -4.79 121.76 118.91 2fja s ALA 104 Ca 0.08 1.10 -0.23 0.00 0.00 0.00 0.00 51.96 52.91 2fja s ALA 104 Cb -0.21 -0.56 0.04 0.00 0.00 0.00 0.00 23.12 22.39 2fja s ALA 104 CO -0.05 -0.23 1.46 1.03 0.00 0.00 0.00 175.76 177.97 2fja s ARG 105 N -0.09 3.52 0.58 0.00 1.81 0.10 -4.83 118.95 120.03 2fja s ARG 105 Ca -0.03 -1.02 0.27 0.00 -1.72 0.00 0.00 55.73 53.23 2fja s ARG 105 Cb -0.03 -5.26 1.70 0.00 -0.45 0.00 0.00 34.95 30.91 2fja s ARG 105 CO 0.02 -2.25 2.21 0.93 -0.68 0.00 0.00 175.30 175.53 2fja h GLU 106 N 9.88 0.00 -0.34 3.54 5.08 -1.88 0.15 114.58 131.01 2fja h GLU 106 Ca 0.16 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2fja h GLU 106 Cb 1.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2fja h GLU 106 CO 1.41 0.00 -0.20 0.38 -1.00 0.00 0.00 179.01 179.60 2fja h ASP 107 N 0.00 0.65 0.10 1.42 2.03 -1.88 0.62 116.42 119.36 2fja h ASP 107 Ca 0.02 -0.22 -0.26 0.00 -0.73 0.00 0.00 57.03 55.84 2fja h ASP 107 Cb 0.09 -0.18 0.02 0.00 -0.83 0.00 0.00 39.33 38.43 2fja h ASP 107 CO -0.00 0.85 -1.03 -0.07 -1.03 0.00 0.00 179.24 177.96 2fja h LEU 108 N 0.57 0.81 -0.18 0.15 3.38 -1.37 -2.58 115.31 116.10 2fja h LEU 108 Ca 0.09 -0.66 -0.07 0.00 0.09 0.00 0.00 57.88 57.33 2fja h LEU 108 Cb 0.66 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2fja h LEU 108 CO 0.05 1.46 -0.16 0.58 0.09 0.00 0.00 178.44 180.45 2fja h VAL 109 N 0.35 1.33 -0.19 1.22 2.07 -1.13 -2.34 116.25 117.56 2fja h VAL 109 Ca -0.12 -1.31 -0.05 0.00 0.82 0.00 0.00 66.70 66.04 2fja h VAL 109 Cb 1.68 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.23 2fja h VAL 109 CO 0.20 0.39 -0.12 0.00 0.02 0.00 0.00 177.57 178.06 2fja h ALA 110 N 0.64 1.44 -0.13 1.67 0.00 -0.98 -1.26 119.26 120.65 2fja h ALA 110 Ca 0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2fja h ALA 110 Cb 0.69 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2fja h ALA 110 CO 0.04 0.39 -0.02 0.22 0.00 0.00 0.00 179.25 179.88 2fja h ASP 111 N 0.29 0.24 0.93 0.00 3.58 -1.31 -1.97 116.42 118.19 2fja h ASP 111 Ca 0.06 -0.35 -0.11 0.00 0.42 0.00 0.00 57.03 57.05 2fja h ASP 111 Cb 0.40 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 2fja h ASP 111 CO 0.02 0.53 -0.53 0.10 -2.88 0.00 0.00 179.24 176.48 2fja h TYR 112 N -0.05 0.00 -0.18 0.28 -0.00 -1.33 -3.18 116.97 112.50 2fja h TYR 112 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.67 2fja h TYR 112 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.13 2fja h TYR 112 CO 0.05 0.53 -0.29 0.00 -0.00 0.00 0.00 178.16 178.45 2fja h ALA 113 N 1.47 1.17 0.00 0.10 0.00 -1.10 0.13 119.26 121.03 2fja h ALA 113 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2fja h ALA 113 Cb 1.14 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2fja h ALA 113 CO 0.07 0.54 0.00 2.89 0.00 0.00 0.00 179.25 182.74 2fja n ARG 114 N -4.11 0.17 -0.05 0.00 1.85 -0.75 -3.76 116.66 110.01 2fja n ARG 114 Ca -0.01 0.15 -0.03 0.00 -1.00 0.00 0.00 57.85 56.96 2fja n ARG 114 Cb 0.41 -1.70 -0.12 0.00 -1.05 0.00 0.00 32.46 29.99 2fja n ARG 114 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2fja n HIS 115 N -2.01 0.00 -0.26 2.89 8.25 -1.00 -4.74 115.22 118.35 2fja n HIS 115 Ca 0.06 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.58 2fja n HIS 115 Cb 0.40 -0.62 0.19 0.00 1.12 0.00 0.00 29.99 31.08 2fja n HIS 115 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2fja h VAL 116 N 0.00 0.62 -0.94 1.59 3.04 -0.84 -2.39 116.25 117.34 2fja h VAL 116 Ca -0.28 -0.14 0.04 0.00 -1.01 0.00 0.00 66.70 65.31 2fja h VAL 116 Cb 1.56 0.18 -0.06 0.00 -2.01 0.00 0.00 31.29 30.96 2fja h VAL 116 CO 0.02 0.07 0.62 0.44 -1.01 0.00 0.00 177.57 177.71 2fja h ASP 117 N 0.41 1.01 -0.87 3.17 5.19 -1.85 -1.61 116.42 121.86 2fja h ASP 117 Ca 0.42 -0.01 0.05 0.00 -0.62 0.00 0.00 57.03 56.87 2fja h ASP 117 Cb 0.66 -0.23 -0.06 0.00 0.18 0.00 0.00 39.33 39.89 2fja h ASP 117 CO -0.43 0.68 0.55 1.23 -3.12 0.00 0.00 179.24 178.16 2fja h GLY 118 N 1.16 1.29 0.94 2.75 0.00 -1.76 -0.71 103.07 106.74 2fja h GLY 118 Ca 0.38 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2fja h GLY 118 CO -0.12 0.32 0.14 -0.84 0.00 0.00 0.00 176.54 176.05 2fja h THR 119 N 1.05 1.15 -0.69 4.70 2.02 -1.31 -2.07 112.91 117.76 2fja h THR 119 Ca 0.36 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 2fja h THR 119 Cb 0.08 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 2fja h THR 119 CO -0.14 0.16 0.43 0.58 0.37 0.00 0.00 175.52 176.92 2fja h VAL 120 N 0.35 1.19 -0.41 3.16 2.07 -0.79 -0.76 116.25 121.05 2fja h VAL 120 Ca 0.10 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2fja h VAL 120 Cb 0.12 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 2fja h VAL 120 CO -0.01 0.20 0.14 0.45 0.02 0.00 0.00 177.57 178.36 2fja h HIS 121 N 0.94 0.60 -0.33 1.57 3.86 -0.97 -1.95 115.15 118.86 2fja h HIS 121 Ca 0.25 -0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.32 2fja h HIS 121 Cb -0.05 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 2fja h HIS 121 CO -0.02 0.49 -0.23 -0.07 0.86 0.00 0.00 177.93 178.96 2fja h LEU 122 N 0.59 0.78 -0.56 2.43 3.38 -0.68 -1.47 115.31 119.79 2fja h LEU 122 Ca 0.14 -0.44 0.09 0.00 0.09 0.00 0.00 57.88 57.76 2fja h LEU 122 Cb 0.17 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.63 2fja h LEU 122 CO -0.01 1.05 0.18 -0.26 0.09 0.00 0.00 178.44 179.50 2fja h PHE 123 N 0.52 0.31 -0.48 1.13 0.04 -0.47 0.34 116.94 118.34 2fja h PHE 123 Ca 0.06 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.81 2fja h PHE 123 Cb 0.79 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.87 2fja h PHE 123 CO 0.06 0.07 0.09 1.49 -0.60 0.00 0.00 178.31 179.42 2fja h GLU 124 N 0.35 0.78 -0.71 1.51 4.81 -1.27 -1.93 114.58 118.11 2fja h GLU 124 Ca 0.28 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 2fja h GLU 124 Cb 0.36 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 2fja h GLU 124 CO -0.31 0.78 0.47 -0.22 -0.73 0.00 0.00 179.01 179.00 2fja h LYS 125 N 0.65 0.74 0.00 1.92 3.11 -0.11 -0.65 116.57 122.23 2fja h LYS 125 Ca 0.15 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.94 2fja h LYS 125 Cb 0.36 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.43 2fja h LYS 125 CO 0.01 0.49 0.00 0.91 -2.81 0.00 0.00 179.45 178.04 2fja n TRP 126 N -4.48 0.00 0.00 1.91 8.01 0.11 -4.88 117.44 118.11 2fja n TRP 126 Ca 0.10 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.29 2fja n TRP 126 Cb 0.21 -0.36 0.00 0.00 -2.01 0.00 0.00 31.31 29.15 2fja n TRP 126 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2fja n GLY 127 N 0.73 1.35 3.69 6.99 0.00 -0.25 -5.06 105.19 112.65 2fja n GLY 127 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2fja n GLY 127 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fja s LEU 128 N 0.00 4.35 -0.29 0.99 2.96 -0.85 -4.94 118.68 120.91 2fja s LEU 128 Ca 0.00 2.41 -0.27 0.00 -0.22 0.00 0.00 54.13 56.06 2fja s LEU 128 Cb 0.00 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.13 2fja s LEU 128 CO 0.00 -0.86 0.94 -2.84 -1.32 0.00 0.00 176.35 172.28 2fja s PRO 129 N 2.61 4.09 -0.16 0.98 0.02 -1.26 -4.44 135.00 136.84 2fja s PRO 129 Ca 0.72 0.96 -0.07 0.00 0.02 0.00 0.00 61.00 62.63 2fja s PRO 129 Cb -0.38 -3.70 -0.04 0.00 0.02 0.00 0.00 34.50 30.40 2fja s PRO 129 CO 0.31 -0.72 0.08 0.42 -0.33 0.00 0.00 177.00 176.76 2fja s ILE 130 N 3.22 4.95 0.28 2.83 1.01 -1.26 -0.68 121.20 131.54 2fja s ILE 130 Ca 0.39 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.76 2fja s ILE 130 Cb -0.14 -3.19 -0.13 0.00 0.01 0.00 0.00 42.46 39.01 2fja s ILE 130 CO 0.11 0.52 1.44 0.79 0.00 0.00 0.00 174.94 177.80 2fja n TRP 131 N 2.98 2.41 -4.11 3.97 7.02 -0.56 -4.92 117.44 124.23 2fja n TRP 131 Ca -0.18 0.41 -0.15 0.00 -1.02 0.00 0.00 57.50 56.56 2fja n TRP 131 Cb 0.53 -2.49 -0.12 0.00 -2.42 0.00 0.00 31.31 26.81 2fja n TRP 131 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2fja s LYS 132 N -0.76 0.66 0.74 -0.99 1.02 -1.26 -1.13 119.74 118.02 2fja s LYS 132 Ca 0.64 -0.85 -0.10 0.00 0.02 0.00 0.00 55.97 55.69 2fja s LYS 132 Cb -0.59 -0.52 0.06 0.00 -0.52 0.00 0.00 37.83 36.26 2fja s LYS 132 CO 0.52 0.11 1.09 0.95 -0.92 0.00 0.00 175.35 177.10 2fja s THR 133 N -1.34 2.39 0.56 2.17 -4.23 0.24 -4.86 115.64 110.57 2fja s THR 133 Ca -0.06 -0.04 0.26 0.00 -1.18 0.00 0.00 61.69 60.66 2fja s THR 133 Cb -0.10 -3.09 0.36 0.00 1.34 0.00 0.00 72.50 71.01 2fja s THR 133 CO 0.01 -0.11 2.06 -0.65 -0.54 0.00 0.00 174.62 175.39 2fja h PRO 134 N -0.78 0.00 0.00 3.99 0.11 -2.01 0.40 132.00 133.70 2fja h PRO 134 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2fja h PRO 134 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2fja h PRO 134 CO 0.63 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 2fja n ASP 135 N -4.09 0.00 0.00 -2.05 5.75 -1.26 -4.91 116.55 110.00 2fja n ASP 135 Ca 0.04 -0.48 0.00 0.00 -0.01 0.00 0.00 54.79 54.34 2fja n ASP 135 Cb 0.41 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 2fja n ASP 135 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fja n GLY 136 N 1.09 0.75 3.81 6.12 0.00 0.14 -5.06 105.19 112.03 2fja n GLY 136 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2fja n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fja s LYS 137 N -0.47 4.35 0.24 1.61 -0.14 -1.26 -4.70 119.74 119.37 2fja s LYS 137 Ca 0.00 1.02 -0.31 0.00 -1.36 0.00 0.00 55.97 55.32 2fja s LYS 137 Cb 0.00 -2.80 -0.11 0.00 -1.68 0.00 0.00 37.83 33.24 2fja s LYS 137 CO 0.00 0.33 1.62 0.71 -0.76 0.00 0.00 175.35 177.24 2fja s TYR 138 N -1.61 2.89 -0.10 3.18 4.12 0.40 -0.59 117.35 125.64 2fja s TYR 138 Ca 0.47 0.62 -0.30 0.00 0.02 0.00 0.00 57.07 57.89 2fja s TYR 138 Cb -0.17 -4.04 -0.02 0.00 -1.52 0.00 0.00 41.96 36.21 2fja s TYR 138 CO 0.21 -3.72 1.21 0.08 0.02 0.00 0.00 175.55 173.35 2fja s VAL 139 N 0.62 4.30 0.28 0.71 1.01 -0.28 -1.90 120.40 125.13 2fja s VAL 139 Ca 0.68 1.60 -0.24 0.00 0.00 0.00 0.00 61.98 64.03 2fja s VAL 139 Cb -0.47 -4.03 -0.09 0.00 0.00 0.00 0.00 36.38 31.78 2fja s VAL 139 CO 0.39 -0.05 0.86 -0.13 0.00 0.00 0.00 175.10 176.16 2fja s ARG 140 N 2.67 4.46 -0.02 2.72 1.81 -1.26 -1.16 118.95 128.17 2fja s ARG 140 Ca 0.55 1.15 -0.02 0.00 -1.72 0.00 0.00 55.73 55.69 2fja s ARG 140 Cb -0.23 -2.84 -0.01 0.00 -0.45 0.00 0.00 34.95 31.43 2fja s ARG 140 CO 0.19 0.33 -0.03 -1.91 -0.68 0.00 0.00 175.30 173.20 2fja n GLU 141 N 0.64 0.06 0.00 3.54 2.13 -0.58 -4.79 120.64 121.64 2fja n GLU 141 Ca 0.00 0.19 0.00 0.00 0.66 0.00 0.00 57.16 58.02 2fja n GLU 141 Cb 0.50 -0.78 0.00 0.00 0.27 0.00 0.00 31.44 31.43 2fja n GLU 141 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fja n GLY 142 N 1.65 4.35 0.09 8.31 0.00 -1.26 -3.63 105.19 114.70 2fja n GLY 142 Ca -0.01 -1.67 -0.13 0.00 0.00 0.00 0.00 46.02 44.21 2fja n GLY 142 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2fja h GLN 143 N 0.00 0.14 -0.01 1.61 4.15 -1.97 -3.38 115.11 115.65 2fja h GLN 143 Ca 0.00 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.19 2fja h GLN 143 Cb 0.00 0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2fja h GLN 143 CO 0.00 0.97 -0.20 0.91 -1.93 0.00 0.00 178.83 178.59 2fja n TRP 144 N -3.35 0.00 -4.30 3.99 7.02 -1.26 -4.96 117.44 114.58 2fja n TRP 144 Ca -0.12 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.12 2fja n TRP 144 Cb 1.02 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.83 2fja n TRP 144 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2fja s GLN 145 N -1.44 2.22 0.00 -0.99 1.11 -1.26 -1.13 119.66 118.18 2fja s GLN 145 Ca 0.11 -1.38 0.02 0.00 0.01 0.00 0.00 55.36 54.12 2fja s GLN 145 Cb 0.10 -2.16 -0.01 0.00 -1.01 0.00 0.00 33.01 29.94 2fja s GLN 145 CO 0.27 0.39 -0.07 0.96 0.01 0.00 0.00 175.29 176.85 2fja s ILE 146 N -2.15 0.52 0.38 1.08 -4.36 -0.67 -1.53 121.20 114.47 2fja s ILE 146 Ca 0.30 -0.35 -0.25 0.00 -0.26 0.00 0.00 60.65 60.09 2fja s ILE 146 Cb -0.07 -0.45 -0.09 0.00 1.25 0.00 0.00 42.46 43.10 2fja s ILE 146 CO 0.18 0.09 1.04 -0.04 0.24 0.00 0.00 174.94 176.46 2fja s MET 147 N -0.29 4.26 0.06 0.37 -1.94 -0.31 -0.75 119.30 120.70 2fja s MET 147 Ca 0.01 1.50 -0.04 0.00 -1.71 0.00 0.00 55.69 55.46 2fja s MET 147 Cb -0.03 -2.62 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 2fja s MET 147 CO -0.00 -0.05 0.06 0.96 -0.01 0.00 0.00 175.02 175.98 2fja s ILE 148 N -1.62 0.17 -1.11 2.53 -4.36 -0.55 -1.49 121.20 114.77 2fja s ILE 148 Ca 0.56 -1.41 -0.07 0.00 -0.26 0.00 0.00 60.65 59.47 2fja s ILE 148 Cb -0.22 -1.25 0.29 0.00 1.25 0.00 0.00 42.46 42.53 2fja s ILE 148 CO 0.28 -0.78 1.24 1.41 0.24 0.00 0.00 174.94 177.33 2fja n HIS 149 N 0.31 4.31 -1.23 1.37 8.25 0.14 -4.44 115.22 123.93 2fja n HIS 149 Ca -0.16 -3.48 -0.29 0.00 -0.26 0.00 0.00 57.72 53.53 2fja n HIS 149 Cb 0.60 -1.57 0.12 0.00 1.12 0.00 0.00 29.99 30.27 2fja n HIS 149 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fja n GLY 150 N 2.24 5.19 0.34 -1.41 0.00 -1.11 -4.29 105.19 106.14 2fja n GLY 150 Ca 0.25 -1.73 0.03 0.00 0.00 0.00 0.00 46.02 44.57 2fja n GLY 150 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fja h GLU 151 N 1.54 0.79 -0.69 1.61 4.22 -1.77 -1.79 114.58 118.49 2fja h GLU 151 Ca 0.60 -0.05 -0.26 0.00 0.08 0.00 0.00 59.36 59.73 2fja h GLU 151 Cb 1.65 -0.18 -0.15 0.00 0.50 0.00 0.00 28.75 30.56 2fja h GLU 151 CO 1.34 0.52 0.28 0.43 -2.18 0.00 0.00 179.01 179.40 2fja n SER 152 N -4.45 4.14 -0.11 1.04 7.64 -1.26 -3.98 113.62 116.63 2fja n SER 152 Ca 0.07 -3.38 -0.05 0.00 1.01 0.00 0.00 58.87 56.52 2fja n SER 152 Cb 0.09 -0.73 0.02 0.00 -1.01 0.00 0.00 64.21 62.58 2fja n SER 152 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2fja h TYR 153 N 1.95 -0.03 0.03 1.43 3.20 -1.68 -1.35 116.97 120.52 2fja h TYR 153 Ca 0.32 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.21 2fja h TYR 153 Cb 2.27 0.07 0.00 0.00 1.54 0.00 0.00 36.73 40.61 2fja h TYR 153 CO 1.24 -0.08 -0.02 -0.22 -1.64 0.00 0.00 178.16 177.45 2fja h LYS 154 N 0.09 -0.04 -1.00 1.82 1.63 -1.84 -2.55 116.57 114.69 2fja h LYS 154 Ca 0.18 0.00 0.21 0.00 -0.85 0.00 0.00 60.65 60.19 2fja h LYS 154 Cb 0.25 0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 31.78 2fja h LYS 154 CO -0.30 0.40 0.61 -1.35 -3.45 0.00 0.00 179.45 175.36 2fja h PRO 155 N -0.50 0.65 0.01 1.90 0.11 -1.29 0.71 132.00 133.58 2fja h PRO 155 Ca -0.00 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2fja h PRO 155 Cb 0.46 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.42 2fja h PRO 155 CO 0.01 0.43 -0.00 0.82 -0.21 0.00 0.00 178.00 179.04 2fja h ILE 156 N 0.67 1.24 -0.29 4.15 2.04 -1.21 -0.81 117.51 123.30 2fja h ILE 156 Ca 0.58 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 2fja h ILE 156 Cb 1.04 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 2fja h ILE 156 CO -0.37 0.19 -0.04 0.40 0.00 0.00 0.00 178.15 178.33 2fja h ILE 157 N -0.32 1.19 -0.54 -0.67 5.03 -0.82 -1.72 117.51 119.67 2fja h ILE 157 Ca -0.00 -0.80 -0.09 0.00 -0.12 0.00 0.00 64.86 63.86 2fja h ILE 157 Cb 0.31 1.03 -0.02 0.00 -3.03 0.00 0.00 36.82 35.11 2fja h ILE 157 CO 0.00 0.27 -0.00 0.00 -0.68 0.00 0.00 178.15 177.73 2fja h ALA 158 N 1.53 0.97 -0.32 1.87 0.00 0.55 -2.07 119.26 121.79 2fja h ALA 158 Ca 0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2fja h ALA 158 Cb 0.35 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2fja h ALA 158 CO 0.01 0.63 0.07 1.49 0.00 0.00 0.00 179.25 181.46 2fja h GLU 159 N 0.86 0.52 -0.29 0.00 4.81 -0.32 -0.67 114.58 119.49 2fja h GLU 159 Ca 0.16 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2fja h GLU 159 Cb 0.51 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 2fja h GLU 159 CO 0.03 0.58 0.07 0.00 -0.73 0.00 0.00 179.01 178.96 2fja h ALA 160 N 0.91 0.30 -0.77 2.92 0.00 -1.14 0.87 119.26 122.35 2fja h ALA 160 Ca 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2fja h ALA 160 Cb 0.30 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2fja h ALA 160 CO 0.00 -0.34 0.44 0.00 0.00 0.00 0.00 179.25 179.35 2fja h ALA 161 N 1.20 0.99 -0.37 0.00 0.00 -1.22 -0.10 119.26 119.77 2fja h ALA 161 Ca 0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2fja h ALA 161 Cb 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2fja h ALA 161 CO -0.16 0.49 0.11 -0.22 0.00 0.00 0.00 179.25 179.46 2fja h LYS 162 N 1.07 0.59 0.00 0.00 3.64 -0.55 -0.54 116.57 120.78 2fja h LYS 162 Ca 0.27 -0.13 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 2fja h LYS 162 Cb 0.01 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2fja h LYS 162 CO -0.05 0.61 -0.25 0.52 -2.27 0.00 0.00 179.45 178.02 2fja h MET 163 N 0.46 0.00 0.05 1.90 2.86 -0.54 0.16 114.93 119.80 2fja h MET 163 Ca 0.12 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2fja h MET 163 Cb 0.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.94 2fja h MET 163 CO -0.00 0.25 -0.02 0.00 1.06 0.00 0.00 176.91 178.20 2fja h ALA 164 N 1.75 -0.06 0.00 6.32 0.00 -0.53 -3.39 119.26 123.35 2fja h ALA 164 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2fja h ALA 164 Cb 0.46 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2fja h ALA 164 CO 0.03 -0.11 -1.36 1.55 0.00 0.00 0.00 179.25 179.36 2fja n VAL 165 N -4.75 0.14 0.00 0.00 3.14 -0.25 -4.82 118.33 111.79 2fja n VAL 165 Ca -0.08 -0.34 0.00 0.00 -2.96 0.00 0.00 64.34 60.96 2fja n VAL 165 Cb 0.32 0.17 0.00 0.00 -1.06 0.00 0.00 33.84 33.27 2fja n VAL 165 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2fja n GLY 166 N 1.32 -0.95 0.33 7.55 0.00 0.54 -4.46 105.19 109.53 2fja n GLY 166 Ca -0.00 -1.20 0.18 0.00 0.00 0.00 0.00 46.02 45.00 2fja n GLY 166 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fja h GLU 167 N 0.00 0.00 0.00 1.61 4.57 -1.93 0.06 114.58 118.89 2fja h GLU 167 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2fja h GLU 167 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2fja h GLU 167 CO 0.00 0.00 0.00 -0.85 -1.18 0.00 0.00 179.01 176.98 2fja n GLU 168 N -3.46 0.12 -0.51 1.92 0.00 -1.26 -2.37 120.64 115.08 2fja n GLU 168 Ca -0.01 0.30 0.08 0.00 0.00 0.00 0.00 57.16 57.53 2fja n GLU 168 Cb 0.20 -1.71 0.28 0.00 0.00 0.00 0.00 31.44 30.21 2fja n GLU 168 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2fja n ASN 169 N -1.94 4.19 -4.06 -1.84 3.02 0.01 -4.89 115.26 109.74 2fja n ASN 169 Ca 0.03 -2.77 -0.32 0.00 -0.03 0.00 0.00 54.58 51.49 2fja n ASN 169 Cb 0.25 -0.53 -0.16 0.00 -0.61 0.00 0.00 39.78 38.73 2fja n ASN 169 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2fja s ILE 170 N -2.41 1.90 -0.31 2.41 1.01 -1.00 -0.87 121.20 121.93 2fja s ILE 170 Ca 0.43 -1.06 -0.10 0.00 0.00 0.00 0.00 60.65 59.92 2fja s ILE 170 Cb 0.32 -1.86 -0.01 0.00 0.01 0.00 0.00 42.46 40.93 2fja s ILE 170 CO 0.13 0.31 0.16 -0.31 0.00 0.00 0.00 174.94 175.23 2fja s TYR 171 N 1.31 3.18 0.33 3.97 1.51 0.81 -5.00 117.35 123.46 2fja s TYR 171 Ca 0.00 -0.58 0.07 0.00 -1.01 0.00 0.00 57.07 55.56 2fja s TYR 171 Cb -0.15 -2.36 -0.02 0.00 -0.11 0.00 0.00 41.96 39.31 2fja s TYR 171 CO -0.10 -0.46 0.32 -1.21 -1.11 0.00 0.00 175.55 173.00 2fja s GLU 172 N 1.61 2.82 -1.47 -0.62 2.02 -1.26 -0.04 118.70 121.77 2fja s GLU 172 Ca 0.04 -1.22 -0.11 0.00 0.02 0.00 0.00 54.97 53.70 2fja s GLU 172 Cb -0.17 -2.55 0.05 0.00 0.10 0.00 0.00 34.13 31.56 2fja s GLU 172 CO 0.06 0.11 0.97 0.54 0.02 0.00 0.00 175.26 176.96 2fja n ARG 173 N -1.42 -6.04 -3.91 1.61 5.12 0.11 -4.89 116.66 107.25 2fja n ARG 173 Ca -0.02 0.69 -0.29 0.00 -1.93 0.00 0.00 57.85 56.30 2fja n ARG 173 Cb 0.59 -5.62 -0.16 0.00 -1.16 0.00 0.00 32.46 26.11 2fja n ARG 173 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2fja s VAL 174 N -3.26 1.23 -0.21 1.55 1.01 -0.67 -2.32 120.40 117.74 2fja s VAL 174 Ca 0.59 -0.78 -0.20 0.00 0.00 0.00 0.00 61.98 61.59 2fja s VAL 174 Cb -0.28 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 2fja s VAL 174 CO 0.73 0.08 0.58 0.12 0.00 0.00 0.00 175.10 176.61 2fja s PHE 175 N 1.57 3.35 -0.16 5.22 5.36 -0.13 -2.87 117.98 130.31 2fja s PHE 175 Ca -0.01 0.83 -0.18 0.00 -0.96 0.00 0.00 56.93 56.61 2fja s PHE 175 Cb -0.16 -2.75 -0.04 0.00 -0.34 0.00 0.00 43.02 39.73 2fja s PHE 175 CO -0.08 -0.19 0.49 0.42 -1.46 0.00 0.00 175.22 174.41 2fja s ILE 176 N 1.96 5.15 -0.07 3.12 -1.09 -1.26 -1.23 121.20 127.78 2fja s ILE 176 Ca 0.26 0.94 0.04 0.00 -2.23 0.00 0.00 60.65 59.66 2fja s ILE 176 Cb -0.16 -3.83 -0.06 0.00 -1.58 0.00 0.00 42.46 36.84 2fja s ILE 176 CO 0.10 0.25 0.11 2.22 -1.23 0.00 0.00 174.94 176.39 2fja n PHE 177 N 4.28 0.00 -3.63 3.97 1.16 -0.79 -4.98 117.46 117.46 2fja n PHE 177 Ca -0.06 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.37 2fja n PHE 177 Cb 0.51 -0.06 -0.07 0.00 -1.61 0.00 0.00 39.48 38.25 2fja n PHE 177 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 2fja s GLU 178 N -1.96 0.89 0.34 3.97 2.56 -1.20 -4.75 118.70 118.55 2fja s GLU 178 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.97 54.95 2fja s GLU 178 Cb 0.03 0.41 -0.04 0.00 2.00 0.00 0.00 34.13 36.53 2fja s GLU 178 CO 0.16 -0.27 0.55 -0.51 -0.56 0.00 0.00 175.26 174.63 2fja s LEU 179 N -1.36 4.02 -0.07 2.70 1.43 -1.26 -0.98 118.68 123.15 2fja s LEU 179 Ca -0.11 0.50 0.02 0.00 -1.03 0.00 0.00 54.13 53.51 2fja s LEU 179 Cb -0.02 -3.35 -0.02 0.00 0.03 0.00 0.00 46.19 42.82 2fja s LEU 179 CO 0.06 -0.28 -0.13 -0.76 0.23 0.00 0.00 176.35 175.48 2fja s LEU 180 N -4.17 2.82 0.27 1.79 1.43 0.03 -4.81 118.68 116.03 2fja s LEU 180 Ca 0.41 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.40 2fja s LEU 180 Cb -0.10 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2fja s LEU 180 CO 0.35 0.31 0.16 -0.54 0.23 0.00 0.00 176.35 176.86 2fja s LYS 181 N -0.54 2.73 -0.32 1.70 1.02 -1.26 -0.18 119.74 122.89 2fja s LYS 181 Ca 0.07 -1.19 -0.28 0.00 0.02 0.00 0.00 55.97 54.59 2fja s LYS 181 Cb -0.12 -2.44 -0.02 0.00 -0.52 0.00 0.00 37.83 34.73 2fja s LYS 181 CO 0.02 0.35 1.82 0.34 -0.92 0.00 0.00 175.35 176.95 2fja s ASP 182 N -3.82 5.87 0.44 2.83 3.68 0.54 -4.39 116.67 121.82 2fja s ASP 182 Ca 0.34 1.34 0.34 0.00 2.13 0.00 0.00 52.55 56.70 2fja s ASP 182 Cb -0.07 -2.52 1.46 0.00 -1.45 0.00 0.00 42.92 40.33 2fja s ASP 182 CO 0.24 -1.72 1.49 1.17 0.13 0.00 0.00 175.17 176.48 2fja n LYS 183 N 8.44 -0.03 0.15 4.34 4.81 0.36 0.03 118.16 136.26 2fja n LYS 183 Ca 0.23 1.17 0.10 0.00 -0.87 0.00 0.00 58.31 58.94 2fja n LYS 183 Cb 0.47 -2.36 0.06 0.00 0.02 0.00 0.00 35.03 33.21 2fja n LYS 183 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 2fja h ASN 184 N 0.00 0.00 -3.16 3.14 2.35 -1.88 -3.45 115.58 112.58 2fja h ASN 184 Ca 0.85 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 56.33 2fja h ASN 184 Cb 2.84 0.00 -0.34 0.00 0.05 0.00 0.00 38.32 40.87 2fja h ASN 184 CO -0.38 0.11 -0.60 -0.62 -1.65 0.00 0.00 177.43 174.28 2fja s ASP 185 N -5.85 0.43 0.43 5.81 -1.08 0.10 -5.04 116.67 111.46 2fja s ASP 185 Ca 0.03 0.37 0.30 0.00 -0.52 0.00 0.00 52.55 52.73 2fja s ASP 185 Cb 0.07 0.32 1.31 0.00 -1.46 0.00 0.00 42.92 43.16 2fja s ASP 185 CO 0.74 -0.22 1.89 1.55 0.52 0.00 0.00 175.17 179.65 2fja h PRO 186 N 8.01 0.00 -0.63 4.34 0.13 -1.87 -3.14 132.00 138.83 2fja h PRO 186 Ca -0.22 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.44 2fja h PRO 186 Cb 1.12 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.89 2fja h PRO 186 CO 0.22 0.00 -0.75 -1.71 -0.23 0.00 0.00 178.00 175.53 2fja n ASN 187 N -2.68 4.44 -3.88 1.44 5.15 -1.26 -4.95 115.26 113.53 2fja n ASN 187 Ca 0.01 -3.78 -0.15 0.00 -0.60 0.00 0.00 54.58 50.06 2fja n ASN 187 Cb 0.23 -0.38 -0.15 0.00 -0.53 0.00 0.00 39.78 38.95 2fja n ASN 187 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2fja s ALA 188 N -3.54 0.24 0.51 5.20 0.00 -1.19 -1.17 121.76 121.81 2fja s ALA 188 Ca 0.49 -0.01 -0.15 0.00 0.00 0.00 0.00 51.96 52.29 2fja s ALA 188 Cb 0.40 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 23.31 2fja s ALA 188 CO 0.02 0.01 0.96 0.54 0.00 0.00 0.00 175.76 177.30 2fja s VAL 189 N 0.32 4.58 0.00 0.00 0.11 -0.58 -0.34 120.40 124.49 2fja s VAL 189 Ca -0.03 1.10 0.00 0.00 -2.93 0.00 0.00 61.98 60.12 2fja s VAL 189 Cb -0.06 -3.74 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 2fja s VAL 189 CO -0.01 -0.72 0.13 0.00 -3.33 0.00 0.00 175.10 171.17 2fja n ALA 190 N -1.68 0.38 0.00 1.54 0.00 0.75 -4.41 120.51 117.09 2fja n ALA 190 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2fja n ALA 190 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2fja n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fja n GLY 191 N -0.01 0.43 3.62 0.00 0.00 -1.10 -1.26 105.19 106.87 2fja n GLY 191 Ca 0.00 -1.43 -0.07 0.00 0.00 0.00 0.00 46.02 44.52 2fja n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fja s ALA 192 N -1.00 -1.63 0.10 4.61 0.00 -0.26 -0.79 121.76 122.79 2fja s ALA 192 Ca 0.00 0.41 0.09 0.00 0.00 0.00 0.00 51.96 52.46 2fja s ALA 192 Cb 0.00 0.65 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 2fja s ALA 192 CO 0.00 -0.87 -0.22 0.14 0.00 0.00 0.00 175.76 174.81 2fja s VAL 193 N -3.43 1.78 0.00 0.00 -7.23 -0.15 -0.41 120.40 110.95 2fja s VAL 193 Ca 0.07 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.68 2fja s VAL 193 Cb -0.02 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.31 2fja s VAL 193 CO -0.04 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 2fja n GLY 194 N 1.09 2.31 3.31 2.32 0.00 -0.63 -1.89 105.19 111.69 2fja n GLY 194 Ca -0.19 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 2fja n GLY 194 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fja s PHE 195 N -7.90 -0.25 0.46 1.61 -0.71 -0.36 -0.79 117.98 110.04 2fja s PHE 195 Ca 0.00 0.27 -0.21 0.00 -1.04 0.00 0.00 56.93 55.95 2fja s PHE 195 Cb 0.00 0.18 -0.09 0.00 -1.21 0.00 0.00 43.02 41.90 2fja s PHE 195 CO 0.00 -0.52 1.03 0.45 -1.34 0.00 0.00 175.22 174.84 2fja s SER 196 N -1.77 6.49 0.00 1.98 0.15 -0.57 -0.96 113.70 119.02 2fja s SER 196 Ca -0.08 1.91 0.14 0.00 0.70 0.00 0.00 55.95 58.62 2fja s SER 196 Cb -0.02 -2.56 0.31 0.00 -1.71 0.00 0.00 66.02 62.04 2fja s SER 196 CO 0.00 -0.68 1.21 1.33 1.20 0.00 0.00 173.24 176.31 2fja n VAL 197 N -0.79 0.67 0.09 4.45 0.24 -0.98 -4.36 118.33 117.65 2fja n VAL 197 Ca 0.08 -0.83 0.03 0.00 -2.04 0.00 0.00 64.34 61.58 2fja n VAL 197 Cb 0.52 0.77 -0.04 0.00 -1.47 0.00 0.00 33.84 33.62 2fja n VAL 197 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2fja n ARG 198 N 0.84 1.88 -3.63 7.34 5.12 -1.26 -4.58 116.66 122.36 2fja n ARG 198 Ca 0.13 -0.04 -0.09 0.00 -1.93 0.00 0.00 57.85 55.93 2fja n ARG 198 Cb 0.45 -1.01 -0.02 0.00 -1.16 0.00 0.00 32.46 30.71 2fja n ARG 198 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2fja s GLU 199 N -2.11 1.43 -0.85 5.56 -1.05 -1.26 -5.09 118.70 115.34 2fja s GLU 199 Ca -0.01 -0.68 -0.25 0.00 -0.15 0.00 0.00 54.97 53.88 2fja s GLU 199 Cb 0.04 0.56 0.01 0.00 -0.44 0.00 0.00 34.13 34.30 2fja s GLU 199 CO 0.24 -0.64 1.62 -1.25 0.95 0.00 0.00 175.26 176.18 2fja s PRO 200 N -3.72 3.04 -0.23 -4.83 0.04 -1.26 -4.34 135.00 123.70 2fja s PRO 200 Ca 0.06 -0.37 -0.08 0.00 0.04 0.00 0.00 61.00 60.65 2fja s PRO 200 Cb -0.03 -4.83 0.10 0.00 0.04 0.00 0.00 34.50 29.78 2fja s PRO 200 CO -0.03 -2.60 0.49 0.21 0.04 0.00 0.00 177.00 175.11 2fja s LYS 201 N 6.08 0.42 -0.13 4.56 2.20 -1.26 -4.16 119.74 127.45 2fja s LYS 201 Ca 0.54 1.13 -0.15 0.00 -0.36 0.00 0.00 55.97 57.13 2fja s LYS 201 Cb -0.06 0.42 -0.05 0.00 -1.51 0.00 0.00 37.83 36.64 2fja s LYS 201 CO 0.04 -0.22 0.36 0.12 -0.36 0.00 0.00 175.35 175.28 2fja s PHE 202 N 2.50 3.51 -0.08 4.03 5.36 -0.24 -1.51 117.98 131.55 2fja s PHE 202 Ca -0.04 0.72 -0.01 0.00 -0.96 0.00 0.00 56.93 56.65 2fja s PHE 202 Cb -0.11 -2.39 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2fja s PHE 202 CO -0.15 0.28 -0.04 0.71 -1.46 0.00 0.00 175.22 174.56 2fja s TYR 203 N 0.29 3.04 -0.26 10.12 1.51 0.03 -0.12 117.35 131.96 2fja s TYR 203 Ca 0.20 0.06 0.01 0.00 -1.01 0.00 0.00 57.07 56.33 2fja s TYR 203 Cb -0.14 -1.77 0.07 0.00 -0.11 0.00 0.00 41.96 40.01 2fja s TYR 203 CO 0.07 0.35 -0.02 0.08 -1.11 0.00 0.00 175.55 174.92 2fja s VAL 204 N -0.71 1.55 -0.33 0.71 1.01 -0.61 -1.60 120.40 120.42 2fja s VAL 204 Ca 0.11 -1.41 -0.14 0.00 0.00 0.00 0.00 61.98 60.54 2fja s VAL 204 Cb -0.11 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 2fja s VAL 204 CO 0.02 -0.25 0.32 -0.36 0.00 0.00 0.00 175.10 174.83 2fja s PHE 205 N 1.35 3.22 -0.18 5.22 0.40 0.45 -0.60 117.98 127.84 2fja s PHE 205 Ca -0.01 0.00 -0.11 0.00 -0.60 0.00 0.00 56.93 56.20 2fja s PHE 205 Cb -0.19 -2.60 -0.05 0.00 0.51 0.00 0.00 43.02 40.70 2fja s PHE 205 CO -0.09 -0.37 0.20 0.15 0.70 0.00 0.00 175.22 175.81 2fja s LYS 206 N 1.94 4.18 0.13 0.44 1.02 0.53 -1.10 119.74 126.89 2fja s LYS 206 Ca 0.11 -0.08 -0.13 0.00 0.02 0.00 0.00 55.97 55.89 2fja s LYS 206 Cb -0.17 -3.41 0.02 0.00 -0.52 0.00 0.00 37.83 33.75 2fja s LYS 206 CO 0.11 0.30 0.34 0.00 -0.92 0.00 0.00 175.35 175.18 2fja s ALA 207 N 0.34 -0.57 -0.12 5.17 0.00 -0.39 -1.39 121.76 124.79 2fja s ALA 207 Ca 0.12 -0.38 0.17 0.00 0.00 0.00 0.00 51.96 51.87 2fja s ALA 207 Cb -0.12 0.70 -0.18 0.00 0.00 0.00 0.00 23.12 23.52 2fja s ALA 207 CO 0.01 -0.63 0.67 1.63 0.00 0.00 0.00 175.76 177.44 2fja n LYS 208 N -0.20 0.63 -3.80 0.00 5.02 -0.19 -4.04 118.16 115.58 2fja n LYS 208 Ca -0.13 0.15 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 2fja n LYS 208 Cb 0.63 -1.74 -0.13 0.00 -0.02 0.00 0.00 35.03 33.77 2fja n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fja s ALA 209 N -2.90 -0.29 -0.05 7.82 0.00 0.17 -4.78 121.76 121.72 2fja s ALA 209 Ca -0.04 0.46 0.05 0.00 0.00 0.00 0.00 51.96 52.42 2fja s ALA 209 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2fja s ALA 209 CO 0.82 -0.09 -0.21 0.08 0.00 0.00 0.00 175.76 176.36 2fja s VAL 210 N 0.43 1.73 -0.21 0.00 1.01 0.04 -0.60 120.40 122.80 2fja s VAL 210 Ca -0.03 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2fja s VAL 210 Cb -0.04 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.88 2fja s VAL 210 CO -0.02 0.49 -0.15 -0.63 0.00 0.00 0.00 175.10 174.79 2fja s ILE 211 N 0.00 2.28 -0.34 2.22 1.01 0.97 0.26 121.20 127.59 2fja s ILE 211 Ca -0.05 -1.05 -0.26 0.00 0.00 0.00 0.00 60.65 59.28 2fja s ILE 211 Cb -0.13 -2.06 0.01 0.00 0.01 0.00 0.00 42.46 40.29 2fja s ILE 211 CO 0.03 0.38 0.94 -0.76 0.00 0.00 0.00 174.94 175.53 2fja s LEU 212 N 1.27 4.00 -0.30 2.97 1.43 0.36 -0.77 118.68 127.64 2fja s LEU 212 Ca 0.02 0.74 0.20 0.00 -1.03 0.00 0.00 54.13 54.06 2fja s LEU 212 Cb -0.15 -3.30 0.48 0.00 0.03 0.00 0.00 46.19 43.24 2fja s LEU 212 CO -0.10 -0.81 1.02 0.00 0.23 0.00 0.00 176.35 176.70 2fja n ALA 213 N 6.67 3.05 1.70 4.21 0.00 0.49 -1.22 120.51 135.41 2fja n ALA 213 Ca 0.08 -2.93 0.14 0.00 0.00 0.00 0.00 53.44 50.72 2fja n ALA 213 Cb 0.48 -0.92 0.65 0.00 0.00 0.00 0.00 19.45 19.66 2fja n ALA 213 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2fja n THR 214 N -0.29 0.03 0.00 0.00 -2.24 -1.09 -4.13 114.28 106.55 2fja n THR 214 Ca 0.08 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2fja n THR 214 Cb 0.81 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 2fja n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fja n GLY 215 N 1.06 -1.45 0.00 3.38 0.00 -1.26 -4.67 105.19 102.24 2fja n GLY 215 Ca 0.20 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2fja n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fja n GLY 216 N -1.54 1.02 2.83 -0.02 0.00 -1.26 -4.55 105.19 101.66 2fja n GLY 216 Ca 0.00 -1.44 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 2fja n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fja s ALA 217 N -3.88 0.45 0.34 4.61 0.00 0.11 -0.16 121.76 123.23 2fja s ALA 217 Ca 0.00 0.08 0.05 0.00 0.00 0.00 0.00 51.96 52.08 2fja s ALA 217 Cb 0.00 -0.41 -0.07 0.00 0.00 0.00 0.00 23.12 22.65 2fja s ALA 217 CO 0.00 -0.12 0.03 0.95 0.00 0.00 0.00 175.76 176.62 2fja s THR 218 N 1.14 1.45 -1.62 0.00 -4.23 -0.41 -2.11 115.64 109.86 2fja s THR 218 Ca -0.08 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2fja s THR 218 Cb -0.14 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 70.92 2fja s THR 218 CO -0.02 -0.05 0.00 0.18 -0.54 0.00 0.00 174.62 174.19 2fja n LEU 219 N -0.73 -1.40 0.06 4.79 4.77 -1.26 -4.76 117.00 118.47 2fja n LEU 219 Ca -0.03 0.25 -0.13 0.00 -0.03 0.00 0.00 56.01 56.07 2fja n LEU 219 Cb 0.66 -2.38 -0.13 0.00 -2.33 0.00 0.00 43.42 39.24 2fja n LEU 219 CO 0.43 -0.60 -0.16 -0.07 -1.33 0.00 0.00 177.39 175.66 2fja h LEU 220 N 0.00 0.24 -9.53 2.23 4.07 -1.86 -3.44 115.31 107.02 2fja h LEU 220 Ca -0.36 -0.30 -0.65 0.00 0.08 0.00 0.00 57.88 56.66 2fja h LEU 220 Cb 1.15 -0.08 -0.11 0.00 1.08 0.00 0.00 40.66 42.71 2fja h LEU 220 CO 0.48 1.24 -0.64 -0.36 -1.08 0.00 0.00 178.44 178.09 2fja s PHE 221 N -2.65 3.07 0.17 1.13 0.40 -1.26 -3.53 117.98 115.32 2fja s PHE 221 Ca -0.05 0.02 -0.31 0.00 -0.60 0.00 0.00 56.93 55.99 2fja s PHE 221 Cb 0.08 -1.58 -0.10 0.00 0.51 0.00 0.00 43.02 41.94 2fja s PHE 221 CO 0.85 0.50 1.50 0.50 0.70 0.00 0.00 175.22 179.26 2fja s ARG 222 N -2.29 4.25 0.74 0.44 3.52 -1.11 -4.91 118.95 119.59 2fja s ARG 222 Ca 0.27 2.29 -0.09 0.00 -0.13 0.00 0.00 55.73 58.06 2fja s ARG 222 Cb -0.12 -3.16 0.06 0.00 -1.56 0.00 0.00 34.95 30.17 2fja s ARG 222 CO 0.19 -0.53 1.08 -2.14 -0.81 0.00 0.00 175.30 173.09 2fja s PRO 223 N 0.79 2.16 0.00 5.12 0.02 -1.26 -4.75 135.00 137.08 2fja s PRO 223 Ca 0.66 -0.08 0.16 0.00 0.02 0.00 0.00 61.00 61.77 2fja s PRO 223 Cb -0.42 -2.08 0.72 0.00 0.02 0.00 0.00 34.50 32.74 2fja s PRO 223 CO 0.34 -1.35 1.52 0.54 -0.33 0.00 0.00 177.00 177.72 2fja n ARG 224 N -3.06 0.04 -4.39 5.54 1.74 -1.26 -4.41 116.66 110.86 2fja n ARG 224 Ca 0.08 0.20 -0.25 0.00 -0.77 0.00 0.00 57.85 57.11 2fja n ARG 224 Cb 0.60 -1.50 -0.17 0.00 -1.02 0.00 0.00 32.46 30.38 2fja n ARG 224 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2fja s SER 225 N -2.92 1.86 0.00 0.55 0.01 -1.26 -5.04 113.70 106.90 2fja s SER 225 Ca 0.09 -0.30 0.07 0.00 1.31 0.00 0.00 55.95 57.12 2fja s SER 225 Cb 0.11 -0.82 0.11 0.00 0.21 0.00 0.00 66.02 65.62 2fja s SER 225 CO 0.29 -0.01 0.90 0.35 0.41 0.00 0.00 173.24 175.18 2fja n THR 226 N 4.12 0.42 0.00 1.44 -2.24 -1.26 -3.28 114.28 113.48 2fja n THR 226 Ca -0.20 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 2fja n THR 226 Cb 0.51 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 2fja n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fja n GLY 227 N 0.28 0.53 0.34 3.38 0.00 -1.26 -4.65 105.19 103.81 2fja n GLY 227 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 2fja n GLY 227 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2fja h GLU 228 N 0.00 1.14 0.00 1.61 5.08 -2.04 -2.42 114.58 117.95 2fja h GLU 228 Ca 0.00 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2fja h GLU 228 Cb 0.00 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.06 2fja h GLU 228 CO 0.00 0.92 0.00 0.00 -1.00 0.00 0.00 179.01 178.93 2fja n ALA 229 N -2.44 1.78 0.29 3.43 0.00 -1.26 -1.62 120.51 120.69 2fja n ALA 229 Ca 0.07 -0.03 0.17 0.00 0.00 0.00 0.00 53.44 53.65 2fja n ALA 229 Cb 0.18 -1.07 0.82 0.00 0.00 0.00 0.00 19.45 19.38 2fja n ALA 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fja h ALA 230 N 2.05 1.07 0.00 0.00 0.00 -1.42 -0.99 119.26 119.98 2fja h ALA 230 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2fja h ALA 230 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2fja h ALA 230 CO 0.00 0.06 -0.08 0.41 0.00 0.00 0.00 179.25 179.64 2fja n GLY 231 N -0.42 -1.51 2.84 0.00 0.00 -0.64 -4.29 105.19 101.17 2fja n GLY 231 Ca -0.01 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 2fja n GLY 231 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2fja n ARG 232 N -1.68 3.81 -3.13 1.61 3.00 -0.38 -4.88 116.66 115.01 2fja n ARG 232 Ca 0.06 -3.64 -0.37 0.00 -0.00 0.00 0.00 57.85 53.90 2fja n ARG 232 Cb 0.36 -2.85 -0.06 0.00 0.00 0.00 0.00 32.46 29.91 2fja n ARG 232 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2fja s THR 233 N -0.14 4.58 0.08 5.15 -4.23 -1.26 -4.97 115.64 114.85 2fja s THR 233 Ca 0.40 1.34 -0.31 0.00 -1.18 0.00 0.00 61.69 61.94 2fja s THR 233 Cb 0.10 -3.93 -0.17 0.00 1.34 0.00 0.00 72.50 69.84 2fja s THR 233 CO 0.01 0.38 1.64 -0.25 -0.54 0.00 0.00 174.62 175.86 2fja h TRP 234 N 3.93 -0.74 -4.40 3.99 7.01 -1.93 -3.43 115.95 120.39 2fja h TRP 234 Ca -0.48 -0.01 -0.47 0.00 2.11 0.00 0.00 58.89 60.04 2fja h TRP 234 Cb 1.20 0.26 0.11 0.00 -2.10 0.00 0.00 29.16 28.63 2fja h TRP 234 CO 0.65 -0.44 0.35 -0.47 -2.79 0.00 0.00 178.44 175.74 2fja s TYR 235 N -6.07 2.77 -0.29 2.65 5.04 -1.26 -4.91 117.35 115.28 2fja s TYR 235 Ca -0.17 0.87 -0.33 0.00 -2.44 0.00 0.00 57.07 55.00 2fja s TYR 235 Cb 0.04 -3.37 -0.10 0.00 0.35 0.00 0.00 41.96 38.89 2fja s TYR 235 CO 0.63 -1.99 2.17 0.00 -1.34 0.00 0.00 175.55 175.02 2fja n ALA 236 N -3.51 1.23 0.30 3.97 0.00 -1.26 -4.81 120.51 116.43 2fja n ALA 236 Ca 0.07 -0.08 0.17 0.00 0.00 0.00 0.00 53.44 53.61 2fja n ALA 236 Cb 0.59 -2.64 0.81 0.00 0.00 0.00 0.00 19.45 18.22 2fja n ALA 236 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2fja h ILE 237 N 6.96 0.00 0.00 0.00 2.10 -1.90 -2.09 117.51 122.59 2fja h ILE 237 Ca -0.32 -0.23 -0.04 0.00 1.08 0.00 0.00 64.86 65.34 2fja h ILE 237 Cb 1.30 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 38.14 2fja h ILE 237 CO 1.00 0.00 -0.20 -0.26 -1.08 0.00 0.00 178.15 177.61 2fja h PHE 238 N 0.00 0.00 -3.70 2.19 0.05 -1.93 -3.43 116.94 110.12 2fja h PHE 238 Ca 0.00 0.00 -0.63 0.00 3.82 0.00 0.00 57.97 61.16 2fja h PHE 238 Cb 0.26 0.00 -0.14 0.00 2.00 0.00 0.00 35.95 38.06 2fja h PHE 238 CO 0.00 0.20 -0.22 -0.51 -0.18 0.00 0.00 178.31 177.60 2fja s ASP 239 N -6.14 6.27 -0.21 2.17 1.01 -0.79 -4.97 116.67 114.02 2fja s ASP 239 Ca 0.01 0.32 0.11 0.00 0.71 0.00 0.00 52.55 53.70 2fja s ASP 239 Cb 0.10 -2.22 0.42 0.00 1.01 0.00 0.00 42.92 42.24 2fja s ASP 239 CO 0.63 -0.18 1.22 0.35 0.21 0.00 0.00 175.17 177.39 2fja n THR 240 N 5.07 2.17 -2.15 -1.27 -2.24 -1.18 -1.29 114.28 113.39 2fja n THR 240 Ca -0.08 -3.25 -0.13 0.00 -2.27 0.00 0.00 64.05 58.32 2fja n THR 240 Cb 0.51 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.46 2fja n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fja n GLY 241 N -1.04 0.00 0.22 3.38 0.00 0.78 -3.44 105.19 105.09 2fja n GLY 241 Ca 0.20 -0.36 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 2fja n GLY 241 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2fja h SER 242 N 0.00 0.65 -0.48 1.61 0.02 -1.84 -1.64 113.55 111.86 2fja h SER 242 Ca -0.30 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.55 2fja h SER 242 Cb 1.18 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 2fja h SER 242 CO 0.36 0.54 0.24 1.23 -1.14 0.00 0.00 176.83 178.06 2fja h GLY 243 N 0.70 0.74 0.71 -3.77 0.00 -1.88 -2.04 103.07 97.53 2fja h GLY 243 Ca 0.18 -0.37 0.03 0.00 0.00 0.00 0.00 47.33 47.18 2fja h GLY 243 CO -0.03 0.35 0.03 -0.97 0.00 0.00 0.00 176.54 175.92 2fja h TYR 244 N 0.64 0.04 0.41 5.60 0.99 -1.83 -1.42 116.97 121.40 2fja h TYR 244 Ca 0.17 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.89 2fja h TYR 244 Cb 0.11 0.01 -0.00 0.00 1.00 0.00 0.00 36.73 37.85 2fja h TYR 244 CO -0.01 0.00 -0.27 -0.92 -0.00 0.00 0.00 178.16 176.96 2fja h TYR 245 N 0.11 -0.72 -0.81 4.88 3.20 -1.08 -1.17 116.97 121.38 2fja h TYR 245 Ca 0.11 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.03 2fja h TYR 245 Cb 0.12 0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 2fja h TYR 245 CO -0.16 -0.39 0.53 0.00 -1.64 0.00 0.00 178.16 176.49 2fja h MET 246 N -0.64 0.89 -0.13 1.82 -0.00 -1.38 -0.00 114.93 115.49 2fja h MET 246 Ca -0.05 -0.05 -0.06 0.00 -0.00 0.00 0.00 59.70 59.53 2fja h MET 246 Cb 0.52 -0.20 -0.00 0.00 -0.00 0.00 0.00 31.60 31.91 2fja h MET 246 CO 0.05 0.59 -0.14 0.78 -0.00 0.00 0.00 176.91 178.18 2fja h GLY 247 N 0.92 0.35 1.34 -3.00 0.00 -1.27 -1.68 103.07 99.72 2fja h GLY 247 Ca 0.34 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 2fja h GLY 247 CO -0.12 0.33 -0.01 0.17 0.00 0.00 0.00 176.54 176.92 2fja h LEU 248 N -0.07 0.78 -1.17 3.11 8.10 -0.90 -0.50 115.31 124.65 2fja h LEU 248 Ca 0.02 -0.19 -0.04 0.00 0.11 0.00 0.00 57.88 57.78 2fja h LEU 248 Cb 0.68 -0.21 -0.02 0.00 -0.44 0.00 0.00 40.66 40.67 2fja h LEU 248 CO 0.03 0.85 0.17 0.11 -4.11 0.00 0.00 178.44 175.49 2fja h LYS 249 N 0.75 0.75 0.00 0.17 1.79 -0.97 -0.87 116.57 118.18 2fja h LYS 249 Ca 0.14 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2fja h LYS 249 Cb 0.47 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 2fja h LYS 249 CO 0.02 0.64 0.00 0.00 -1.08 0.00 0.00 179.45 179.04 2fja n ALA 250 N -2.46 1.87 -0.07 3.86 0.00 -0.64 -4.50 120.51 118.57 2fja n ALA 250 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2fja n ALA 250 Cb 0.18 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2fja n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fja n GLY 251 N 0.46 0.84 3.73 0.00 0.00 -0.33 -4.95 105.19 104.94 2fja n GLY 251 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2fja n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fja s ALA 252 N -2.04 3.41 0.27 4.61 0.00 -0.28 -4.74 121.76 123.00 2fja s ALA 252 Ca 0.00 0.90 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 2fja s ALA 252 Cb 0.00 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 2fja s ALA 252 CO 0.00 -0.36 1.11 -1.64 0.00 0.00 0.00 175.76 174.87 2fja s MET 253 N 0.07 4.62 0.25 0.00 1.00 -1.26 -4.23 119.30 119.76 2fja s MET 253 Ca 0.54 1.81 0.04 0.00 0.00 0.00 0.00 55.69 58.08 2fja s MET 253 Cb -0.31 -3.19 -0.03 0.00 0.00 0.00 0.00 34.83 31.29 2fja s MET 253 CO 0.34 0.18 0.39 -0.51 0.00 0.00 0.00 175.02 175.42 2fja s LEU 254 N -1.33 4.26 -0.01 -0.03 1.43 -0.17 -0.88 118.68 121.95 2fja s LEU 254 Ca 0.45 0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.69 2fja s LEU 254 Cb -0.32 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 42.94 2fja s LEU 254 CO 0.41 -0.10 0.06 0.28 0.23 0.00 0.00 176.35 177.23 2fja s THR 255 N -2.01 0.04 -1.20 5.49 -1.32 0.62 -1.22 115.64 116.04 2fja s THR 255 Ca 0.35 -0.34 -0.07 0.00 -1.21 0.00 0.00 61.69 60.43 2fja s THR 255 Cb -0.09 -0.21 0.05 0.00 -1.51 0.00 0.00 72.50 70.74 2fja s THR 255 CO 0.30 -0.19 0.37 0.00 -2.21 0.00 0.00 174.62 172.89 2fja n GLN 256 N 2.41 -3.17 0.00 7.08 1.13 -0.40 -2.88 117.38 121.55 2fja n GLN 256 Ca -0.17 0.50 0.06 0.00 -1.94 0.00 0.00 57.00 55.45 2fja n GLN 256 Cb 0.58 -5.18 0.30 0.00 0.11 0.00 0.00 30.24 26.05 2fja n GLN 256 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2fja n PHE 257 N -3.79 0.00 0.44 1.08 7.35 -1.26 -1.00 117.46 120.28 2fja n PHE 257 Ca -0.05 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.77 2fja n PHE 257 Cb 0.56 -0.40 0.24 0.00 0.35 0.00 0.00 39.48 40.23 2fja n PHE 257 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 2fja h GLU 258 N 0.00 0.00 -5.85 -4.13 9.09 -1.86 -3.41 114.58 108.41 2fja h GLU 258 Ca 0.00 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.75 2fja h GLU 258 Cb 0.18 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 27.18 2fja h GLU 258 CO 0.00 0.00 1.96 -1.58 0.05 0.00 0.00 179.01 179.44 2fja s HIS 259 N -3.18 2.76 0.73 2.06 2.46 -0.17 -4.87 115.29 115.07 2fja s HIS 259 Ca 0.07 -1.45 -0.07 0.00 0.47 0.00 0.00 55.06 54.09 2fja s HIS 259 Cb 0.10 -4.71 0.08 0.00 -0.13 0.00 0.00 32.58 27.92 2fja s HIS 259 CO 0.67 -1.82 1.03 -0.98 -2.47 0.00 0.00 174.74 171.18 2fja s ARG 260 N 4.26 1.99 -0.09 2.88 3.03 -1.26 -3.77 118.95 125.99 2fja s ARG 260 Ca 0.51 -0.40 0.03 0.00 2.03 0.00 0.00 55.73 57.90 2fja s ARG 260 Cb 0.02 -2.17 0.01 0.00 -1.03 0.00 0.00 34.95 31.78 2fja s ARG 260 CO 0.03 -1.36 -0.19 0.12 -1.13 0.00 0.00 175.30 172.76 2fja s PHE 261 N -3.28 2.15 -0.33 5.89 5.36 -0.31 -4.79 117.98 122.67 2fja s PHE 261 Ca 0.62 -0.89 -0.04 0.00 -0.96 0.00 0.00 56.93 55.66 2fja s PHE 261 Cb -0.09 -1.48 0.05 0.00 -0.34 0.00 0.00 43.02 41.15 2fja s PHE 261 CO 0.45 -0.39 0.07 0.42 -1.46 0.00 0.00 175.22 174.31 2fja s ILE 262 N 0.54 3.44 0.00 3.12 1.09 -1.26 -2.07 121.20 126.05 2fja s ILE 262 Ca -0.16 -1.28 -0.26 0.00 -1.10 0.00 0.00 60.65 57.85 2fja s ILE 262 Cb -0.17 -2.98 -0.04 0.00 -1.06 0.00 0.00 42.46 38.21 2fja s ILE 262 CO 0.06 -0.18 0.83 -2.16 -0.10 0.00 0.00 174.94 173.39 2fja s PRO 263 N 1.33 4.52 -0.35 2.79 0.04 -1.26 -4.86 135.00 137.20 2fja s PRO 263 Ca -0.03 1.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.98 2fja s PRO 263 Cb -0.20 -3.42 -0.00 0.00 0.04 0.00 0.00 34.50 30.92 2fja s PRO 263 CO 0.01 0.11 0.50 0.12 0.04 0.00 0.00 177.00 177.78 2fja s PHE 264 N 0.54 3.18 0.29 0.56 5.36 -1.26 -1.18 117.98 125.47 2fja s PHE 264 Ca 0.43 0.15 0.01 0.00 -0.96 0.00 0.00 56.93 56.56 2fja s PHE 264 Cb -0.20 -2.91 -0.02 0.00 -0.34 0.00 0.00 43.02 39.55 2fja s PHE 264 CO 0.24 -0.54 0.31 1.03 -1.46 0.00 0.00 175.22 174.80 2fja s ARG 265 N 2.36 1.64 0.27 10.12 1.81 -0.80 -4.77 118.95 129.58 2fja s ARG 265 Ca 0.18 -1.79 -0.31 0.00 -1.72 0.00 0.00 55.73 52.09 2fja s ARG 265 Cb -0.16 0.35 -0.13 0.00 -0.45 0.00 0.00 34.95 34.57 2fja s ARG 265 CO 0.13 -0.62 1.49 1.19 -0.68 0.00 0.00 175.30 176.81 2fja n PHE 266 N -0.50 2.49 -1.77 -0.53 3.01 -0.99 -0.72 117.46 118.46 2fja n PHE 266 Ca 0.04 0.35 -0.41 0.00 1.01 0.00 0.00 57.45 58.44 2fja n PHE 266 Cb 0.63 -2.52 0.01 0.00 -0.01 0.00 0.00 39.48 37.58 2fja n PHE 266 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2fja n LYS 267 N 2.05 2.55 0.00 -1.08 4.81 0.14 -0.58 118.16 126.05 2fja n LYS 267 Ca 0.10 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.44 2fja n LYS 267 Cb 0.34 -2.66 0.00 0.00 0.02 0.00 0.00 35.03 32.73 2fja n LYS 267 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2fja n ASP 268 N 0.26 0.00 0.11 3.14 10.43 -1.26 -4.14 116.55 125.09 2fja n ASP 268 Ca 0.02 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.38 2fja n ASP 268 Cb 0.40 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.34 2fja n ASP 268 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 2fja h GLY 269 N 0.00 0.00 -3.44 0.44 0.00 -1.89 -3.48 103.07 94.69 2fja h GLY 269 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 2fja h GLY 269 CO 0.00 0.00 -0.47 -1.72 0.00 0.00 0.00 176.54 174.35 2fja n TYR 270 N -3.24 -1.45 -1.06 5.60 0.53 0.26 -4.50 117.16 113.30 2fja n TYR 270 Ca 0.01 0.37 -0.32 0.00 -1.02 0.00 0.00 57.90 56.94 2fja n TYR 270 Cb 0.79 -3.69 0.12 0.00 -1.03 0.00 0.00 39.34 35.54 2fja n TYR 270 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 2fja s GLY 271 N -2.72 1.87 0.52 2.72 0.00 -1.25 -4.63 107.32 103.83 2fja s GLY 271 Ca 0.21 0.58 -0.22 0.00 0.00 0.00 0.00 44.72 45.30 2fja s GLY 271 CO 0.26 0.98 1.27 2.56 0.00 0.00 0.00 173.10 178.17 2fja s PRO 272 N -4.51 3.33 0.00 2.90 0.04 -1.26 -2.34 135.00 133.16 2fja s PRO 272 Ca 0.67 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.74 2fja s PRO 272 Cb -0.23 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.04 2fja s PRO 272 CO 0.54 -0.97 0.05 1.33 0.04 0.00 0.00 177.00 177.98 2fja n VAL 273 N -0.92 0.00 -0.02 -0.36 0.24 -1.26 -4.70 118.33 111.31 2fja n VAL 273 Ca 0.10 -0.48 -0.09 0.00 -2.04 0.00 0.00 64.34 61.82 2fja n VAL 273 Cb 0.47 1.00 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 2fja n VAL 273 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2fja h GLY 274 N 0.16 0.10 0.94 7.63 0.00 -1.94 0.36 103.07 110.32 2fja h GLY 274 Ca 0.00 0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2fja h GLY 274 CO 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 176.54 176.55 2fja h ALA 275 N 1.14 0.54 -0.44 3.60 0.00 -1.97 0.55 119.26 122.67 2fja h ALA 275 Ca 0.07 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2fja h ALA 275 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2fja h ALA 275 CO -0.15 0.25 0.28 -1.49 0.00 0.00 0.00 179.25 178.15 2fja h TRP 276 N 0.52 0.54 0.15 0.00 4.06 -1.74 0.31 115.95 119.79 2fja h TRP 276 Ca 0.12 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.08 2fja h TRP 276 Cb 0.37 -0.18 0.00 0.00 -1.00 0.00 0.00 29.16 28.35 2fja h TRP 276 CO 0.03 0.33 -0.07 0.74 -3.56 0.00 0.00 178.44 175.91 2fja h PHE 277 N 0.58 -0.18 0.17 0.49 0.05 -0.19 0.54 116.94 118.40 2fja h PHE 277 Ca 0.17 -0.00 -0.28 0.00 3.82 0.00 0.00 57.97 61.67 2fja h PHE 277 Cb -0.05 0.06 0.02 0.00 2.00 0.00 0.00 35.95 37.98 2fja h PHE 277 CO -0.05 0.24 -1.31 -0.07 -0.18 0.00 0.00 178.31 176.94 2fja h LEU 278 N -0.70 0.58 0.00 1.54 3.38 -0.89 -3.17 115.31 116.04 2fja h LEU 278 Ca -0.02 -0.92 -0.17 0.00 0.09 0.00 0.00 57.88 56.86 2fja h LEU 278 Cb 0.51 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2fja h LEU 278 CO 0.03 1.61 -0.97 0.15 0.09 0.00 0.00 178.44 179.35 2fja h PHE 279 N -0.13 0.00 -0.00 1.13 3.57 -0.53 -3.39 116.94 117.59 2fja h PHE 279 Ca -0.25 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.25 2fja h PHE 279 Cb 1.90 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.64 2fja h PHE 279 CO 0.14 1.25 -0.16 1.19 -2.23 0.00 0.00 178.31 178.50 2fja n PHE 280 N -4.48 0.00 -3.59 0.41 3.01 -0.16 -4.94 117.46 107.70 2fja n PHE 280 Ca -0.26 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 57.95 2fja n PHE 280 Cb 0.60 -0.24 0.07 0.00 -0.01 0.00 0.00 39.48 39.90 2fja n PHE 280 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2fja n LYS 281 N -1.10 -7.36 -2.39 -1.08 4.76 -0.66 -4.79 118.16 105.54 2fja n LYS 281 Ca 0.12 0.80 -0.38 0.00 -2.87 0.00 0.00 58.31 55.98 2fja n LYS 281 Cb 0.30 -5.82 -0.03 0.00 -1.84 0.00 0.00 35.03 27.64 2fja n LYS 281 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fja s LYS 283 N -2.38 3.20 -0.17 0.00 1.02 -1.26 -4.58 119.74 115.57 2fja s LYS 283 Ca 0.58 -0.46 -0.03 0.00 0.02 0.00 0.00 55.97 56.08 2fja s LYS 283 Cb -0.27 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 34.08 2fja s LYS 283 CO 0.34 0.64 -0.06 0.00 -0.92 0.00 0.00 175.35 175.35 2fja s ALA 284 N -1.29 2.83 0.09 5.17 0.00 -1.26 -1.31 121.76 125.98 2fja s ALA 284 Ca 0.26 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.30 2fja s ALA 284 Cb -0.12 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.44 2fja s ALA 284 CO 0.18 -0.00 -0.10 0.15 0.00 0.00 0.00 175.76 175.98 2fja s LYS 285 N 0.75 0.81 0.62 0.00 1.02 -0.24 -3.92 119.74 118.77 2fja s LYS 285 Ca -0.03 -1.08 -0.11 0.00 0.02 0.00 0.00 55.97 54.77 2fja s LYS 285 Cb -0.15 -0.54 0.15 0.00 -0.52 0.00 0.00 37.83 36.77 2fja s LYS 285 CO 0.02 0.09 0.77 0.27 -0.92 0.00 0.00 175.35 175.58 2fja n ASN 286 N 0.76 -0.30 0.31 2.83 0.23 -0.47 0.11 115.26 118.73 2fja n ASN 286 Ca -0.17 -1.21 0.19 0.00 -0.53 0.00 0.00 54.58 52.86 2fja n ASN 286 Cb 0.57 -0.61 1.00 0.00 -2.08 0.00 0.00 39.78 38.66 2fja n ASN 286 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2fja h ALA 287 N -2.00 1.29 -0.53 -2.53 0.00 0.16 -1.44 119.26 114.22 2fja h ALA 287 Ca -0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2fja h ALA 287 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2fja h ALA 287 CO 0.18 -0.17 0.00 0.66 0.00 0.00 0.00 179.25 179.92 2fja n TYR 288 N -3.19 0.69 -0.71 0.00 4.02 -1.26 -4.95 117.16 111.76 2fja n TYR 288 Ca -0.02 -0.35 0.00 0.00 -0.01 0.00 0.00 57.90 57.52 2fja n TYR 288 Cb 0.22 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 2fja n TYR 288 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2fja n GLY 289 N 1.55 0.59 3.72 2.72 0.00 -0.54 -5.05 105.19 108.18 2fja n GLY 289 Ca 0.21 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 2fja n GLY 289 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fja s GLU 290 N -1.02 4.28 -0.79 1.61 2.02 -1.26 -4.83 118.70 118.70 2fja s GLU 290 Ca 0.00 0.22 -0.25 0.00 0.02 0.00 0.00 54.97 54.96 2fja s GLU 290 Cb 0.00 -3.44 0.04 0.00 0.10 0.00 0.00 34.13 30.84 2fja s GLU 290 CO 0.00 0.19 1.26 -2.00 0.02 0.00 0.00 175.26 174.72 2fja s GLU 291 N 0.60 3.27 0.47 1.61 2.12 -1.26 -1.36 118.70 124.14 2fja s GLU 291 Ca 0.20 -0.57 0.32 0.00 0.36 0.00 0.00 54.97 55.27 2fja s GLU 291 Cb -0.14 -4.45 1.71 0.00 0.26 0.00 0.00 34.13 31.51 2fja s GLU 291 CO 0.06 -2.09 1.97 0.10 -0.54 0.00 0.00 175.26 174.76 2fja h TYR 292 N 9.86 0.00 0.00 5.30 -0.00 -1.95 -0.14 116.97 130.04 2fja h TYR 292 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.56 2fja h TYR 292 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.77 2fja h TYR 292 CO 1.13 0.00 0.00 0.44 -0.00 0.00 0.00 178.16 179.73 2fja n ILE 293 N -2.61 0.78 -0.08 -0.90 -6.64 -1.26 -0.92 119.36 107.72 2fja n ILE 293 Ca -0.02 0.14 -0.09 0.00 -1.77 0.00 0.00 62.75 61.01 2fja n ILE 293 Cb 0.05 -1.02 -0.03 0.00 -1.44 0.00 0.00 39.64 37.20 2fja n ILE 293 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 2fja n LYS 294 N -2.11 0.50 0.33 6.28 5.02 -0.09 -3.74 118.16 124.35 2fja n LYS 294 Ca 0.03 0.39 0.21 0.00 -2.02 0.00 0.00 58.31 56.92 2fja n LYS 294 Cb 0.26 -1.58 1.14 0.00 -0.02 0.00 0.00 35.03 34.83 2fja n LYS 294 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2fja h THR 295 N -1.00 0.07 -0.32 -0.18 1.35 -1.50 -2.14 112.91 109.19 2fja h THR 295 Ca -0.06 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 2fja h THR 295 Cb 0.82 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2fja h THR 295 CO -0.04 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.78 2fja n ARG 296 N -3.18 2.88 0.11 4.72 5.12 -0.10 -4.66 116.66 121.55 2fja n ARG 296 Ca -0.03 -2.12 -0.13 0.00 -1.93 0.00 0.00 57.85 53.65 2fja n ARG 296 Cb 0.09 -1.32 -0.07 0.00 -1.16 0.00 0.00 32.46 30.00 2fja n ARG 296 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2fja h ALA 297 N 1.90 -0.21 -1.01 7.54 0.00 -1.47 -2.94 119.26 123.07 2fja h ALA 297 Ca 0.00 -0.04 0.24 0.00 0.00 0.00 0.00 54.91 55.11 2fja h ALA 297 Cb 0.80 0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.59 2fja h ALA 297 CO 0.03 -0.62 0.62 0.00 0.00 0.00 0.00 179.25 179.28 2fja h ALA 298 N 0.63 1.93 0.00 0.00 0.00 -1.83 0.58 119.26 120.58 2fja h ALA 298 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fja h ALA 298 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2fja h ALA 298 CO 0.01 -0.35 0.00 0.93 0.00 0.00 0.00 179.25 179.84 2fja h GLU 299 N 0.56 0.00 -0.00 0.00 5.08 -1.85 -0.75 114.58 117.61 2fja h GLU 299 Ca 0.60 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.96 2fja h GLU 299 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2fja h GLU 299 CO -0.37 0.00 -0.31 1.28 -1.00 0.00 0.00 179.01 178.60 2fja n LEU 300 N -2.44 0.48 0.13 1.33 4.77 0.20 -3.99 117.00 117.47 2fja n LEU 300 Ca -0.01 0.06 0.09 0.00 -0.03 0.00 0.00 56.01 56.11 2fja n LEU 300 Cb 0.09 -0.27 0.58 0.00 -2.33 0.00 0.00 43.42 41.49 2fja n LEU 300 CO 0.14 0.11 1.12 -0.08 -1.33 0.00 0.00 177.39 177.35 2fja h GLU 301 N 0.26 0.18 0.00 3.23 4.22 -1.23 -0.84 114.58 120.40 2fja h GLU 301 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 2fja h GLU 301 Cb 0.48 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2fja h GLU 301 CO 0.00 0.12 0.00 0.36 -2.18 0.00 0.00 179.01 177.31 2fja n LYS 302 N -4.50 0.01 -1.30 1.92 2.85 -1.26 -3.27 118.16 112.61 2fja n LYS 302 Ca 0.01 0.21 -0.29 0.00 -1.05 0.00 0.00 58.31 57.18 2fja n LYS 302 Cb 0.16 -1.52 0.12 0.00 -0.65 0.00 0.00 35.03 33.14 2fja n LYS 302 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2fja n TYR 303 N -1.54 3.07 -1.87 5.58 4.02 -0.32 -5.00 117.16 121.11 2fja n TYR 303 Ca 0.04 -2.53 -0.41 0.00 -0.01 0.00 0.00 57.90 54.99 2fja n TYR 303 Cb 0.21 -1.19 -0.00 0.00 -0.02 0.00 0.00 39.34 38.33 2fja n TYR 303 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 2fja s LYS 304 N -3.61 4.12 0.03 -0.72 1.02 -1.20 -0.22 119.74 119.14 2fja s LYS 304 Ca 0.61 2.49 0.24 0.00 0.02 0.00 0.00 55.97 59.32 2fja s LYS 304 Cb 0.49 -2.96 0.25 0.00 -0.52 0.00 0.00 37.83 35.09 2fja s LYS 304 CO 0.03 -0.49 1.22 -0.35 -0.92 0.00 0.00 175.35 174.84 2fja n PRO 305 N 0.46 0.11 -0.32 -1.68 -0.04 -1.26 -4.82 135.00 127.44 2fja n PRO 305 Ca 0.01 0.01 0.17 0.00 -0.04 0.00 0.00 63.50 63.64 2fja n PRO 305 Cb 0.40 -1.54 0.36 0.00 -0.04 0.00 0.00 33.50 32.68 2fja n PRO 305 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2fja h TYR 306 N 0.00 0.76 0.00 0.54 -1.99 -1.55 0.12 116.97 114.85 2fja h TYR 306 Ca 0.00 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.77 2fja h TYR 306 Cb 0.59 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 39.13 2fja h TYR 306 CO 0.00 -0.07 0.00 0.41 -0.00 0.00 0.00 178.16 178.50 2fja n GLY 307 N -1.33 -0.49 0.31 3.88 0.00 0.69 -2.21 105.19 106.04 2fja n GLY 307 Ca 0.25 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.27 2fja n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fja n ALA 308 N -1.22 2.47 -0.91 4.61 0.00 0.41 -4.83 120.51 121.04 2fja n ALA 308 Ca 0.04 -0.58 -0.29 0.00 0.00 0.00 0.00 53.44 52.61 2fja n ALA 308 Cb 0.06 -0.25 0.20 0.00 0.00 0.00 0.00 19.45 19.45 2fja n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fja s ALA 309 N -0.64 0.53 -0.11 0.00 0.00 -0.94 -4.99 121.76 115.61 2fja s ALA 309 Ca 0.09 -0.16 -0.04 0.00 0.00 0.00 0.00 51.96 51.85 2fja s ALA 309 Cb 0.06 -3.20 0.05 0.00 0.00 0.00 0.00 23.12 20.03 2fja s ALA 309 CO 0.09 -3.14 0.08 -0.65 0.00 0.00 0.00 175.76 172.14 2fja s GLN 310 N -4.75 -0.00 0.96 0.00 -1.52 -1.26 -3.24 119.66 109.84 2fja s GLN 310 Ca 0.66 0.15 -0.12 0.00 -1.95 0.00 0.00 55.36 54.11 2fja s GLN 310 Cb -0.21 -1.17 0.16 0.00 -0.22 0.00 0.00 33.01 31.57 2fja s GLN 310 CO 0.60 -0.50 1.09 -2.14 -0.25 0.00 0.00 175.29 174.09 2fja s PRO 311 N 2.16 0.77 0.30 2.91 0.02 -1.26 -5.00 135.00 134.91 2fja s PRO 311 Ca 0.04 0.74 -0.29 0.00 0.02 0.00 0.00 61.00 61.51 2fja s PRO 311 Cb -0.14 -1.76 -0.10 0.00 0.02 0.00 0.00 34.50 32.52 2fja s PRO 311 CO -0.06 -2.55 1.29 0.42 -0.33 0.00 0.00 177.00 175.76 2fja s ILE 312 N -2.89 2.87 0.24 2.83 1.09 -1.20 -4.90 121.20 119.23 2fja s ILE 312 Ca 0.65 0.84 -0.30 0.00 -1.10 0.00 0.00 60.65 60.74 2fja s ILE 312 Cb -0.19 -3.54 -0.15 0.00 -1.06 0.00 0.00 42.46 37.53 2fja s ILE 312 CO 0.58 0.19 1.10 -2.65 -0.10 0.00 0.00 174.94 174.06 2fja n PRO 313 N 1.15 1.33 -0.21 2.79 -0.02 -1.26 -4.77 135.00 134.02 2fja n PRO 313 Ca 0.01 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2fja n PRO 313 Cb 0.42 -1.91 0.11 0.00 -0.02 0.00 0.00 33.50 32.10 2fja n PRO 313 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2fja h THR 314 N 2.34 0.77 -0.82 3.45 2.02 -1.91 -1.43 112.91 117.33 2fja h THR 314 Ca -0.41 -0.14 0.05 0.00 0.77 0.00 0.00 66.41 66.68 2fja h THR 314 Cb 1.34 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 2fja h THR 314 CO 0.66 0.08 0.54 1.55 0.37 0.00 0.00 175.52 178.71 2fja h PRO 315 N 0.42 0.91 -0.24 6.66 0.13 -1.84 -0.53 132.00 137.51 2fja h PRO 315 Ca 0.31 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 65.29 2fja h PRO 315 Cb 0.38 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.29 2fja h PRO 315 CO -0.31 0.60 -0.27 -0.07 -0.23 0.00 0.00 178.00 177.73 2fja h LEU 316 N 0.94 0.48 -0.80 1.56 3.38 -1.40 0.14 115.31 119.61 2fja h LEU 316 Ca 0.35 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 2fja h LEU 316 Cb 0.16 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2fja h LEU 316 CO -0.12 0.74 -0.24 0.03 0.09 0.00 0.00 178.44 178.95 2fja h ARG 317 N 0.42 0.64 -0.59 1.13 3.08 -0.55 -2.04 114.38 116.47 2fja h ARG 317 Ca 0.06 -0.25 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 2fja h ARG 317 Cb 0.70 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 2fja h ARG 317 CO 0.05 0.83 0.11 -0.91 -1.07 0.00 0.00 179.97 178.97 2fja h ASN 318 N 0.56 0.93 -0.87 7.04 -0.26 -0.55 -2.74 115.58 119.69 2fja h ASN 318 Ca 0.08 -0.25 0.07 0.00 -0.56 0.00 0.00 56.30 55.64 2fja h ASN 318 Cb 0.71 -0.25 -0.07 0.00 -1.06 0.00 0.00 38.32 37.66 2fja h ASN 318 CO 0.05 0.94 0.53 -0.74 -1.06 0.00 0.00 177.43 177.16 2fja h HIS 319 N 0.87 0.97 -0.77 1.19 2.76 -0.24 0.14 115.15 120.08 2fja h HIS 319 Ca 0.18 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.34 2fja h HIS 319 Cb 0.41 -0.31 -0.03 0.00 1.55 0.00 0.00 27.41 29.02 2fja h HIS 319 CO 0.03 0.47 0.33 1.96 -1.30 0.00 0.00 177.93 179.41 2fja h GLN 320 N 0.94 1.12 -0.42 5.26 4.20 -1.14 -0.78 115.11 124.29 2fja h GLN 320 Ca 0.39 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 2fja h GLN 320 Cb 0.24 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2fja h GLN 320 CO -0.20 0.89 0.12 0.28 -0.67 0.00 0.00 178.83 179.26 2fja h VAL 321 N 1.10 1.22 -0.82 -0.54 2.07 -0.88 -2.64 116.25 115.76 2fja h VAL 321 Ca 0.26 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 2fja h VAL 321 Cb 0.17 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2fja h VAL 321 CO -0.03 0.26 0.50 0.24 0.02 0.00 0.00 177.57 178.57 2fja h MET 322 N 0.54 1.11 -0.77 1.57 2.86 -0.19 -0.67 114.93 119.38 2fja h MET 322 Ca 0.13 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2fja h MET 322 Cb 0.28 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 2fja h MET 322 CO -0.00 0.77 0.28 -0.07 1.06 0.00 0.00 176.91 178.94 2fja h LEU 323 N 1.13 1.09 -0.62 1.22 3.38 -0.98 0.09 115.31 120.62 2fja h LEU 323 Ca 0.30 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 2fja h LEU 323 Cb -0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 2fja h LEU 323 CO -0.06 0.99 0.14 -0.33 0.09 0.00 0.00 178.44 179.27 2fja h GLU 324 N 1.13 1.00 -0.40 1.13 4.39 -1.00 -1.72 114.58 119.12 2fja h GLU 324 Ca 0.25 -0.25 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2fja h GLU 324 Cb 0.26 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2fja h GLU 324 CO -0.02 0.92 0.13 0.82 -1.16 0.00 0.00 179.01 179.70 2fja h ILE 325 N 0.92 1.21 -0.31 3.13 2.04 -0.63 -1.05 117.51 122.82 2fja h ILE 325 Ca 0.19 -0.69 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 2fja h ILE 325 Cb 0.37 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2fja h ILE 325 CO 0.00 0.24 -0.02 0.24 0.00 0.00 0.00 178.15 178.62 2fja h MET 326 N 0.50 0.48 0.00 2.37 2.86 -0.85 -1.69 114.93 118.60 2fja h MET 326 Ca 0.13 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2fja h MET 326 Cb 0.25 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.84 2fja h MET 326 CO -0.01 0.53 0.00 -0.25 1.06 0.00 0.00 176.91 178.24 2fja n ASP 327 N -4.28 0.00 -1.46 1.22 8.00 -0.66 -4.92 116.55 114.46 2fja n ASP 327 Ca 0.01 -0.06 -0.06 0.00 0.71 0.00 0.00 54.79 55.39 2fja n ASP 327 Cb 0.25 -0.31 0.02 0.00 -0.02 0.00 0.00 41.12 41.07 2fja n ASP 327 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fja n GLY 328 N 1.17 0.45 1.58 0.44 0.00 -0.63 -4.97 105.19 103.22 2fja n GLY 328 Ca 0.13 -0.39 -0.01 0.00 0.00 0.00 0.00 46.02 45.75 2fja n GLY 328 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2fja n ASN 329 N -0.24 4.28 -4.90 1.61 3.02 -0.45 -4.98 115.26 113.60 2fja n ASN 329 Ca -0.02 -3.24 -0.28 0.00 -0.03 0.00 0.00 54.58 51.00 2fja n ASN 329 Cb 0.52 -0.67 0.01 0.00 -0.61 0.00 0.00 39.78 39.04 2fja n ASN 329 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2fja s GLN 330 N -2.98 3.34 0.61 3.52 -0.21 -1.26 -0.63 119.66 122.05 2fja s GLN 330 Ca 0.50 0.33 -0.17 0.00 0.02 0.00 0.00 55.36 56.04 2fja s GLN 330 Cb 0.41 -2.23 -0.02 0.00 1.00 0.00 0.00 33.01 32.16 2fja s GLN 330 CO 0.10 -0.51 1.12 -2.14 -2.12 0.00 0.00 175.29 171.75 2fja s PRO 331 N -4.98 3.01 -0.21 2.91 0.02 -1.26 -4.57 135.00 129.92 2fja s PRO 331 Ca 0.52 1.50 -0.10 0.00 0.02 0.00 0.00 61.00 62.94 2fja s PRO 331 Cb -0.11 -1.97 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 2fja s PRO 331 CO 0.48 -1.10 0.13 0.42 -0.33 0.00 0.00 177.00 176.60 2fja s ILE 332 N -2.08 5.33 0.04 2.83 -1.09 -1.26 -0.53 121.20 124.44 2fja s ILE 332 Ca 0.70 0.16 0.06 0.00 -2.23 0.00 0.00 60.65 59.34 2fja s ILE 332 Cb -0.22 -3.44 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 2fja s ILE 332 CO 0.35 0.42 -0.13 -0.31 -1.23 0.00 0.00 174.94 174.05 2fja s TYR 333 N 0.52 2.70 -0.42 3.97 1.51 0.12 -0.61 117.35 125.14 2fja s TYR 333 Ca 0.07 -0.16 -0.14 0.00 -1.01 0.00 0.00 57.07 55.83 2fja s TYR 333 Cb -0.12 -1.50 0.04 0.00 -0.11 0.00 0.00 41.96 40.27 2fja s TYR 333 CO -0.00 0.33 0.31 -1.64 -1.11 0.00 0.00 175.55 173.43 2fja s MET 334 N -1.60 2.92 -1.41 -0.62 -1.94 0.87 -1.08 119.30 116.44 2fja s MET 334 Ca 0.17 -1.16 -0.14 0.00 -1.71 0.00 0.00 55.69 52.85 2fja s MET 334 Cb -0.11 -3.96 0.06 0.00 2.01 0.00 0.00 34.83 32.83 2fja s MET 334 CO 0.08 -0.83 2.09 0.72 -0.01 0.00 0.00 175.02 177.06 2fja n HIS 335 N 5.12 3.71 0.11 -0.03 8.25 -0.43 -1.94 115.22 130.02 2fja n HIS 335 Ca -0.11 -2.94 0.03 0.00 -0.26 0.00 0.00 57.72 54.43 2fja n HIS 335 Cb 0.46 -2.50 0.42 0.00 1.12 0.00 0.00 29.99 29.48 2fja n HIS 335 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2fja h THR 336 N 4.26 1.15 -0.43 1.59 1.35 -1.84 -2.09 112.91 116.89 2fja h THR 336 Ca 0.52 -0.61 -0.08 0.00 -0.55 0.00 0.00 66.41 65.70 2fja h THR 336 Cb 0.68 1.08 -0.02 0.00 -1.73 0.00 0.00 68.15 68.16 2fja h THR 336 CO 1.77 0.20 -0.06 1.05 -0.25 0.00 0.00 175.52 178.22 2fja h GLU 337 N 0.25 0.74 0.01 4.72 9.09 -1.43 -0.72 114.58 127.25 2fja h GLU 337 Ca 0.06 -0.22 -0.22 0.00 0.05 0.00 0.00 59.36 59.03 2fja h GLU 337 Cb 0.27 -0.08 -0.03 0.00 -1.65 0.00 0.00 28.75 27.26 2fja h GLU 337 CO 0.01 0.80 -1.05 0.93 0.05 0.00 0.00 179.01 179.74 2fja h GLU 338 N 0.68 0.03 -0.09 1.06 5.08 -1.78 -2.86 114.58 116.70 2fja h GLU 338 Ca 0.13 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2fja h GLU 338 Cb 0.51 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2fja h GLU 338 CO 0.03 1.01 -0.04 0.00 -1.00 0.00 0.00 179.01 179.00 2fja h ALA 339 N 0.95 0.13 -0.53 3.43 0.00 -1.12 -1.57 119.26 120.55 2fja h ALA 339 Ca -0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2fja h ALA 339 Cb 1.80 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.54 2fja h ALA 339 CO 0.14 -0.11 0.19 -0.07 0.00 0.00 0.00 179.25 179.40 2fja h LEU 340 N -0.17 0.75 -0.12 0.00 3.38 -1.23 -0.91 115.31 117.01 2fja h LEU 340 Ca 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2fja h LEU 340 Cb 0.49 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2fja h LEU 340 CO 0.01 0.74 0.06 0.00 0.09 0.00 0.00 178.44 179.34 2fja h ALA 341 N 1.04 0.15 -0.68 1.53 0.00 -1.53 -0.96 119.26 118.82 2fja h ALA 341 Ca 0.17 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2fja h ALA 341 Cb 0.24 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2fja h ALA 341 CO -0.01 -0.31 0.41 1.49 0.00 0.00 0.00 179.25 180.83 2fja h GLU 342 N 0.09 0.75 -0.31 0.00 4.57 -1.12 -2.28 114.58 116.27 2fja h GLU 342 Ca 0.04 -0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.01 2fja h GLU 342 Cb 0.09 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 2fja h GLU 342 CO -0.01 0.50 -0.44 1.25 -1.18 0.00 0.00 179.01 179.13 2fja h LEU 343 N 0.78 0.93 -1.11 1.64 5.85 -0.99 -3.22 115.31 119.18 2fja h LEU 343 Ca 0.29 -0.50 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 2fja h LEU 343 Cb 0.09 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2fja h LEU 343 CO -0.14 1.26 -0.26 0.00 -0.34 0.00 0.00 178.44 178.96 2fja h ALA 344 N 0.71 1.03 -6.49 1.25 0.00 -1.03 -3.48 119.26 111.26 2fja h ALA 344 Ca 0.03 -0.24 -0.51 0.00 0.00 0.00 0.00 54.91 54.20 2fja h ALA 344 Cb 1.04 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.69 2fja h ALA 344 CO 0.10 0.33 -0.79 0.41 0.00 0.00 0.00 179.25 179.30 2fja n GLY 345 N 0.12 -0.47 2.76 0.00 0.00 -0.87 -1.47 105.19 105.25 2fja n GLY 345 Ca -0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2fja n GLY 345 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fja n GLY 346 N -1.58 3.02 3.56 -0.02 0.00 -1.26 -4.98 105.19 103.93 2fja n GLY 346 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2fja n GLY 346 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2fja s ASP 347 N -1.30 5.91 0.37 1.61 -1.08 -0.54 -4.89 116.67 116.74 2fja s ASP 347 Ca 0.00 0.14 0.06 0.00 -0.52 0.00 0.00 52.55 52.23 2fja s ASP 347 Cb 0.00 -2.54 0.76 0.00 -1.46 0.00 0.00 42.92 39.67 2fja s ASP 347 CO 0.00 -1.92 1.96 0.11 0.52 0.00 0.00 175.17 175.84 2fja h LYS 348 N 11.85 0.71 -0.11 4.34 1.57 -1.94 0.32 116.57 133.32 2fja h LYS 348 Ca -0.27 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.32 2fja h LYS 348 Cb 1.10 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2fja h LYS 348 CO 1.21 0.47 -0.58 0.87 -0.57 0.00 0.00 179.45 180.85 2fja h LYS 349 N 0.74 0.35 -0.41 3.15 1.57 -1.96 -1.79 116.57 118.21 2fja h LYS 349 Ca 0.31 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.73 2fja h LYS 349 Cb 0.28 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2fja h LYS 349 CO -0.10 0.83 -0.28 -0.22 -0.57 0.00 0.00 179.45 179.10 2fja h LYS 350 N 0.26 0.89 -0.21 3.15 3.64 -1.58 -2.50 116.57 120.22 2fja h LYS 350 Ca -0.00 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 58.97 2fja h LYS 350 Cb 1.09 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 2fja h LYS 350 CO 0.10 1.05 0.11 1.25 -2.27 0.00 0.00 179.45 179.69 2fja h LEU 351 N 0.76 0.27 -0.95 5.20 5.85 -0.78 -2.01 115.31 123.64 2fja h LEU 351 Ca 0.09 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.81 2fja h LEU 351 Cb 0.84 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.73 2fja h LEU 351 CO 0.07 0.28 0.59 0.50 -0.34 0.00 0.00 178.44 179.54 2fja h LYS 352 N 0.23 0.97 -0.20 1.25 3.64 -1.21 0.45 116.57 121.71 2fja h LYS 352 Ca 0.07 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2fja h LYS 352 Cb 0.07 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2fja h LYS 352 CO -0.01 0.64 0.03 1.25 -2.27 0.00 0.00 179.45 179.09 2fja h HIS 353 N 1.00 0.35 0.00 1.91 2.76 -1.05 -2.06 115.15 118.07 2fja h HIS 353 Ca 0.44 -0.05 -0.06 0.00 -2.20 0.00 0.00 60.37 58.50 2fja h HIS 353 Cb 0.33 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2fja h HIS 353 CO -0.02 0.49 -0.27 -0.84 -1.30 0.00 0.00 177.93 175.99 2fja h ILE 354 N 0.12 0.61 -0.33 6.26 3.07 -1.01 -2.21 117.51 124.02 2fja h ILE 354 Ca 0.06 -1.30 -0.13 0.00 1.55 0.00 0.00 64.86 65.04 2fja h ILE 354 Cb 0.33 1.88 -0.01 0.00 -0.27 0.00 0.00 36.82 38.74 2fja h ILE 354 CO 0.00 0.26 -0.32 0.22 -1.05 0.00 0.00 178.15 177.27 2fja h TYR 355 N 0.00 0.84 -0.14 0.16 3.20 -0.76 0.21 116.97 120.47 2fja h TYR 355 Ca -0.00 -0.22 -0.18 0.00 3.14 0.00 0.00 58.73 61.47 2fja h TYR 355 Cb 0.85 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.93 2fja h TYR 355 CO 0.00 0.95 -0.66 0.93 -1.64 0.00 0.00 178.16 177.74 2fja h GLU 356 N 0.61 0.56 -0.46 1.82 5.08 -1.06 -2.23 114.58 118.90 2fja h GLU 356 Ca 0.07 -0.41 -0.10 0.00 -1.00 0.00 0.00 59.36 57.92 2fja h GLU 356 Cb 0.84 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 2fja h GLU 356 CO 0.07 1.03 -0.11 0.93 -1.00 0.00 0.00 179.01 179.93 2fja h GLU 357 N 0.40 0.84 -0.15 2.33 5.08 -1.17 -0.90 114.58 121.01 2fja h GLU 357 Ca -0.02 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2fja h GLU 357 Cb 1.24 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2fja h GLU 357 CO 0.12 0.91 0.07 0.00 -1.00 0.00 0.00 179.01 179.11 2fja h ALA 358 N 1.11 0.19 -0.21 3.43 0.00 -0.80 -1.54 119.26 121.44 2fja h ALA 358 Ca 0.12 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2fja h ALA 358 Cb 0.61 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2fja h ALA 358 CO 0.04 -0.24 -0.32 0.74 0.00 0.00 0.00 179.25 179.47 2fja h PHE 359 N 0.11 0.50 -0.51 0.00 -1.00 -1.28 -2.75 116.94 112.00 2fja h PHE 359 Ca 0.05 -0.12 -0.05 0.00 2.81 0.00 0.00 57.97 60.66 2fja h PHE 359 Cb 0.13 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.55 2fja h PHE 359 CO -0.02 0.71 0.11 1.49 -1.61 0.00 0.00 178.31 178.98 2fja h GLU 360 N 0.37 0.79 -0.79 1.51 4.81 -0.90 0.16 114.58 120.54 2fja h GLU 360 Ca 0.05 -0.16 0.18 0.00 -0.13 0.00 0.00 59.36 59.29 2fja h GLU 360 Cb 0.75 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 2fja h GLU 360 CO 0.06 0.72 0.54 0.22 -0.73 0.00 0.00 179.01 179.82 2fja h ASP 361 N 0.76 0.30 0.04 1.04 3.58 -0.97 0.14 116.42 121.31 2fja h ASP 361 Ca 0.17 0.02 -0.28 0.00 0.42 0.00 0.00 57.03 57.36 2fja h ASP 361 Cb 0.30 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 2fja h ASP 361 CO 0.00 0.14 -1.51 0.49 -2.88 0.00 0.00 179.24 175.48 2fja n PHE 362 N -4.45 1.09 0.30 0.28 0.99 -0.71 -4.18 117.46 110.79 2fja n PHE 362 Ca 0.16 0.38 0.19 0.00 -0.00 0.00 0.00 57.45 58.18 2fja n PHE 362 Cb 0.64 -1.12 0.87 0.00 -1.00 0.00 0.00 39.48 38.87 2fja n PHE 362 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2fja h LEU 363 N -0.66 0.00 -0.14 4.37 3.38 -0.33 0.13 115.31 122.06 2fja h LEU 363 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2fja h LEU 363 Cb 1.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2fja h LEU 363 CO -0.12 0.00 -0.29 0.47 0.09 0.00 0.00 178.44 178.59 2fja n ASP 364 N -2.96 0.51 0.00 -0.43 10.43 0.45 -4.71 116.55 119.84 2fja n ASP 364 Ca -0.01 -0.31 0.00 0.00 2.57 0.00 0.00 54.79 57.04 2fja n ASP 364 Cb 0.19 0.04 0.00 0.00 1.84 0.00 0.00 41.12 43.19 2fja n ASP 364 CO 0.00 0.00 0.00 1.15 -1.07 0.00 0.00 177.20 177.28 2fja n MET 365 N -1.23 0.68 -3.06 -1.24 0.00 -0.88 -1.70 117.12 109.68 2fja n MET 365 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 57.70 57.60 2fja n MET 365 Cb 0.33 -0.06 -0.03 0.00 0.00 0.00 0.00 33.22 33.46 2fja n MET 365 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 2fja n THR 366 N 0.00 -0.53 -0.06 3.17 -1.04 0.38 -4.72 114.28 111.48 2fja n THR 366 Ca 0.00 -2.96 0.15 0.00 -2.04 0.00 0.00 64.05 59.20 2fja n THR 366 Cb 0.00 -0.70 0.57 0.00 -1.82 0.00 0.00 70.33 68.38 2fja n THR 366 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2fja h VAL 367 N 2.96 0.82 -0.91 12.58 2.07 -1.80 -1.76 116.25 130.22 2fja h VAL 367 Ca 0.04 -0.09 0.22 0.00 0.82 0.00 0.00 66.70 67.69 2fja h VAL 367 Cb 0.95 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 2fja h VAL 367 CO 0.37 0.05 0.61 0.28 0.02 0.00 0.00 177.57 178.90 2fja h SER 368 N 0.26 0.33 -0.13 0.57 0.02 -1.89 0.23 113.55 112.94 2fja h SER 368 Ca 0.28 0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 61.12 2fja h SER 368 Cb 0.75 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 2fja h SER 368 CO -0.06 0.12 -0.43 -0.61 -1.14 0.00 0.00 176.83 174.71 2fja h GLN 369 N 0.32 0.67 -0.31 3.45 5.75 -1.54 0.21 115.11 123.66 2fja h GLN 369 Ca 0.47 -0.36 -0.17 0.00 -0.15 0.00 0.00 58.65 58.44 2fja h GLN 369 Cb 1.30 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.86 2fja h GLN 369 CO -0.15 0.97 -0.47 0.00 -2.65 0.00 0.00 178.83 176.52 2fja h ALA 370 N 0.98 0.57 -0.33 3.38 0.00 -1.16 -1.90 119.26 120.80 2fja h ALA 370 Ca 0.04 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2fja h ALA 370 Cb 0.96 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2fja h ALA 370 CO 0.09 0.68 -0.12 1.25 0.00 0.00 0.00 179.25 181.15 2fja h LEU 371 N 0.66 0.56 -0.28 0.00 5.85 -0.91 -1.22 115.31 119.96 2fja h LEU 371 Ca 0.03 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 2fja h LEU 371 Cb 1.06 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2fja h LEU 371 CO 0.11 0.71 0.08 0.25 -0.34 0.00 0.00 178.44 179.24 2fja h LEU 372 N 0.53 0.42 -1.02 2.25 6.46 -0.33 0.15 115.31 123.76 2fja h LEU 372 Ca 0.10 -0.22 0.00 0.00 -0.12 0.00 0.00 57.88 57.64 2fja h LEU 372 Cb 0.52 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 40.30 2fja h LEU 372 CO 0.03 0.52 0.60 -0.50 -0.62 0.00 0.00 178.44 178.48 2fja h TRP 373 N 0.29 1.22 -0.28 1.25 6.55 -1.02 -0.64 115.95 123.32 2fja h TRP 373 Ca 0.09 0.01 -0.04 0.00 0.95 0.00 0.00 58.89 59.90 2fja h TRP 373 Cb 0.26 -0.41 -0.01 0.00 -0.86 0.00 0.00 29.16 28.15 2fja h TRP 373 CO 0.01 0.79 0.03 0.00 -1.05 0.00 0.00 178.44 178.22 2fja h ALA 374 N 1.37 0.38 -0.23 1.49 0.00 -0.87 0.34 119.26 121.73 2fja h ALA 374 Ca 0.34 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2fja h ALA 374 Cb -0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2fja h ALA 374 CO -0.07 0.09 -0.21 0.00 0.00 0.00 0.00 179.25 179.06 2fja n GLN 376 N -4.16 2.53 -3.79 0.00 6.02 -0.27 -4.96 117.38 112.74 2fja n GLN 376 Ca -0.00 -2.35 -0.27 0.00 -0.01 0.00 0.00 57.00 54.36 2fja n GLN 376 Cb 0.36 -1.52 0.04 0.00 1.02 0.00 0.00 30.24 30.15 2fja n GLN 376 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2fja n ASN 377 N 1.45 -4.61 -4.52 1.08 3.02 -0.07 -4.96 115.26 106.65 2fja n ASN 377 Ca 0.22 -0.72 -0.41 0.00 -0.03 0.00 0.00 54.58 53.63 2fja n ASN 377 Cb 0.57 -4.23 -0.10 0.00 -0.61 0.00 0.00 39.78 35.42 2fja n ASN 377 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2fja s ILE 378 N -3.36 5.21 -0.37 2.41 1.01 0.10 -5.02 121.20 121.18 2fja s ILE 378 Ca 0.53 -0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.89 2fja s ILE 378 Cb -0.26 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.41 2fja s ILE 378 CO 0.80 -0.12 0.24 -0.62 0.00 0.00 0.00 174.94 175.24 2fja s ASP 379 N 1.73 5.89 0.61 3.58 3.68 -1.26 -4.64 116.67 126.27 2fja s ASP 379 Ca 0.09 -0.82 0.28 0.00 2.13 0.00 0.00 52.55 54.23 2fja s ASP 379 Cb -0.17 -2.09 1.42 0.00 -1.45 0.00 0.00 42.92 40.64 2fja s ASP 379 CO 0.11 -0.36 1.83 1.55 0.13 0.00 0.00 175.17 178.43 2fja h PRO 380 N 8.50 0.00 0.00 4.34 0.13 -1.97 0.14 132.00 143.15 2fja h PRO 380 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2fja h PRO 380 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2fja h PRO 380 CO 0.68 0.00 -0.26 0.00 -0.23 0.00 0.00 178.00 178.19 2fja n GLN 381 N -3.40 0.23 -0.08 0.86 10.64 -1.26 -1.34 117.38 123.02 2fja n GLN 381 Ca 0.06 0.13 -0.14 0.00 -1.83 0.00 0.00 57.00 55.22 2fja n GLN 381 Cb 0.66 -1.71 -0.07 0.00 -0.86 0.00 0.00 30.24 28.26 2fja n GLN 381 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2fja n GLU 382 N -2.07 0.39 -4.16 2.61 -0.58 0.39 -4.67 120.64 112.54 2fja n GLU 382 Ca 0.05 0.12 -0.17 0.00 -0.42 0.00 0.00 57.16 56.74 2fja n GLU 382 Cb 0.42 -1.24 -0.12 0.00 -0.57 0.00 0.00 31.44 29.93 2fja n GLU 382 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2fja s GLN 383 N -2.32 0.80 0.94 3.49 -2.07 -0.56 -4.88 119.66 115.05 2fja s GLN 383 Ca -0.23 -1.00 -0.12 0.00 -1.82 0.00 0.00 55.36 52.19 2fja s GLN 383 Cb 0.07 -0.69 0.15 0.00 -1.09 0.00 0.00 33.01 31.45 2fja s GLN 383 CO 0.35 0.14 1.12 -1.25 -1.32 0.00 0.00 175.29 174.33 2fja s PRO 384 N -2.03 0.94 0.07 9.60 0.04 -1.26 -4.33 135.00 138.03 2fja s PRO 384 Ca -0.01 0.41 0.10 0.00 0.04 0.00 0.00 61.00 61.54 2fja s PRO 384 Cb -0.08 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2fja s PRO 384 CO 0.02 -2.36 -0.26 -1.12 0.04 0.00 0.00 177.00 173.32 2fja s SER 385 N -3.80 3.29 0.39 6.66 0.01 -0.82 -4.94 113.70 114.49 2fja s SER 385 Ca 0.64 -0.62 -0.24 0.00 1.31 0.00 0.00 55.95 57.04 2fja s SER 385 Cb -0.16 -0.30 -0.10 0.00 0.21 0.00 0.00 66.02 65.67 2fja s SER 385 CO 0.55 0.23 0.99 -1.61 0.41 0.00 0.00 173.24 173.82 2fja s GLU 386 N -1.52 4.28 0.14 12.44 2.02 -1.26 -0.09 118.70 134.71 2fja s GLU 386 Ca 0.13 1.36 0.06 0.00 0.02 0.00 0.00 54.97 56.54 2fja s GLU 386 Cb -0.10 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2fja s GLU 386 CO 0.04 -0.01 -0.13 0.00 0.02 0.00 0.00 175.26 175.17 2fja s ALA 387 N -1.78 1.59 -0.05 5.21 0.00 0.22 -0.69 121.76 126.27 2fja s ALA 387 Ca 0.57 -1.41 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 2fja s ALA 387 Cb -0.18 -0.05 0.10 0.00 0.00 0.00 0.00 23.12 23.00 2fja s ALA 387 CO 0.23 0.05 0.88 0.00 0.00 0.00 0.00 175.76 176.91 2fja s ALA 388 N -2.56 -1.83 0.20 0.00 0.00 0.10 -4.36 121.76 113.31 2fja s ALA 388 Ca 0.13 1.19 -0.28 0.00 0.00 0.00 0.00 51.96 52.99 2fja s ALA 388 Cb -0.02 0.06 -0.08 0.00 0.00 0.00 0.00 23.12 23.07 2fja s ALA 388 CO 0.03 -0.54 0.89 -1.25 0.00 0.00 0.00 175.76 174.89 2fja s PRO 389 N -2.33 4.75 0.46 0.00 0.04 -1.26 -1.91 135.00 134.75 2fja s PRO 389 Ca 0.01 1.38 -0.04 0.00 0.04 0.00 0.00 61.00 62.39 2fja s PRO 389 Cb -0.01 -3.28 0.10 0.00 0.04 0.00 0.00 34.50 31.35 2fja s PRO 389 CO -0.04 0.51 0.63 0.00 0.04 0.00 0.00 177.00 178.14 2fja n ALA 390 N 1.65 -0.31 -1.61 8.56 0.00 -0.32 -4.97 120.51 123.50 2fja n ALA 390 Ca -0.03 -1.02 -0.30 0.00 0.00 0.00 0.00 53.44 52.10 2fja n ALA 390 Cb 0.48 0.08 0.10 0.00 0.00 0.00 0.00 19.45 20.10 2fja n ALA 390 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2fja s GLU 391 N -4.20 1.88 0.47 0.00 1.03 -1.26 -4.62 118.70 112.00 2fja s GLU 391 Ca 0.39 0.47 -0.23 0.00 0.03 0.00 0.00 54.97 55.63 2fja s GLU 391 Cb -0.02 -1.91 -0.07 0.00 -0.80 0.00 0.00 34.13 31.33 2fja s GLU 391 CO 0.26 -1.73 1.21 -2.14 -1.33 0.00 0.00 175.26 171.53 2fja s PRO 392 N -5.25 3.69 0.06 -4.83 0.02 -1.26 -4.63 135.00 122.80 2fja s PRO 392 Ca 0.61 1.88 0.05 0.00 0.02 0.00 0.00 61.00 63.56 2fja s PRO 392 Cb -0.14 -2.43 -0.03 0.00 0.02 0.00 0.00 34.50 31.93 2fja s PRO 392 CO 0.53 -0.64 -0.14 0.71 -0.33 0.00 0.00 177.00 177.14 2fja s TYR 393 N -1.48 1.20 -0.25 6.54 1.51 -0.88 -4.56 117.35 119.43 2fja s TYR 393 Ca 0.64 -0.42 -0.02 0.00 -1.01 0.00 0.00 57.07 56.26 2fja s TYR 393 Cb -0.31 -0.69 0.02 0.00 -0.11 0.00 0.00 41.96 40.87 2fja s TYR 393 CO 0.38 0.05 -0.05 0.42 -1.11 0.00 0.00 175.55 175.23 2fja s ILE 394 N -1.11 2.98 0.20 2.71 -1.09 -0.89 -1.16 121.20 122.83 2fja s ILE 394 Ca -0.01 -0.94 -0.22 0.00 -2.23 0.00 0.00 60.65 57.25 2fja s ILE 394 Cb -0.09 -2.49 0.05 0.00 -1.58 0.00 0.00 42.46 38.35 2fja s ILE 394 CO 0.02 0.23 0.66 0.00 -1.23 0.00 0.00 174.94 174.61 2fja s MET 395 N 1.35 1.45 0.00 2.79 0.23 -1.26 0.05 119.30 123.91 2fja s MET 395 Ca 0.01 -0.66 0.01 0.00 -1.03 0.00 0.00 55.69 54.02 2fja s MET 395 Cb -0.16 0.59 0.01 0.00 -1.53 0.00 0.00 34.83 33.74 2fja s MET 395 CO -0.04 -0.65 0.59 0.41 -2.03 0.00 0.00 175.02 173.30 2fja n GLY 396 N -0.41 -0.90 0.08 3.16 0.00 -0.85 -2.26 105.19 104.00 2fja n GLY 396 Ca -0.12 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 45.88 2fja n GLY 396 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fja n SER 397 N 0.01 0.45 0.00 1.61 3.41 -1.25 -3.76 113.62 114.09 2fja n SER 397 Ca 0.01 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2fja n SER 397 Cb 0.05 0.81 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 2fja n SER 397 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2fja n HIS 398 N -2.69 0.00 1.43 7.33 -0.00 -1.26 -0.34 115.22 119.69 2fja n HIS 398 Ca -0.13 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.73 2fja n HIS 398 Cb 0.83 0.00 0.55 0.00 -0.00 0.00 0.00 29.99 31.37 2fja n HIS 398 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2fja n SER 399 N 0.00 0.83 -4.86 0.26 7.64 -1.26 0.02 113.62 116.24 2fja n SER 399 Ca 0.00 -0.91 -0.30 0.00 1.01 0.00 0.00 58.87 58.67 2fja n SER 399 Cb 0.00 0.01 -0.05 0.00 -1.01 0.00 0.00 64.21 63.16 2fja n SER 399 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2fja s GLY 400 N -2.34 2.04 -0.18 0.23 0.00 -1.26 -4.90 107.32 100.91 2fja s GLY 400 Ca 0.31 -0.95 0.13 0.00 0.00 0.00 0.00 44.72 44.21 2fja s GLY 400 CO 0.45 -0.93 1.21 -1.84 0.00 0.00 0.00 173.10 171.98 2fja n GLU 401 N 0.21 1.39 -2.72 2.90 0.28 -1.19 -3.88 120.64 117.62 2fja n GLU 401 Ca -0.07 -3.10 -0.41 0.00 -0.16 0.00 0.00 57.16 53.43 2fja n GLU 401 Cb 0.52 -1.44 -0.05 0.00 1.43 0.00 0.00 31.44 31.90 2fja n GLU 401 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2fja s ALA 402 N -2.85 3.30 0.00 -1.84 0.00 -0.96 -0.95 121.76 118.46 2fja s ALA 402 Ca 0.37 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.95 2fja s ALA 402 Cb 0.36 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 20.23 2fja s ALA 402 CO -0.07 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2fja n GLY 403 N 1.82 -1.03 3.80 0.00 0.00 -1.14 -2.43 105.19 106.22 2fja n GLY 403 Ca 0.00 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 2fja n GLY 403 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fja s PHE 404 N -3.00 3.34 -0.34 1.61 0.40 0.52 -0.28 117.98 120.23 2fja s PHE 404 Ca 0.00 1.64 -0.29 0.00 -0.60 0.00 0.00 56.93 57.68 2fja s PHE 404 Cb 0.00 -2.93 0.01 0.00 0.51 0.00 0.00 43.02 40.61 2fja s PHE 404 CO 0.00 -0.20 1.26 -0.46 0.70 0.00 0.00 175.22 176.52 2fja s TRP 405 N -1.98 2.73 0.22 0.36 -0.11 -0.06 -1.16 118.94 118.94 2fja s TRP 405 Ca 0.60 0.87 0.11 0.00 1.22 0.00 0.00 56.10 58.90 2fja s TRP 405 Cb -0.13 -4.01 -0.05 0.00 -1.50 0.00 0.00 33.47 27.78 2fja s TRP 405 CO 0.18 -1.55 -0.21 0.14 -4.62 0.00 0.00 176.95 170.88 2fja s VAL 406 N 4.43 2.47 0.47 5.86 -7.23 -1.26 -4.13 120.40 121.01 2fja s VAL 406 Ca 0.54 -2.14 -0.21 0.00 -1.81 0.00 0.00 61.98 58.36 2fja s VAL 406 Cb -0.14 -2.23 -0.09 0.00 0.56 0.00 0.00 36.38 34.48 2fja s VAL 406 CO 0.24 -0.22 1.03 0.00 -0.31 0.00 0.00 175.10 175.84 2fja n GLY 408 N -0.23 2.64 3.77 0.00 0.00 -1.26 -0.02 105.19 110.10 2fja n GLY 408 Ca 0.09 -2.19 -0.37 0.00 0.00 0.00 0.00 46.02 43.54 2fja n GLY 408 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fja s PRO 409 N -2.66 4.05 0.55 1.61 0.04 -1.26 -4.18 135.00 133.15 2fja s PRO 409 Ca 0.11 1.70 0.23 0.00 0.04 0.00 0.00 61.00 63.08 2fja s PRO 409 Cb -0.01 -2.58 1.46 0.00 0.04 0.00 0.00 34.50 33.41 2fja s PRO 409 CO 0.07 -0.29 2.11 1.05 0.04 0.00 0.00 177.00 179.98 2fja h GLU 410 N 2.49 0.00 -0.00 4.56 -0.00 -1.93 0.55 114.58 120.24 2fja h GLU 410 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.87 2fja h GLU 410 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.98 2fja h GLU 410 CO 0.62 0.00 -0.23 -0.40 -0.00 0.00 0.00 179.01 179.00 2fja n ASP 411 N -4.23 0.40 0.00 3.06 5.75 -1.26 -4.38 116.55 115.89 2fja n ASP 411 Ca 0.02 -0.21 0.00 0.00 -0.01 0.00 0.00 54.79 54.59 2fja n ASP 411 Cb 0.29 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.32 2fja n ASP 411 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2fja n LEU 412 N -1.26 0.96 -4.69 -2.12 4.77 -0.64 -5.04 117.00 108.97 2fja n LEU 412 Ca 0.09 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 2fja n LEU 412 Cb 0.32 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 2fja n LEU 412 CO 0.29 0.16 1.29 -0.32 -1.33 0.00 0.00 177.39 177.48 2fja s MET 413 N -1.82 4.21 0.57 3.23 1.75 0.09 -4.75 119.30 122.58 2fja s MET 413 Ca 0.00 2.28 -0.15 0.00 -1.25 0.00 0.00 55.69 56.57 2fja s MET 413 Cb 0.00 -3.57 -0.05 0.00 2.84 0.00 0.00 34.83 34.05 2fja s MET 413 CO 0.00 -0.70 1.02 -2.14 -0.65 0.00 0.00 175.02 172.54 2fja s PRO 414 N 2.52 3.64 0.36 4.11 0.02 -1.26 -4.93 135.00 139.46 2fja s PRO 414 Ca 0.72 0.99 0.09 0.00 0.02 0.00 0.00 61.00 62.83 2fja s PRO 414 Cb -0.39 -2.09 0.84 0.00 0.02 0.00 0.00 34.50 32.88 2fja s PRO 414 CO 0.31 -0.53 1.87 1.49 -0.33 0.00 0.00 177.00 179.82 2fja h GLU 415 N 0.47 0.65 -0.75 5.54 4.57 -2.00 -0.99 114.58 122.06 2fja h GLU 415 Ca -0.46 -0.04 0.21 0.00 -1.18 0.00 0.00 59.36 57.89 2fja h GLU 415 Cb 1.20 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.61 2fja h GLU 415 CO 0.60 0.43 0.54 0.93 -1.18 0.00 0.00 179.01 180.33 2fja h GLU 416 N 0.67 0.05 -0.03 1.92 3.07 -1.99 -1.77 114.58 116.50 2fja h GLU 416 Ca 0.44 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2fja h GLU 416 Cb 0.72 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 2fja h GLU 416 CO -0.20 0.03 -0.08 0.66 -1.40 0.00 0.00 179.01 178.03 2fja n TYR 417 N -4.34 0.00 0.96 4.33 0.53 -0.38 -4.41 117.16 113.85 2fja n TYR 417 Ca 0.15 0.00 0.10 0.00 -1.02 0.00 0.00 57.90 57.13 2fja n TYR 417 Cb 0.79 -0.00 -0.10 0.00 -1.03 0.00 0.00 39.34 39.00 2fja n TYR 417 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2fja n ALA 418 N 1.12 4.62 -0.22 -0.72 0.00 -0.67 -4.62 120.51 120.03 2fja n ALA 418 Ca 0.13 -0.58 0.16 0.00 0.00 0.00 0.00 53.44 53.15 2fja n ALA 418 Cb 0.58 -0.79 0.47 0.00 0.00 0.00 0.00 19.45 19.71 2fja n ALA 418 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2fja h LYS 419 N 0.00 0.47 -0.04 0.00 1.57 -1.77 -2.59 116.57 114.22 2fja h LYS 419 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2fja h LYS 419 Cb 0.52 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2fja h LYS 419 CO 0.00 0.31 0.00 1.28 -0.57 0.00 0.00 179.45 180.47 2fja n LEU 420 N -4.51 1.44 -4.48 2.94 4.77 -1.26 -4.84 117.00 111.05 2fja n LEU 420 Ca 0.17 -0.50 -0.39 0.00 -0.03 0.00 0.00 56.01 55.26 2fja n LEU 420 Cb 0.57 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.53 2fja n LEU 420 CO 0.31 0.25 -0.18 -0.36 -1.33 0.00 0.00 177.39 176.08 2fja s PHE 421 N -1.97 3.19 0.30 -1.77 0.40 -0.98 -4.73 117.98 112.42 2fja s PHE 421 Ca 0.38 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 56.31 2fja s PHE 421 Cb 0.20 -2.38 0.45 0.00 0.51 0.00 0.00 43.02 41.80 2fja s PHE 421 CO 0.33 -0.39 1.92 -1.35 0.70 0.00 0.00 175.22 176.43 2fja h PRO 422 N 8.38 0.97 -4.81 0.24 0.11 -1.88 -3.41 132.00 131.60 2fja h PRO 422 Ca -0.33 -0.11 -0.55 0.00 0.11 0.00 0.00 66.00 65.13 2fja h PRO 422 Cb 1.16 -0.19 -0.33 0.00 0.11 0.00 0.00 31.00 31.74 2fja h PRO 422 CO 0.61 0.71 -0.83 -0.51 -0.21 0.00 0.00 178.00 177.77 2fja s LEU 423 N -9.69 1.77 -1.01 2.35 1.43 -1.26 -5.09 118.68 107.18 2fja s LEU 423 Ca -0.11 -0.36 -0.17 0.00 -1.03 0.00 0.00 54.13 52.47 2fja s LEU 423 Cb 0.17 -0.96 0.15 0.00 0.03 0.00 0.00 46.19 45.58 2fja s LEU 423 CO 0.79 0.08 1.21 -0.54 0.23 0.00 0.00 176.35 178.12 2fja s LYS 424 N 0.50 3.75 -0.03 1.70 -0.14 -1.26 -4.96 119.74 119.30 2fja s LYS 424 Ca -0.14 -2.04 0.04 0.00 -1.36 0.00 0.00 55.97 52.47 2fja s LYS 424 Cb -0.15 -4.95 -0.00 0.00 -1.68 0.00 0.00 37.83 31.04 2fja s LYS 424 CO 0.05 -1.76 -0.14 0.71 -0.76 0.00 0.00 175.35 173.45 2fja s TYR 425 N 2.26 1.42 -0.13 3.18 1.51 -1.26 -4.98 117.35 119.35 2fja s TYR 425 Ca 0.35 -0.37 -0.36 0.00 -1.01 0.00 0.00 57.07 55.69 2fja s TYR 425 Cb -0.04 -0.96 -0.13 0.00 -0.11 0.00 0.00 41.96 40.72 2fja s TYR 425 CO -0.07 -0.11 1.84 -1.71 -1.11 0.00 0.00 175.55 174.39 2fja n ASN 426 N 3.09 3.19 -0.12 2.29 4.05 -1.26 -1.36 115.26 125.14 2fja n ASN 426 Ca -0.17 1.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.84 2fja n ASN 426 Cb 0.54 -1.32 -0.01 0.00 1.23 0.00 0.00 39.78 40.22 2fja n ASN 426 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2fja n ARG 427 N 6.26 -0.55 -2.97 1.20 3.00 0.98 -4.42 116.66 120.15 2fja n ARG 427 Ca 0.23 0.30 -0.36 0.00 -0.01 0.00 0.00 57.85 58.01 2fja n ARG 427 Cb 0.26 -3.82 -0.06 0.00 0.00 0.00 0.00 32.46 28.83 2fja n ARG 427 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 2fja s MET 428 N -1.09 4.36 0.17 5.56 1.75 -0.46 -1.84 119.30 127.74 2fja s MET 428 Ca 0.00 1.04 -0.02 0.00 -1.25 0.00 0.00 55.69 55.45 2fja s MET 428 Cb 0.00 -2.79 0.04 0.00 2.84 0.00 0.00 34.83 34.92 2fja s MET 428 CO 0.00 0.32 0.23 0.25 -0.65 0.00 0.00 175.02 175.16 2fja n THR 429 N 0.54 0.00 1.00 10.11 -2.24 0.58 -1.09 114.28 123.18 2fja n THR 429 Ca 0.00 -0.20 0.11 0.00 -2.27 0.00 0.00 64.05 61.70 2fja n THR 429 Cb 0.51 -1.79 0.55 0.00 -2.10 0.00 0.00 70.33 67.50 2fja n THR 429 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2fja n THR 430 N -2.19 0.32 -3.55 4.28 -2.24 -1.26 -4.58 114.28 105.06 2fja n THR 430 Ca 0.03 0.08 -0.37 0.00 -2.27 0.00 0.00 64.05 61.52 2fja n THR 430 Cb 0.10 -0.69 -0.09 0.00 -2.10 0.00 0.00 70.33 67.56 2fja n THR 430 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fja s VAL 431 N -2.72 5.30 0.12 2.28 1.01 -1.26 -4.59 120.40 120.53 2fja s VAL 431 Ca 0.18 0.40 -0.31 0.00 0.00 0.00 0.00 61.98 62.26 2fja s VAL 431 Cb 0.15 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.84 2fja s VAL 431 CO 0.38 0.31 1.70 -0.54 0.00 0.00 0.00 175.10 176.95 2fja s LYS 432 N 1.10 4.17 0.00 2.72 1.02 -0.32 -2.17 119.74 126.27 2fja s LYS 432 Ca 0.12 2.45 0.00 0.00 0.02 0.00 0.00 55.97 58.56 2fja s LYS 432 Cb -0.14 -3.46 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 2fja s LYS 432 CO 0.05 -0.75 0.00 0.41 -0.92 0.00 0.00 175.35 174.15 2fja n GLY 433 N 4.02 1.79 3.55 -3.33 0.00 -1.26 -1.53 105.19 108.42 2fja n GLY 433 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2fja n GLY 433 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fja s LEU 434 N 0.00 3.98 0.27 0.99 2.96 -0.92 -0.78 118.68 125.17 2fja s LEU 434 Ca 0.00 -0.13 0.08 0.00 -0.22 0.00 0.00 54.13 53.87 2fja s LEU 434 Cb 0.00 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2fja s LEU 434 CO 0.00 -0.08 0.11 -0.36 -1.32 0.00 0.00 176.35 174.70 2fja s PHE 435 N 1.72 2.88 -0.02 5.38 0.40 0.14 -0.30 117.98 128.18 2fja s PHE 435 Ca 0.07 -0.19 0.01 0.00 -0.60 0.00 0.00 56.93 56.21 2fja s PHE 435 Cb -0.16 -1.34 0.02 0.00 0.51 0.00 0.00 43.02 42.05 2fja s PHE 435 CO 0.09 0.54 -0.01 0.00 0.70 0.00 0.00 175.22 176.54 2fja s ALA 436 N -2.25 0.32 0.16 5.36 0.00 -0.77 -0.49 121.76 124.09 2fja s ALA 436 Ca 0.33 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.38 2fja s ALA 436 Cb -0.07 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 2fja s ALA 436 CO 0.23 -0.03 0.04 0.96 0.00 0.00 0.00 175.76 176.95 2fja s ILE 437 N 0.75 0.36 0.00 0.00 -4.36 -0.36 -4.37 121.20 113.22 2fja s ILE 437 Ca -0.08 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2fja s ILE 437 Cb -0.11 -2.12 0.00 0.00 1.25 0.00 0.00 42.46 41.48 2fja s ILE 437 CO -0.01 -0.43 0.00 0.61 0.24 0.00 0.00 174.94 175.34 2fja n GLY 438 N -0.18 3.32 0.25 6.27 0.00 -1.26 -1.57 105.19 112.03 2fja n GLY 438 Ca -0.05 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 45.90 2fja n GLY 438 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2fja h ASP 439 N 0.35 0.00 1.02 1.61 3.45 -1.88 -2.55 116.42 118.42 2fja h ASP 439 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2fja h ASP 439 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2fja h ASP 439 CO 0.00 0.08 0.00 0.00 -1.57 0.00 0.00 179.24 177.75 2fja s ALA 441 N -3.48 3.58 0.58 0.00 0.00 -0.96 -0.35 121.76 121.13 2fja s ALA 441 Ca 0.03 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.16 2fja s ALA 441 Cb 0.09 -2.45 0.06 0.00 0.00 0.00 0.00 23.12 20.82 2fja s ALA 441 CO 0.50 -0.33 0.80 0.20 0.00 0.00 0.00 175.76 176.94 2fja s GLY 442 N 1.25 1.82 0.00 0.00 0.00 -0.31 -4.51 107.32 105.57 2fja s GLY 442 Ca 0.10 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.25 2fja s GLY 442 CO 0.07 -1.21 0.00 0.00 0.00 0.00 0.00 173.10 171.96 2fja n ALA 443 N -2.39 0.00 -3.13 3.20 0.00 -0.12 -4.71 120.51 113.36 2fja n ALA 443 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.37 2fja n ALA 443 Cb 0.60 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 19.17 2fja n ALA 443 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2fja n ASN 444 N -0.40 -1.58 -2.27 0.00 2.04 -1.26 0.00 115.26 111.78 2fja n ASN 444 Ca 0.00 -2.62 -0.03 0.00 -0.44 0.00 0.00 54.58 51.48 2fja n ASN 444 Cb 0.20 0.35 0.02 0.00 -2.53 0.00 0.00 39.78 37.82 2fja n ASN 444 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 2fja n PRO 445 N 2.72 0.09 -2.44 -0.53 -0.04 -1.25 -4.61 135.00 128.95 2fja n PRO 445 Ca 0.24 -0.29 -0.18 0.00 -0.04 0.00 0.00 63.50 63.23 2fja n PRO 445 Cb 0.52 -0.14 -0.00 0.00 -0.04 0.00 0.00 33.50 33.84 2fja n PRO 445 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2fja n HIS 446 N -1.99 -0.98 -0.01 0.54 8.25 0.10 -4.90 115.22 116.23 2fja n HIS 446 Ca 0.02 0.08 -0.21 0.00 -0.26 0.00 0.00 57.72 57.35 2fja n HIS 446 Cb 0.07 -3.57 -0.13 0.00 1.12 0.00 0.00 29.99 27.48 2fja n HIS 446 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2fja h LYS 447 N -0.22 0.20 0.00 -0.41 1.57 -0.90 -3.45 116.57 113.36 2fja h LYS 447 Ca -0.42 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.02 2fja h LYS 447 Cb 1.31 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.74 2fja h LYS 447 CO 0.49 1.16 0.00 1.19 -0.57 0.00 0.00 179.45 181.72 2fja n PHE 448 N -4.01 -0.13 0.49 -1.35 3.01 0.25 0.41 117.46 116.13 2fja n PHE 448 Ca -0.25 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.02 2fja n PHE 448 Cb 0.86 0.09 -0.09 0.00 -0.01 0.00 0.00 39.48 40.33 2fja n PHE 448 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2fja h SER 449 N 5.81 -1.04 -0.64 4.37 4.64 -1.93 -0.58 113.55 124.18 2fja h SER 449 Ca 0.00 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2fja h SER 449 Cb 0.00 0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 2fja h SER 449 CO 0.00 -0.74 0.42 0.77 -0.87 0.00 0.00 176.83 176.41 2fja h SER 450 N -1.25 0.72 -0.04 4.97 4.64 -1.87 -2.10 113.55 118.63 2fja h SER 450 Ca -0.13 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.07 2fja h SER 450 Cb 0.95 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.85 2fja h SER 450 CO 0.21 0.52 -0.29 1.23 -0.87 0.00 0.00 176.83 177.63 2fja h GLY 451 N 0.85 0.53 1.03 -0.77 0.00 -0.07 -1.22 103.07 103.42 2fja h GLY 451 Ca 0.24 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 46.96 2fja h GLY 451 CO -0.06 0.41 -0.45 1.76 0.00 0.00 0.00 176.54 178.21 2fja h SER 452 N 0.42 0.83 -0.46 0.19 0.02 -0.89 0.11 113.55 113.76 2fja h SER 452 Ca 0.06 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 2fja h SER 452 Cb 0.72 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2fja h SER 452 CO 0.06 1.20 0.24 0.15 -1.14 0.00 0.00 176.83 177.33 2fja h PHE 453 N 0.48 0.65 -0.35 3.45 3.57 -1.32 -1.93 116.94 121.50 2fja h PHE 453 Ca 0.02 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2fja h PHE 453 Cb 1.05 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2fja h PHE 453 CO 0.08 0.51 0.20 1.15 -2.23 0.00 0.00 178.31 178.01 2fja h THR 454 N 0.60 1.13 -0.15 4.41 2.02 -1.08 -1.83 112.91 118.01 2fja h THR 454 Ca 0.16 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 2fja h THR 454 Cb 0.09 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 2fja h THR 454 CO -0.02 0.13 0.07 -0.08 0.37 0.00 0.00 175.52 175.99 2fja h GLU 455 N 0.44 0.21 -0.52 6.66 4.81 -0.58 -0.81 114.58 124.79 2fja h GLU 455 Ca 0.12 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 2fja h GLU 455 Cb 0.04 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2fja h GLU 455 CO -0.02 0.17 0.01 0.78 -0.73 0.00 0.00 179.01 179.22 2fja h GLY 456 N 0.29 0.98 0.96 1.92 0.00 -0.56 -1.69 103.07 104.97 2fja h GLY 456 Ca 0.06 -0.71 -0.00 0.00 0.00 0.00 0.00 47.33 46.67 2fja h GLY 456 CO -0.01 0.66 0.07 3.21 0.00 0.00 0.00 176.54 180.47 2fja h ARG 457 N 0.78 0.15 -0.30 4.80 3.08 -0.49 -0.79 114.38 121.61 2fja h ARG 457 Ca 0.15 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.25 2fja h ARG 457 Cb 0.51 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.47 2fja h ARG 457 CO 0.02 0.14 -0.09 0.82 -1.07 0.00 0.00 179.97 179.79 2fja h ILE 458 N 0.11 0.66 -0.17 2.04 2.04 -1.06 -1.45 117.51 119.68 2fja h ILE 458 Ca 0.04 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.81 2fja h ILE 458 Cb 0.03 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2fja h ILE 458 CO -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 178.15 177.87 2fja h ALA 459 N 1.26 1.22 -0.33 1.87 0.00 -1.16 -2.32 119.26 119.80 2fja h ALA 459 Ca 0.15 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2fja h ALA 459 Cb 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2fja h ALA 459 CO -0.32 0.51 0.15 0.00 0.00 0.00 0.00 179.25 179.58 2fja h ALA 460 N 1.43 0.43 -0.56 0.00 0.00 -0.36 0.21 119.26 120.41 2fja h ALA 460 Ca 0.04 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2fja h ALA 460 Cb 0.63 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2fja h ALA 460 CO 0.05 0.01 -0.09 -0.22 0.00 0.00 0.00 179.25 179.00 2fja h LYS 461 N 0.39 1.04 -0.37 0.00 3.64 -1.18 -2.12 116.57 117.97 2fja h LYS 461 Ca 0.11 -0.37 -0.05 0.00 -1.27 0.00 0.00 60.65 59.07 2fja h LYS 461 Cb 0.15 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2fja h LYS 461 CO -0.01 1.07 0.02 0.00 -2.27 0.00 0.00 179.45 178.25 2fja h ALA 462 N 0.96 1.34 -0.52 5.00 0.00 -1.11 -0.90 119.26 124.03 2fja h ALA 462 Ca 0.15 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 2fja h ALA 462 Cb 0.66 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2fja h ALA 462 CO 0.05 0.46 -0.14 0.00 0.00 0.00 0.00 179.25 179.61 2fja h ALA 463 N 1.47 0.77 -0.38 0.00 0.00 -0.22 0.23 119.26 121.13 2fja h ALA 463 Ca 0.12 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 2fja h ALA 463 Cb 0.33 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2fja h ALA 463 CO 0.01 0.67 -0.13 0.28 0.00 0.00 0.00 179.25 180.08 2fja h VAL 464 N 0.88 1.28 -0.66 0.00 2.07 -0.99 -1.06 116.25 117.76 2fja h VAL 464 Ca 0.13 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2fja h VAL 464 Cb 0.70 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2fja h VAL 464 CO 0.05 0.41 0.31 -0.09 0.02 0.00 0.00 177.57 178.27 2fja h ARG 465 N 0.56 0.97 -0.36 1.57 2.43 -0.94 -0.92 114.38 117.69 2fja h ARG 465 Ca 0.09 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2fja h ARG 465 Cb 0.66 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 2fja h ARG 465 CO 0.04 0.78 0.23 0.35 -1.51 0.00 0.00 179.97 179.86 2fja h PHE 466 N 0.92 0.46 -0.26 2.20 3.57 -0.37 0.54 116.94 124.01 2fja h PHE 466 Ca 0.23 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 2fja h PHE 466 Cb 0.14 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2fja h PHE 466 CO 0.01 0.32 0.11 0.82 -2.23 0.00 0.00 178.31 177.33 2fja h ILE 467 N 0.47 1.17 -0.02 1.41 2.04 -0.85 0.66 117.51 122.39 2fja h ILE 467 Ca 0.13 -0.51 -0.13 0.00 1.00 0.00 0.00 64.86 65.36 2fja h ILE 467 Cb -0.02 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2fja h ILE 467 CO -0.03 0.17 -0.57 -0.07 0.00 0.00 0.00 178.15 177.65 2fja h LEU 468 N 0.27 0.08 0.02 1.44 3.38 -1.06 0.29 115.31 119.73 2fja h LEU 468 Ca 0.09 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2fja h LEU 468 Cb 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2fja h LEU 468 CO -0.01 0.64 -0.59 -0.33 0.09 0.00 0.00 178.44 178.24 2fja h GLU 469 N 0.06 0.03 0.00 1.13 5.08 -0.78 -3.38 114.58 116.72 2fja h GLU 469 Ca -0.00 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2fja h GLU 469 Cb 1.03 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2fja h GLU 469 CO 0.08 1.03 -0.70 1.96 -1.00 0.00 0.00 179.01 180.38 2fja h GLN 470 N -0.92 0.00 -6.42 2.33 1.08 -0.98 -3.49 115.11 106.71 2fja h GLN 470 Ca -0.15 0.00 -0.45 0.00 -1.45 0.00 0.00 58.65 56.60 2fja h GLN 470 Cb 1.19 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 28.67 2fja h GLN 470 CO -0.06 0.14 -0.92 1.63 -0.95 0.00 0.00 178.83 178.67 2fja n LYS 471 N -2.93 -1.01 -2.03 1.46 5.02 0.09 -4.94 118.16 113.82 2fja n LYS 471 Ca -0.00 0.48 -0.32 0.00 -2.02 0.00 0.00 58.31 56.45 2fja n LYS 471 Cb 0.63 -3.55 0.00 0.00 -0.02 0.00 0.00 35.03 32.09 2fja n LYS 471 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2fja s PRO 472 N -5.99 3.54 -0.39 1.97 0.04 -1.26 -5.02 135.00 127.89 2fja s PRO 472 Ca 0.38 0.94 0.10 0.00 0.04 0.00 0.00 61.00 62.46 2fja s PRO 472 Cb -0.16 -2.07 0.33 0.00 0.04 0.00 0.00 34.50 32.63 2fja s PRO 472 CO 0.89 -0.61 0.77 0.09 0.04 0.00 0.00 177.00 178.18 2fja n ASN 473 N -2.29 0.04 -4.65 6.66 3.02 -1.26 -4.95 115.26 111.83 2fja n ASN 473 Ca 0.07 -3.09 -0.41 0.00 -0.03 0.00 0.00 54.58 51.11 2fja n ASN 473 Cb 0.54 -0.09 0.01 0.00 -0.61 0.00 0.00 39.78 39.63 2fja n ASN 473 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2fja n PRO 474 N 0.51 1.62 -5.10 3.52 -0.02 -1.26 -5.02 135.00 129.25 2fja n PRO 474 Ca 0.21 0.58 -0.32 0.00 -2.02 0.00 0.00 63.50 61.94 2fja n PRO 474 Cb 0.65 -2.19 -0.17 0.00 -0.02 0.00 0.00 33.50 31.77 2fja n PRO 474 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2fja s GLU 475 N -2.09 3.10 0.29 -0.52 2.12 -1.26 -4.95 118.70 115.40 2fja s GLU 475 Ca 0.62 -0.85 -0.21 0.00 0.36 0.00 0.00 54.97 54.90 2fja s GLU 475 Cb -0.54 -2.37 -0.09 0.00 0.26 0.00 0.00 34.13 31.39 2fja s GLU 475 CO 0.57 0.17 0.81 0.96 -0.54 0.00 0.00 175.26 177.24 2fja s ILE 476 N 0.38 4.46 -0.47 -3.70 -4.36 -1.26 -0.49 121.20 115.77 2fja s ILE 476 Ca -0.17 1.41 -0.25 0.00 -0.26 0.00 0.00 60.65 61.38 2fja s ILE 476 Cb -0.17 -3.84 0.03 0.00 1.25 0.00 0.00 42.46 39.73 2fja s ILE 476 CO 0.08 0.07 0.91 -0.62 0.24 0.00 0.00 174.94 175.62 2fja s ASP 477 N -1.79 6.48 0.46 4.36 -1.08 -1.26 -4.83 116.67 119.01 2fja s ASP 477 Ca 0.49 0.06 0.12 0.00 -0.52 0.00 0.00 52.55 52.70 2fja s ASP 477 Cb -0.15 -2.44 1.06 0.00 -1.46 0.00 0.00 42.92 39.92 2fja s ASP 477 CO 0.20 -1.05 2.09 0.44 0.52 0.00 0.00 175.17 177.38 2fja h ASP 478 N 9.09 0.21 -0.52 -0.34 3.32 -1.99 -0.79 116.42 125.41 2fja h ASP 478 Ca -0.24 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.69 2fja h ASP 478 Cb 1.08 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 2fja h ASP 478 CO 1.02 0.17 -0.11 0.00 -1.72 0.00 0.00 179.24 178.61 2fja h ALA 479 N 1.86 0.78 -0.35 3.45 0.00 -2.00 -1.92 119.26 121.08 2fja h ALA 479 Ca 0.07 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 2fja h ALA 479 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2fja h ALA 479 CO -0.01 0.67 -0.23 0.28 0.00 0.00 0.00 179.25 179.95 2fja h VAL 480 N 0.90 1.29 -0.60 0.00 2.07 -1.76 -2.67 116.25 115.47 2fja h VAL 480 Ca 0.14 -1.38 0.07 0.00 0.82 0.00 0.00 66.70 66.35 2fja h VAL 480 Cb 0.68 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 2fja h VAL 480 CO 0.05 0.45 0.29 0.58 0.02 0.00 0.00 177.57 178.97 2fja h VAL 481 N 0.56 0.90 -0.37 2.57 2.07 -0.95 -0.13 116.25 120.89 2fja h VAL 481 Ca 0.07 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 2fja h VAL 481 Cb 0.79 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2fja h VAL 481 CO 0.06 0.10 -0.18 -0.08 0.02 0.00 0.00 177.57 177.49 2fja h GLU 482 N 0.54 0.70 -0.27 1.57 4.57 -1.31 -0.51 114.58 119.88 2fja h GLU 482 Ca 0.28 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2fja h GLU 482 Cb 0.24 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 2fja h GLU 482 CO -0.21 0.84 0.14 0.93 -1.18 0.00 0.00 179.01 179.53 2fja h GLU 483 N 0.63 0.37 -0.26 1.92 5.08 -1.01 -1.55 114.58 119.76 2fja h GLU 483 Ca 0.10 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 2fja h GLU 483 Cb 0.65 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2fja h GLU 483 CO 0.05 0.33 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.23 2fja h LEU 484 N 0.31 0.40 -0.67 1.33 3.38 -0.79 -0.71 115.31 118.57 2fja h LEU 484 Ca 0.09 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 2fja h LEU 484 Cb 0.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2fja h LEU 484 CO -0.01 0.53 -0.15 0.50 0.09 0.00 0.00 178.44 179.39 2fja h LYS 485 N 0.40 0.88 -0.29 1.13 3.64 -0.71 0.35 116.57 121.97 2fja h LYS 485 Ca 0.08 -0.33 -0.06 0.00 -1.27 0.00 0.00 60.65 59.07 2fja h LYS 485 Cb 0.40 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2fja h LYS 485 CO 0.02 0.97 -0.06 0.87 -2.27 0.00 0.00 179.45 178.98 2fja h LYS 486 N 0.78 0.55 -0.70 1.90 1.57 -0.80 -2.83 116.57 117.04 2fja h LYS 486 Ca 0.12 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2fja h LYS 486 Cb 0.68 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 2fja h LYS 486 CO 0.05 0.75 0.31 0.87 -0.57 0.00 0.00 179.45 180.86 2fja h LYS 487 N 0.32 1.02 -0.46 3.15 1.57 -0.88 -0.75 116.57 120.54 2fja h LYS 487 Ca 0.07 -0.15 0.09 0.00 -1.87 0.00 0.00 60.65 58.79 2fja h LYS 487 Cb 0.54 -0.18 -0.09 0.00 0.08 0.00 0.00 32.23 32.58 2fja h LYS 487 CO 0.03 0.80 -0.11 0.00 -0.57 0.00 0.00 179.45 179.61 2fja h ALA 488 N 1.34 0.31 -0.35 3.86 0.00 -0.05 -2.61 119.26 121.76 2fja h ALA 488 Ca 0.24 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2fja h ALA 488 Cb 0.14 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2fja h ALA 488 CO -0.03 -0.44 0.00 0.66 0.00 0.00 0.00 179.25 179.44 2fja n TYR 489 N -5.33 0.45 -0.33 0.00 4.02 -1.15 -4.52 117.16 110.30 2fja n TYR 489 Ca 0.04 -0.25 0.12 0.00 -0.01 0.00 0.00 57.90 57.79 2fja n TYR 489 Cb 0.24 -0.00 0.30 0.00 -0.02 0.00 0.00 39.34 39.86 2fja n TYR 489 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fja h ALA 490 N 4.07 1.55 -1.00 -0.72 0.00 -0.72 -0.51 119.26 121.93 2fja h ALA 490 Ca 0.00 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.10 2fja h ALA 490 Cb 0.92 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.60 2fja h ALA 490 CO 0.00 -0.11 0.64 -1.35 0.00 0.00 0.00 179.25 178.43 2fja h PRO 491 N 0.68 1.03 -0.39 0.00 0.11 -1.76 0.20 132.00 131.86 2fja h PRO 491 Ca 0.55 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 66.45 2fja h PRO 491 Cb 0.88 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 2fja h PRO 491 CO -0.40 0.68 -0.35 0.52 -0.21 0.00 0.00 178.00 178.24 2fja h MET 492 N 1.06 0.92 -0.16 1.05 2.86 -1.24 -2.12 114.93 117.30 2fja h MET 492 Ca 0.47 -0.46 -0.11 0.00 -2.06 0.00 0.00 59.70 57.54 2fja h MET 492 Cb 0.36 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 2fja h MET 492 CO -0.22 1.12 -0.37 0.93 1.06 0.00 0.00 176.91 179.42 2fja h GLU 493 N 0.76 0.34 -0.43 1.72 5.08 -0.80 -2.44 114.58 118.80 2fja h GLU 493 Ca 0.07 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 2fja h GLU 493 Cb 0.94 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2fja h GLU 493 CO 0.09 0.66 -0.25 -0.09 -1.00 0.00 0.00 179.01 178.42 2fja h ARG 494 N 0.29 0.91 -0.17 2.33 2.43 -0.51 -1.26 114.38 118.39 2fja h ARG 494 Ca 0.03 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2fja h ARG 494 Cb 0.79 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 2fja h ARG 494 CO 0.06 1.05 0.11 0.35 -1.51 0.00 0.00 179.97 180.03 2fja h PHE 495 N 0.78 0.21 -0.51 2.20 3.57 -1.17 -0.92 116.94 121.11 2fja h PHE 495 Ca 0.10 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 2fja h PHE 495 Cb 0.81 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2fja h PHE 495 CO 0.05 0.14 0.15 0.52 -2.23 0.00 0.00 178.31 176.94 2fja h MET 496 N 0.23 0.75 0.00 1.11 2.86 -1.33 -0.63 114.93 117.93 2fja h MET 496 Ca 0.06 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 2fja h MET 496 Cb -0.02 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 2fja h MET 496 CO -0.01 0.66 -0.22 0.37 1.06 0.00 0.00 176.91 178.77 2fja h GLN 497 N 0.74 0.00 0.00 1.72 4.15 -0.71 -3.38 115.11 117.63 2fja h GLN 497 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 2fja h GLN 497 Cb 0.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.91 2fja h GLN 497 CO -0.01 0.22 0.00 0.66 -1.93 0.00 0.00 178.83 177.77 2fja n TYR 498 N -3.24 0.00 0.32 3.99 4.02 -0.40 -4.76 117.16 117.09 2fja n TYR 498 Ca 0.02 0.00 0.19 0.00 -0.01 0.00 0.00 57.90 58.10 2fja n TYR 498 Cb 0.52 0.00 1.07 0.00 -0.02 0.00 0.00 39.34 40.91 2fja n TYR 498 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 2fja h LYS 499 N 0.00 0.00 0.00 -0.72 2.10 -1.29 -1.80 116.57 114.86 2fja h LYS 499 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2fja h LYS 499 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2fja h LYS 499 CO 0.00 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 177.21 2fja n ASP 500 N -3.40 0.00 0.23 7.07 10.43 -1.26 -2.93 116.55 126.69 2fja n ASP 500 Ca -0.03 0.37 0.15 0.00 2.57 0.00 0.00 54.79 57.85 2fja n ASP 500 Cb 0.09 -0.45 0.50 0.00 1.84 0.00 0.00 41.12 43.10 2fja n ASP 500 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2fja h LEU 501 N 0.00 0.00 -7.83 0.64 3.38 -1.69 -3.45 115.31 106.37 2fja h LEU 501 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2fja h LEU 501 Cb 0.33 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 40.86 2fja h LEU 501 CO 0.00 0.00 -0.62 -0.55 0.09 0.00 0.00 178.44 177.36 2fja s SER 502 N -5.54 0.10 0.00 -0.43 0.15 -1.15 -4.99 113.70 101.84 2fja s SER 502 Ca 0.04 -0.25 0.27 0.00 0.70 0.00 0.00 55.95 56.70 2fja s SER 502 Cb 0.08 0.14 1.33 0.00 -1.71 0.00 0.00 66.02 65.87 2fja s SER 502 CO 0.56 -0.26 1.90 0.35 1.20 0.00 0.00 173.24 177.00 2fja n THR 503 N 1.90 0.14 -4.44 6.45 -2.24 -1.26 -4.61 114.28 110.22 2fja n THR 503 Ca -0.21 0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.28 2fja n THR 503 Cb 0.56 -0.60 -0.16 0.00 -2.10 0.00 0.00 70.33 68.04 2fja n THR 503 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fja s ALA 504 N -2.59 2.33 0.35 6.98 0.00 -1.26 -5.02 121.76 122.55 2fja s ALA 504 Ca 0.25 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 51.12 2fja s ALA 504 Cb 0.18 -1.11 0.69 0.00 0.00 0.00 0.00 23.12 22.87 2fja s ALA 504 CO 0.41 -0.15 1.97 -0.44 0.00 0.00 0.00 175.76 177.54 2fja h ASP 505 N 7.55 0.71 -0.41 0.00 3.32 -1.90 -2.82 116.42 122.88 2fja h ASP 505 Ca -0.37 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2fja h ASP 505 Cb 1.17 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2fja h ASP 505 CO 0.59 0.47 0.00 -0.90 -1.72 0.00 0.00 179.24 177.68 2fja n ASP 506 N -4.47 2.44 -3.68 6.45 5.68 -1.26 -4.53 116.55 117.19 2fja n ASP 506 Ca 0.10 -1.94 -0.29 0.00 -0.50 0.00 0.00 54.79 52.16 2fja n ASP 506 Cb 0.18 -0.27 -0.12 0.00 -1.14 0.00 0.00 41.12 39.77 2fja n ASP 506 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2fja s VAL 507 N -1.46 1.51 -0.01 2.12 1.01 -1.06 -4.96 120.40 117.55 2fja s VAL 507 Ca 0.32 -2.97 0.04 0.00 0.00 0.00 0.00 61.98 59.37 2fja s VAL 507 Cb 0.17 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2fja s VAL 507 CO 0.23 -1.00 -0.13 0.21 0.00 0.00 0.00 175.10 174.42 2fja s ASN 508 N -0.13 1.53 0.30 3.32 3.84 -1.26 -4.66 114.94 117.88 2fja s ASN 508 Ca 0.23 -0.24 0.25 0.00 0.21 0.00 0.00 52.86 53.30 2fja s ASN 508 Cb -0.14 -0.17 0.69 0.00 -0.55 0.00 0.00 41.25 41.08 2fja s ASN 508 CO -0.08 0.16 1.73 1.55 -2.79 0.00 0.00 177.10 177.66 2fja h PRO 509 N 5.78 0.00 -0.33 0.43 0.13 -1.94 -3.31 132.00 132.77 2fja h PRO 509 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2fja h PRO 509 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2fja h PRO 509 CO 0.49 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.65 2fja n GLU 510 N -2.57 2.31 -3.59 0.86 -0.58 -1.26 -5.01 120.64 110.80 2fja n GLU 510 Ca 0.05 -2.12 -0.08 0.00 -0.42 0.00 0.00 57.16 54.58 2fja n GLU 510 Cb 0.45 -1.45 -0.02 0.00 -0.57 0.00 0.00 31.44 29.85 2fja n GLU 510 CO 0.00 0.00 0.00 1.52 -0.48 0.00 0.00 177.13 178.17 2fja s TYR 511 N -1.38 -0.33 0.05 -0.32 -0.85 -1.25 -4.87 117.35 108.40 2fja s TYR 511 Ca 0.34 0.08 0.06 0.00 -0.52 0.00 0.00 57.07 57.03 2fja s TYR 511 Cb 0.20 0.59 -0.02 0.00 0.38 0.00 0.00 41.96 43.11 2fja s TYR 511 CO 0.28 -0.80 -0.17 0.96 -1.52 0.00 0.00 175.55 174.30 2fja s ILE 512 N -3.46 1.37 0.38 -3.49 -4.36 -0.85 -4.53 121.20 106.26 2fja s ILE 512 Ca 0.06 -1.12 -0.02 0.00 -0.26 0.00 0.00 60.65 59.31 2fja s ILE 512 Cb -0.02 -1.22 -0.04 0.00 1.25 0.00 0.00 42.46 42.43 2fja s ILE 512 CO -0.05 0.08 0.62 -0.76 0.24 0.00 0.00 174.94 175.06 2fja s LEU 513 N -1.21 3.91 0.25 0.37 1.43 -1.26 -1.34 118.68 120.83 2fja s LEU 513 Ca 0.04 0.64 -0.04 0.00 -1.03 0.00 0.00 54.13 53.75 2fja s LEU 513 Cb -0.08 -3.52 0.51 0.00 0.03 0.00 0.00 46.19 43.12 2fja s LEU 513 CO 0.02 -0.36 1.67 -0.65 0.23 0.00 0.00 176.35 177.26 2fja h PRO 514 N 0.78 0.24 -0.02 1.29 0.11 -1.88 -0.64 132.00 131.88 2fja h PRO 514 Ca -0.49 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 2fja h PRO 514 Cb 1.21 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2fja h PRO 514 CO 0.62 0.16 -0.27 0.11 -0.21 0.00 0.00 178.00 178.41 2fja h TRP 515 N 0.25 0.03 -0.18 0.65 5.08 -1.94 -0.48 115.95 119.35 2fja h TRP 515 Ca 0.44 -0.00 -0.13 0.00 1.08 0.00 0.00 58.89 60.27 2fja h TRP 515 Cb 0.79 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.94 2fja h TRP 515 CO -0.27 0.30 -0.41 1.96 -1.28 0.00 0.00 178.44 178.73 2fja h GLN 516 N 0.02 0.59 -0.18 0.12 4.20 -1.53 -1.32 115.11 117.01 2fja h GLN 516 Ca 0.00 -0.40 -0.10 0.00 0.06 0.00 0.00 58.65 58.22 2fja h GLN 516 Cb 0.50 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2fja h GLN 516 CO 0.04 1.02 -0.30 0.78 -0.67 0.00 0.00 178.83 179.69 2fja h GLY 517 N 0.26 0.39 0.90 3.46 0.00 -1.10 -2.58 103.07 104.40 2fja h GLY 517 Ca -0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 2fja h GLY 517 CO 0.09 0.30 -0.11 -2.00 0.00 0.00 0.00 176.54 174.82 2fja h LEU 518 N 0.32 0.62 -0.71 3.11 5.85 -0.97 -0.40 115.31 123.12 2fja h LEU 518 Ca 0.04 -0.39 0.06 0.00 0.84 0.00 0.00 57.88 58.44 2fja h LEU 518 Cb 0.70 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 2fja h LEU 518 CO 0.05 0.86 0.41 0.58 -0.34 0.00 0.00 178.44 180.00 2fja h VAL 519 N 0.36 0.98 -0.21 1.05 2.07 -1.14 -0.29 116.25 119.08 2fja h VAL 519 Ca 0.07 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2fja h VAL 519 Cb 0.61 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2fja h VAL 519 CO 0.04 0.14 0.07 -0.09 0.02 0.00 0.00 177.57 177.75 2fja h ARG 520 N 0.74 0.32 -0.23 1.57 2.43 -1.26 -1.82 114.38 116.14 2fja h ARG 520 Ca 0.32 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.45 2fja h ARG 520 Cb 0.19 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2fja h ARG 520 CO -0.18 0.40 0.05 1.25 -1.51 0.00 0.00 179.97 179.97 2fja h LEU 521 N 0.18 0.02 -1.06 3.80 5.85 -0.57 -1.77 115.31 121.75 2fja h LEU 521 Ca 0.07 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2fja h LEU 521 Cb 0.20 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 2fja h LEU 521 CO -0.00 0.04 0.63 1.56 -0.34 0.00 0.00 178.44 180.33 2fja h GLN 522 N 0.14 1.14 -0.38 1.25 4.20 -0.92 -1.43 115.11 119.11 2fja h GLN 522 Ca 0.10 -0.07 -0.11 0.00 0.06 0.00 0.00 58.65 58.63 2fja h GLN 522 Cb 0.10 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2fja h GLN 522 CO -0.13 0.76 -0.20 -0.22 -0.67 0.00 0.00 178.83 178.37 2fja h LYS 523 N 1.18 0.80 0.13 1.46 3.64 -1.01 -0.22 116.57 122.55 2fja h LYS 523 Ca 0.39 -0.35 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2fja h LYS 523 Cb 0.07 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2fja h LYS 523 CO -0.13 0.98 -0.06 0.82 -2.27 0.00 0.00 179.45 178.79 2fja h ILE 524 N 0.59 0.91 -0.65 2.00 2.04 -0.84 -0.98 117.51 120.59 2fja h ILE 524 Ca 0.08 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 2fja h ILE 524 Cb 0.75 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 2fja h ILE 524 CO 0.06 0.03 0.19 0.24 0.00 0.00 0.00 178.15 178.67 2fja h MET 525 N -0.23 1.02 -0.38 2.37 2.86 -1.29 -0.30 114.93 118.97 2fja h MET 525 Ca -0.02 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 2fja h MET 525 Cb 0.18 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 2fja h MET 525 CO 0.03 0.90 0.19 0.22 1.06 0.00 0.00 176.91 179.31 2fja h ASP 526 N 0.94 0.50 1.36 1.22 3.58 -0.93 0.10 116.42 123.20 2fja h ASP 526 Ca 0.21 -0.12 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 2fja h ASP 526 Cb 0.32 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 2fja h ASP 526 CO -0.00 0.48 -0.66 -0.33 -2.88 0.00 0.00 179.24 175.85 2fja h GLU 527 N 0.48 0.00 0.00 0.28 5.08 -1.05 -2.86 114.58 116.51 2fja h GLU 527 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2fja h GLU 527 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2fja h GLU 527 CO -0.02 0.38 -0.87 0.66 -1.00 0.00 0.00 179.01 178.16 2fja n TYR 528 N -3.11 0.00 -1.52 4.33 4.02 -0.13 -4.80 117.16 115.95 2fja n TYR 528 Ca -0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 2fja n TYR 528 Cb 0.72 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 40.13 2fja n TYR 528 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fja n ALA 529 N -1.38 5.70 -3.14 -0.72 0.00 0.02 -3.89 120.51 117.10 2fja n ALA 529 Ca 0.00 -3.46 -0.14 0.00 0.00 0.00 0.00 53.44 49.84 2fja n ALA 529 Cb 0.00 -1.25 0.07 0.00 0.00 0.00 0.00 19.45 18.27 2fja n ALA 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fja n ALA 530 N -0.91 -1.89 -2.21 0.00 0.00 -1.25 -4.91 120.51 109.34 2fja n ALA 530 Ca 0.54 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2fja n ALA 530 Cb 0.89 -3.15 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2fja n ALA 530 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fja n GLY 531 N -1.17 0.91 0.22 0.00 0.00 -1.08 -4.23 105.19 99.85 2fja n GLY 531 Ca -0.18 -1.96 0.05 0.00 0.00 0.00 0.00 46.02 43.93 2fja n GLY 531 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2fja h ILE 532 N -0.28 1.12 -0.97 -0.61 3.07 -1.86 0.81 117.51 118.80 2fja h ILE 532 Ca 0.00 -0.70 0.18 0.00 1.55 0.00 0.00 64.86 65.89 2fja h ILE 532 Cb 0.00 1.38 -0.09 0.00 -0.27 0.00 0.00 36.82 37.84 2fja h ILE 532 CO 0.00 0.20 0.61 0.00 -1.05 0.00 0.00 178.15 177.91 2fja h ALA 533 N 1.80 1.80 -0.29 0.16 0.00 -1.94 -0.69 119.26 120.09 2fja h ALA 533 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2fja h ALA 533 Cb 0.36 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2fja h ALA 533 CO 0.03 -0.11 0.00 0.25 0.00 0.00 0.00 179.25 179.42 2fja n THR 534 N -4.65 2.36 -3.78 0.00 -2.24 -1.14 -4.94 114.28 99.89 2fja n THR 534 Ca 0.21 -2.01 -0.24 0.00 -2.27 0.00 0.00 64.05 59.73 2fja n THR 534 Cb 0.55 -0.27 0.03 0.00 -2.10 0.00 0.00 70.33 68.54 2fja n THR 534 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2fja n ILE 535 N -0.61 -3.66 -2.40 2.28 5.41 -0.27 -2.16 119.36 117.95 2fja n ILE 535 Ca 0.24 -0.35 -0.20 0.00 1.00 0.00 0.00 62.75 63.44 2fja n ILE 535 Cb 0.94 -3.44 -0.01 0.00 -0.71 0.00 0.00 39.64 36.42 2fja n ILE 535 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2fja n TYR 536 N -4.41 -0.99 -4.23 1.39 4.02 0.27 -4.90 117.16 108.31 2fja n TYR 536 Ca -0.20 0.01 -0.32 0.00 -0.01 0.00 0.00 57.90 57.39 2fja n TYR 536 Cb 0.63 -3.92 -0.08 0.00 -0.02 0.00 0.00 39.34 35.95 2fja n TYR 536 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 2fja s LYS 537 N -5.03 2.68 0.34 -0.72 1.02 -0.92 -0.91 119.74 116.20 2fja s LYS 537 Ca 0.01 -0.71 -0.15 0.00 0.02 0.00 0.00 55.97 55.14 2fja s LYS 537 Cb -0.00 -2.61 0.03 0.00 -0.52 0.00 0.00 37.83 34.73 2fja s LYS 537 CO 0.01 0.59 0.70 -0.08 -0.92 0.00 0.00 175.35 175.65 2fja s THR 538 N -1.18 0.00 0.35 2.17 -1.32 -0.23 -3.84 115.64 111.60 2fja s THR 538 Ca 0.22 -1.11 -0.13 0.00 -1.21 0.00 0.00 61.69 59.45 2fja s THR 538 Cb -0.12 -2.56 0.03 0.00 -1.51 0.00 0.00 72.50 68.35 2fja s THR 538 CO 0.14 0.00 0.69 0.54 -2.21 0.00 0.00 174.62 173.78 2fja s ASN 539 N -3.05 0.16 0.17 8.08 6.03 -1.26 -1.56 114.94 123.50 2fja s ASN 539 Ca 0.17 -1.13 -0.17 0.00 -1.03 0.00 0.00 52.86 50.70 2fja s ASN 539 Cb -0.04 0.78 0.09 0.00 -3.03 0.00 0.00 41.25 39.04 2fja s ASN 539 CO 0.11 -1.52 1.66 -0.08 -2.03 0.00 0.00 177.10 175.24 2fja h GLU 540 N 2.04 -0.02 -0.73 3.55 4.81 -1.97 -1.38 114.58 120.88 2fja h GLU 540 Ca -0.29 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2fja h GLU 540 Cb 1.25 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.60 2fja h GLU 540 CO 0.37 -0.01 0.45 0.87 -0.73 0.00 0.00 179.01 179.96 2fja h LYS 541 N -0.02 0.99 -0.19 1.92 1.79 -1.99 -0.11 116.57 118.97 2fja h LYS 541 Ca 0.19 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.56 2fja h LYS 541 Cb 0.31 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 2fja h LYS 541 CO -0.41 0.69 0.05 0.52 -1.08 0.00 0.00 179.45 179.22 2fja h MET 542 N 1.00 0.30 -0.74 3.15 2.86 -1.77 -1.47 114.93 118.26 2fja h MET 542 Ca 0.26 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 2fja h MET 542 Cb -0.05 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 2fja h MET 542 CO -0.05 0.41 0.37 -0.07 1.06 0.00 0.00 176.91 178.63 2fja h LEU 543 N 0.12 0.95 -0.71 1.22 3.38 -1.07 0.52 115.31 119.72 2fja h LEU 543 Ca 0.06 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 2fja h LEU 543 Cb 0.25 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2fja h LEU 543 CO -0.00 0.80 0.09 1.56 0.09 0.00 0.00 178.44 180.97 2fja h GLN 544 N 1.05 1.08 -0.43 1.13 4.20 -0.84 -1.44 115.11 119.85 2fja h GLN 544 Ca 0.26 -0.29 -0.10 0.00 0.06 0.00 0.00 58.65 58.57 2fja h GLN 544 Cb 0.09 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 2fja h GLN 544 CO -0.03 1.00 -0.15 -0.09 -0.67 0.00 0.00 178.83 178.88 2fja h ARG 545 N 1.01 0.81 -0.37 1.46 9.65 -0.65 -2.25 114.38 124.04 2fja h ARG 545 Ca 0.20 -0.29 0.05 0.00 -1.10 0.00 0.00 59.98 58.83 2fja h ARG 545 Cb 0.45 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.94 2fja h ARG 545 CO 0.02 0.91 0.11 0.00 2.80 0.00 0.00 179.97 183.80 2fja h ALA 546 N 1.11 0.42 -1.01 2.80 0.00 -0.29 -0.22 119.26 122.07 2fja h ALA 546 Ca 0.11 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2fja h ALA 546 Cb 0.65 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 2fja h ALA 546 CO 0.05 -0.29 0.66 -0.07 0.00 0.00 0.00 179.25 179.60 2fja h LEU 547 N 0.25 1.12 -0.61 0.00 3.38 -0.91 0.31 115.31 118.85 2fja h LEU 547 Ca 0.17 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2fja h LEU 547 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2fja h LEU 547 CO -0.19 0.77 0.09 -0.33 0.09 0.00 0.00 178.44 178.88 2fja h GLU 548 N 1.30 1.01 -0.16 1.13 5.08 -0.76 -0.68 114.58 121.51 2fja h GLU 548 Ca 0.39 -0.27 -0.17 0.00 -1.00 0.00 0.00 59.36 58.31 2fja h GLU 548 Cb -0.04 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2fja h GLU 548 CO -0.11 0.95 -0.60 -0.07 -1.00 0.00 0.00 179.01 178.18 2fja h LEU 549 N 0.92 0.60 -1.22 1.33 3.38 -0.27 -2.66 115.31 117.39 2fja h LEU 549 Ca 0.18 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2fja h LEU 549 Cb 0.43 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2fja h LEU 549 CO 0.01 1.06 -0.39 -0.07 0.09 0.00 0.00 178.44 179.14 2fja h LEU 550 N 0.40 0.00 -0.47 1.67 3.38 -0.26 -1.61 115.31 118.41 2fja h LEU 550 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2fja h LEU 550 Cb 1.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2fja h LEU 550 CO 0.11 0.39 -0.03 0.00 0.09 0.00 0.00 178.44 179.00 2fja h ALA 551 N 1.61 0.64 -0.28 1.53 0.00 -0.88 0.36 119.26 122.24 2fja h ALA 551 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2fja h ALA 551 Cb 0.70 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2fja h ALA 551 CO 0.05 0.47 0.13 0.74 0.00 0.00 0.00 179.25 180.64 2fja h PHE 552 N 0.70 0.41 -0.60 0.00 0.05 -1.13 -1.81 116.94 114.57 2fja h PHE 552 Ca 0.13 -0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.87 2fja h PHE 552 Cb 0.55 -0.13 -0.03 0.00 2.00 0.00 0.00 35.95 38.34 2fja h PHE 552 CO 0.04 0.39 0.26 1.25 -0.18 0.00 0.00 178.31 180.07 2fja h LEU 553 N 0.32 0.81 -0.72 1.54 5.85 -1.02 -1.38 115.31 120.70 2fja h LEU 553 Ca 0.10 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.67 2fja h LEU 553 Cb 0.14 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 2fja h LEU 553 CO -0.01 0.74 0.48 0.50 -0.34 0.00 0.00 178.44 179.81 2fja h LYS 554 N 0.83 0.94 -0.61 1.25 3.64 -0.11 -1.18 116.57 121.33 2fja h LYS 554 Ca 0.20 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 2fja h LYS 554 Cb 0.17 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2fja h LYS 554 CO -0.02 0.62 0.17 0.93 -2.27 0.00 0.00 179.45 178.88 2fja h GLU 555 N 0.97 0.93 0.00 1.90 5.08 -1.02 -1.93 114.58 120.51 2fja h GLU 555 Ca 0.27 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2fja h GLU 555 Cb -0.10 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.01 2fja h GLU 555 CO -0.06 0.82 0.00 -0.25 -1.00 0.00 0.00 179.01 178.51 2fja n ASP 556 N -4.27 0.46 0.23 1.42 8.00 -0.55 -2.22 116.55 119.63 2fja n ASP 556 Ca 0.05 0.60 0.09 0.00 0.71 0.00 0.00 54.79 56.24 2fja n ASP 556 Cb 0.22 -0.70 0.55 0.00 -0.02 0.00 0.00 41.12 41.18 2fja n ASP 556 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2fja h LEU 557 N 0.00 0.00 0.00 0.64 3.38 -0.42 -0.25 115.31 118.66 2fja h LEU 557 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fja h LEU 557 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2fja h LEU 557 CO 0.00 0.22 0.00 -0.62 0.09 0.00 0.00 178.44 178.13 2fja n GLU 558 N -3.65 0.03 -0.77 1.13 -0.58 -0.94 -2.03 120.64 113.83 2fja n GLU 558 Ca -0.01 0.23 0.02 0.00 -0.42 0.00 0.00 57.16 56.97 2fja n GLU 558 Cb 0.34 -1.50 0.19 0.00 -0.57 0.00 0.00 31.44 29.90 2fja n GLU 558 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2fja n LYS 559 N -1.47 1.82 -2.63 3.49 5.02 -0.11 -5.04 118.16 119.25 2fja n LYS 559 Ca 0.04 -3.38 -0.34 0.00 -2.02 0.00 0.00 58.31 52.61 2fja n LYS 559 Cb 0.17 -1.71 -0.05 0.00 -0.02 0.00 0.00 35.03 33.42 2fja n LYS 559 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2fja s LEU 560 N -3.28 3.93 0.15 -0.35 1.43 -0.86 -2.00 118.68 117.70 2fja s LEU 560 Ca 0.40 1.87 0.06 0.00 -1.03 0.00 0.00 54.13 55.43 2fja s LEU 560 Cb 0.38 -4.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.07 2fja s LEU 560 CO -0.05 -0.60 -0.13 0.00 0.23 0.00 0.00 176.35 175.80 2fja s ALA 561 N -1.98 1.61 -0.10 4.21 0.00 -0.45 -4.19 121.76 120.85 2fja s ALA 561 Ca 0.64 -1.46 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 2fja s ALA 561 Cb -0.15 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 22.97 2fja s ALA 561 CO 0.19 0.02 0.27 0.00 0.00 0.00 0.00 175.76 176.24 2fja s ALA 562 N -2.79 -0.66 -0.77 0.00 0.00 -0.85 -4.12 121.76 112.58 2fja s ALA 562 Ca 0.15 0.85 0.21 0.00 0.00 0.00 0.00 51.96 53.18 2fja s ALA 562 Cb -0.01 -0.51 -0.24 0.00 0.00 0.00 0.00 23.12 22.36 2fja s ALA 562 CO 0.03 -0.15 0.82 0.54 0.00 0.00 0.00 175.76 177.00 2fja n ARG 563 N 3.32 0.16 -3.84 0.00 1.74 -1.26 -4.03 116.66 112.75 2fja n ARG 563 Ca -0.16 -0.05 -0.08 0.00 -0.77 0.00 0.00 57.85 56.79 2fja n ARG 563 Cb 0.57 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 2fja n ARG 563 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2fja s ASP 564 N -3.37 -0.07 0.28 0.55 1.47 -1.26 -1.19 116.67 113.08 2fja s ASP 564 Ca 0.04 -0.96 -0.04 0.00 1.18 0.00 0.00 52.55 52.78 2fja s ASP 564 Cb 0.16 0.80 0.36 0.00 -0.34 0.00 0.00 42.92 43.89 2fja s ASP 564 CO 0.87 -1.54 1.95 -0.07 0.68 0.00 0.00 175.17 177.06 2fja h LEU 565 N 2.01 1.04 -0.12 2.11 3.38 -1.89 -0.19 115.31 121.64 2fja h LEU 565 Ca -0.27 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.68 2fja h LEU 565 Cb 1.25 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 2fja h LEU 565 CO 0.34 0.76 0.02 -0.74 0.09 0.00 0.00 178.44 178.91 2fja h HIS 566 N 1.22 0.03 0.00 1.13 2.76 -1.95 -1.49 115.15 116.85 2fja h HIS 566 Ca 0.33 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.48 2fja h HIS 566 Cb -0.13 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 28.83 2fja h HIS 566 CO 0.00 0.01 -0.14 1.49 -1.30 0.00 0.00 177.93 177.99 2fja h GLU 567 N 0.07 0.00 -0.25 5.26 4.81 -1.88 -1.85 114.58 120.73 2fja h GLU 567 Ca 0.05 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.13 2fja h GLU 567 Cb 0.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2fja h GLU 567 CO -0.08 0.14 -0.47 1.25 -0.73 0.00 0.00 179.01 179.12 2fja h LEU 568 N 0.00 0.73 -0.32 1.64 5.85 -0.24 0.11 115.31 123.07 2fja h LEU 568 Ca -0.00 -0.36 -0.06 0.00 0.84 0.00 0.00 57.88 58.30 2fja h LEU 568 Cb 0.67 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2fja h LEU 568 CO 0.02 1.08 -0.05 -0.03 -0.34 0.00 0.00 178.44 179.12 2fja h MET 569 N 0.53 0.61 -0.69 1.25 4.05 -0.85 -2.46 114.93 117.36 2fja h MET 569 Ca 0.03 -0.22 0.05 0.00 -0.28 0.00 0.00 59.70 59.28 2fja h MET 569 Cb 1.02 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.73 2fja h MET 569 CO 0.10 0.77 0.46 0.00 0.23 0.00 0.00 176.91 178.46 2fja h ARG 570 N 0.39 0.76 -0.39 0.39 2.47 -1.06 0.80 114.38 117.74 2fja h ARG 570 Ca 0.09 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.74 2fja h ARG 570 Cb 0.53 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 2fja h ARG 570 CO 0.03 0.50 0.17 0.00 0.56 0.00 0.00 179.97 181.22 2fja h ALA 571 N 1.61 0.50 0.00 0.04 0.00 -0.43 -1.23 119.26 119.75 2fja h ALA 571 Ca 0.29 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 2fja h ALA 571 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2fja h ALA 571 CO -0.09 0.09 -0.62 -1.49 0.00 0.00 0.00 179.25 177.15 2fja h TRP 572 N 0.48 0.00 -0.35 0.00 4.06 -0.88 -1.99 115.95 117.28 2fja h TRP 572 Ca 0.13 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.00 2fja h TRP 572 Cb 0.17 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 2fja h TRP 572 CO -0.00 0.62 -0.11 0.93 -3.56 0.00 0.00 178.44 176.31 2fja h GLU 573 N 0.00 0.60 0.04 0.49 5.08 -0.62 -0.44 114.58 119.73 2fja h GLU 573 Ca -0.01 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2fja h GLU 573 Cb 1.18 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2fja h GLU 573 CO 0.08 0.70 -0.02 1.25 -1.00 0.00 0.00 179.01 180.03 2fja h LEU 574 N 0.55 -0.04 -0.69 1.33 5.85 -0.91 -1.11 115.31 120.29 2fja h LEU 574 Ca 0.10 -0.21 0.11 0.00 0.84 0.00 0.00 57.88 58.73 2fja h LEU 574 Cb 0.52 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.48 2fja h LEU 574 CO 0.03 0.18 0.28 0.58 -0.34 0.00 0.00 178.44 179.17 2fja h VAL 575 N -0.27 0.74 -0.56 1.05 2.07 -1.00 0.23 116.25 118.51 2fja h VAL 575 Ca -0.01 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2fja h VAL 575 Cb 0.24 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 2fja h VAL 575 CO 0.01 0.08 0.31 0.45 0.02 0.00 0.00 177.57 178.44 2fja h HIS 576 N 0.46 0.77 -0.70 1.57 3.86 -0.86 -2.87 115.15 117.38 2fja h HIS 576 Ca 0.36 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.50 2fja h HIS 576 Cb 0.47 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.67 2fja h HIS 576 CO -0.16 0.56 0.24 0.00 0.86 0.00 0.00 177.93 179.43 2fja h ARG 577 N 0.76 1.07 -0.21 2.45 3.08 0.14 -1.95 114.38 119.72 2fja h ARG 577 Ca 0.20 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2fja h ARG 577 Cb 0.04 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2fja h ARG 577 CO -0.03 0.91 0.13 0.28 -1.07 0.00 0.00 179.97 180.19 2fja h VAL 578 N 1.01 1.08 -0.43 2.04 2.07 -0.85 0.25 116.25 121.42 2fja h VAL 578 Ca 0.23 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 67.47 2fja h VAL 578 Cb 0.27 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2fja h VAL 578 CO -0.01 0.08 -0.07 -0.50 0.02 0.00 0.00 177.57 177.09 2fja h TRP 579 N 0.26 0.81 -0.66 1.57 4.06 -1.47 -0.47 115.95 120.05 2fja h TRP 579 Ca 0.07 -0.13 -0.04 0.00 2.06 0.00 0.00 58.89 60.86 2fja h TRP 579 Cb 0.02 -0.21 -0.03 0.00 -1.00 0.00 0.00 29.16 27.93 2fja h TRP 579 CO -0.05 0.79 0.26 1.15 -3.56 0.00 0.00 178.44 177.04 2fja h THR 580 N 0.69 1.24 -0.44 1.49 2.02 -0.95 -2.04 112.91 114.91 2fja h THR 580 Ca 0.12 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 2fja h THR 580 Cb 0.53 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2fja h THR 580 CO 0.03 0.30 0.23 0.00 0.37 0.00 0.00 175.52 176.45 2fja h ALA 581 N 1.11 0.57 -0.70 6.16 0.00 0.08 -1.80 119.26 124.69 2fja h ALA 581 Ca 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2fja h ALA 581 Cb 0.21 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2fja h ALA 581 CO -0.02 0.11 0.45 1.49 0.00 0.00 0.00 179.25 181.28 2fja h GLU 582 N 0.58 0.92 -0.78 0.00 4.81 -0.82 -0.89 114.58 118.40 2fja h GLU 582 Ca 0.15 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 2fja h GLU 582 Cb 0.09 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 2fja h GLU 582 CO -0.02 0.63 0.37 0.00 -0.73 0.00 0.00 179.01 179.25 2fja h ALA 583 N 1.24 1.01 -0.31 2.92 0.00 -1.17 0.17 119.26 123.12 2fja h ALA 583 Ca 0.25 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2fja h ALA 583 Cb -0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2fja h ALA 583 CO -0.05 0.57 0.18 1.25 0.00 0.00 0.00 179.25 181.20 2fja h HIS 584 N 1.10 0.42 -0.27 0.00 -0.00 -0.79 -0.66 115.15 114.95 2fja h HIS 584 Ca 0.27 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.62 2fja h HIS 584 Cb 0.13 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 27.39 2fja h HIS 584 CO 0.01 0.33 0.13 0.28 -0.00 0.00 0.00 177.93 178.68 2fja h VAL 585 N 0.39 1.15 -0.65 5.26 2.07 -0.84 -0.73 116.25 122.89 2fja h VAL 585 Ca 0.11 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 2fja h VAL 585 Cb 0.05 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2fja h VAL 585 CO -0.02 0.16 0.33 0.03 0.02 0.00 0.00 177.57 178.08 2fja h ARG 586 N 0.30 0.91 -0.27 1.57 3.08 -0.79 -0.23 114.38 118.96 2fja h ARG 586 Ca 0.09 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 2fja h ARG 586 Cb 0.13 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2fja h ARG 586 CO -0.01 0.69 -0.07 0.45 -1.07 0.00 0.00 179.97 179.97 2fja h HIS 587 N 0.91 0.58 -0.43 3.04 3.86 -0.86 -0.92 115.15 121.32 2fja h HIS 587 Ca 0.23 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 59.27 2fja h HIS 587 Cb 0.07 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2fja h HIS 587 CO 0.01 0.73 0.10 0.52 0.86 0.00 0.00 177.93 180.14 2fja h MET 588 N 0.26 0.65 -0.30 2.45 2.86 -0.78 -2.29 114.93 117.79 2fja h MET 588 Ca 0.07 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.45 2fja h MET 588 Cb 0.54 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 2fja h MET 588 CO 0.03 0.60 -0.36 1.25 1.06 0.00 0.00 176.91 179.49 2fja h LEU 589 N 0.63 0.71 -0.20 1.22 5.85 -0.88 -3.29 115.31 119.36 2fja h LEU 589 Ca 0.14 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 2fja h LEU 589 Cb 0.25 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2fja h LEU 589 CO -0.00 1.00 -0.03 0.15 -0.34 0.00 0.00 178.44 179.22 2fja h PHE 590 N 0.56 0.41 -2.96 1.25 3.57 -0.63 -3.41 116.94 115.75 2fja h PHE 590 Ca 0.05 -0.08 -0.55 0.00 3.53 0.00 0.00 57.97 60.92 2fja h PHE 590 Cb 0.88 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.46 2fja h PHE 590 CO 0.04 0.61 1.09 0.50 -2.23 0.00 0.00 178.31 178.32 2fja s ARG 591 N -4.81 3.37 -1.37 1.11 3.52 -0.95 -4.93 118.95 114.90 2fja s ARG 591 Ca -0.14 0.58 -0.10 0.00 -0.13 0.00 0.00 55.73 55.94 2fja s ARG 591 Cb 0.06 -4.10 0.10 0.00 -1.56 0.00 0.00 34.95 29.46 2fja s ARG 591 CO 0.74 -1.84 2.13 1.63 -0.81 0.00 0.00 175.30 177.14 2fja n LYS 592 N 8.50 3.51 -3.71 5.12 5.02 -1.26 -4.85 118.16 130.48 2fja n LYS 592 Ca 0.13 -3.14 -0.01 0.00 -2.02 0.00 0.00 58.31 53.28 2fja n LYS 592 Cb 0.49 -2.99 -0.01 0.00 -0.02 0.00 0.00 35.03 32.50 2fja n LYS 592 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2fja s GLU 593 N 1.19 0.80 -0.48 1.97 -1.05 -1.26 -4.93 118.70 114.94 2fja s GLU 593 Ca 0.46 -0.45 0.03 0.00 -0.15 0.00 0.00 54.97 54.86 2fja s GLU 593 Cb 0.13 0.27 0.13 0.00 -0.44 0.00 0.00 34.13 34.21 2fja s GLU 593 CO -0.04 -0.37 0.24 0.99 0.95 0.00 0.00 175.26 177.04 2fja s THR 594 N -2.76 2.09 -0.11 1.83 2.01 -0.46 -4.64 115.64 113.60 2fja s THR 594 Ca 0.14 -2.97 0.16 0.00 0.31 0.00 0.00 61.69 59.34 2fja s THR 594 Cb 0.02 -2.46 -0.15 0.00 0.01 0.00 0.00 72.50 69.91 2fja s THR 594 CO -0.00 -0.83 0.78 -1.14 -0.69 0.00 0.00 174.62 172.74 2fja n ARG 595 N 3.33 0.62 -3.14 4.92 0.63 -1.26 -2.95 116.66 118.81 2fja n ARG 595 Ca 0.06 0.22 -0.26 0.00 -0.92 0.00 0.00 57.85 56.95 2fja n ARG 595 Cb 0.33 -1.80 -0.06 0.00 0.45 0.00 0.00 32.46 31.39 2fja n ARG 595 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2fja n TRP 596 N -2.89 3.51 -1.85 -0.14 8.01 -1.26 -4.88 117.44 117.93 2fja n TRP 596 Ca -0.11 -4.03 -0.40 0.00 -1.31 0.00 0.00 57.50 51.65 2fja n TRP 596 Cb 0.87 -0.51 0.00 0.00 -2.01 0.00 0.00 31.31 29.67 2fja n TRP 596 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.69 175.43 2fja s PRO 597 N -2.97 3.94 0.00 -0.99 0.04 -1.26 -1.00 135.00 132.77 2fja s PRO 597 Ca 0.45 2.44 0.00 0.00 0.04 0.00 0.00 61.00 63.92 2fja s PRO 597 Cb 0.23 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.95 2fja s PRO 597 CO -0.09 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.75 2fja n GLY 598 N 0.56 1.48 0.16 0.56 0.00 -1.26 -3.90 105.19 102.79 2fja n GLY 598 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 2fja n GLY 598 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2fja n TYR 599 N -0.05 0.00 -3.54 1.61 0.53 -0.17 -4.61 117.16 110.92 2fja n TYR 599 Ca 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 57.90 56.78 2fja n TYR 599 Cb 0.00 -0.84 -0.04 0.00 -1.03 0.00 0.00 39.34 37.44 2fja n TYR 599 CO 0.00 0.00 0.00 1.52 -1.02 0.00 0.00 176.86 177.36 2fja s TYR 600 N -2.43 -0.36 -0.06 -0.72 -0.85 -1.03 -4.85 117.35 107.04 2fja s TYR 600 Ca -0.30 0.44 0.03 0.00 -0.52 0.00 0.00 57.07 56.72 2fja s TYR 600 Cb 0.09 0.49 0.01 0.00 0.38 0.00 0.00 41.96 42.93 2fja s TYR 600 CO 0.48 -0.44 -0.15 0.71 -1.52 0.00 0.00 175.55 174.63 2fja s TYR 601 N -2.08 1.63 -0.54 -3.49 1.51 -0.09 -4.00 117.35 110.29 2fja s TYR 601 Ca 0.01 -0.56 -0.16 0.00 -1.01 0.00 0.00 57.07 55.35 2fja s TYR 601 Cb -0.01 -1.14 0.13 0.00 -0.11 0.00 0.00 41.96 40.83 2fja s TYR 601 CO -0.03 -0.25 0.50 1.03 -1.11 0.00 0.00 175.55 175.69 2fja s ARG 602 N 0.40 2.99 0.57 -0.62 1.81 -1.26 -1.07 118.95 121.78 2fja s ARG 602 Ca -0.11 -1.68 0.31 0.00 -1.72 0.00 0.00 55.73 52.53 2fja s ARG 602 Cb -0.14 -4.29 1.75 0.00 -0.45 0.00 0.00 34.95 31.82 2fja s ARG 602 CO 0.04 -1.32 2.19 1.79 -0.68 0.00 0.00 175.30 177.32 2fja h THR 603 N 5.88 0.46 0.00 0.02 1.35 -1.69 -0.10 112.91 118.84 2fja h THR 603 Ca -0.30 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2fja h THR 603 Cb 1.10 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2fja h THR 603 CO 1.03 0.04 -0.21 -0.90 -0.25 0.00 0.00 175.52 175.23 2fja n ASP 604 N -3.65 0.73 -3.12 5.36 5.75 -1.26 -4.04 116.55 116.32 2fja n ASP 604 Ca -0.02 0.40 -0.19 0.00 -0.01 0.00 0.00 54.79 54.97 2fja n ASP 604 Cb 0.15 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 39.76 2fja n ASP 604 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2fja n TYR 605 N -2.15 -0.62 0.16 2.11 4.02 -0.37 -5.01 117.16 115.31 2fja n TYR 605 Ca 0.05 -3.39 0.07 0.00 -0.01 0.00 0.00 57.90 54.61 2fja n TYR 605 Cb 0.43 -0.05 0.33 0.00 -0.02 0.00 0.00 39.34 40.02 2fja n TYR 605 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2fja n PRO 606 N 0.92 0.08 -4.14 -0.72 -0.04 -0.19 -2.21 135.00 128.70 2fja n PRO 606 Ca 0.20 0.52 -0.23 0.00 -0.04 0.00 0.00 63.50 63.95 2fja n PRO 606 Cb 0.60 -1.73 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 2fja n PRO 606 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2fja s GLU 607 N -3.26 2.81 0.00 0.54 0.41 -1.26 -4.61 118.70 113.33 2fja s GLU 607 Ca 0.00 -1.06 -0.27 0.00 -0.41 0.00 0.00 54.97 53.22 2fja s GLU 607 Cb 0.05 -2.52 -0.04 0.00 -1.78 0.00 0.00 34.13 29.84 2fja s GLU 607 CO 0.15 0.42 0.87 -1.17 -0.49 0.00 0.00 175.26 175.04 2fja s LEU 608 N -3.60 4.38 -0.52 1.80 0.20 -1.15 -1.35 118.68 118.44 2fja s LEU 608 Ca 0.32 1.52 0.03 0.00 0.69 0.00 0.00 54.13 56.68 2fja s LEU 608 Cb -0.08 -3.39 0.13 0.00 -0.43 0.00 0.00 46.19 42.42 2fja s LEU 608 CO 0.24 -0.16 0.27 0.21 -0.29 0.00 0.00 176.35 176.61 2fja s ASN 609 N 0.70 4.49 0.00 3.68 3.84 -1.26 -4.92 114.94 121.46 2fja s ASN 609 Ca 0.46 -2.91 0.31 0.00 0.21 0.00 0.00 52.86 50.92 2fja s ASN 609 Cb -0.20 -1.67 1.61 0.00 -0.55 0.00 0.00 41.25 40.43 2fja s ASN 609 CO 0.25 -0.27 2.09 0.47 -2.79 0.00 0.00 177.10 176.85 2fja n ASP 610 N 3.27 0.04 0.08 -4.21 8.00 -1.26 -0.68 116.55 121.79 2fja n ASP 610 Ca 0.05 -0.40 -0.19 0.00 0.71 0.00 0.00 54.79 54.95 2fja n ASP 610 Cb 0.34 -0.20 -0.15 0.00 -0.02 0.00 0.00 41.12 41.10 2fja n ASP 610 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2fja h GLU 611 N 0.05 0.33 0.00 -1.24 3.07 -1.99 -3.39 114.58 111.41 2fja h GLU 611 Ca 0.00 -0.57 0.00 0.00 -0.50 0.00 0.00 59.36 58.29 2fja h GLU 611 Cb 0.21 0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2fja h GLU 611 CO 0.00 1.23 -0.34 0.39 -1.40 0.00 0.00 179.01 178.88 2fja n GLU 612 N -3.54 4.27 -0.28 2.33 1.02 -1.22 -4.83 120.64 118.39 2fja n GLU 612 Ca -0.18 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.04 2fja n GLU 612 Cb 1.06 -0.65 0.13 0.00 -0.02 0.00 0.00 31.44 31.96 2fja n GLU 612 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2fja n TRP 613 N -1.10 0.00 -1.98 -0.32 7.02 0.14 -4.83 117.44 116.37 2fja n TRP 613 Ca 0.00 -0.93 -0.41 0.00 -1.02 0.00 0.00 57.50 55.14 2fja n TRP 613 Cb 0.00 -0.15 -0.00 0.00 -2.42 0.00 0.00 31.31 28.73 2fja n TRP 613 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 2fja n LYS 614 N -1.10 3.59 -3.79 -0.99 4.81 -1.24 -4.82 118.16 114.62 2fja n LYS 614 Ca 0.14 -3.09 -0.09 0.00 -0.87 0.00 0.00 58.31 54.39 2fja n LYS 614 Cb 0.68 -2.96 -0.06 0.00 0.02 0.00 0.00 35.03 32.70 2fja n LYS 614 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2fja s PHE 616 N -3.78 3.78 -0.29 0.00 0.40 0.89 -4.85 117.98 114.13 2fja s PHE 616 Ca 0.04 1.44 -0.10 0.00 -0.60 0.00 0.00 56.93 57.71 2fja s PHE 616 Cb 0.04 -2.64 -0.03 0.00 0.51 0.00 0.00 43.02 40.90 2fja s PHE 616 CO -0.11 0.46 0.17 0.08 0.70 0.00 0.00 175.22 176.52 2fja s VAL 617 N -1.30 4.99 0.07 -0.44 1.01 -1.26 -1.17 120.40 122.30 2fja s VAL 617 Ca 0.37 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2fja s VAL 617 Cb -0.20 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2fja s VAL 617 CO 0.22 0.20 -0.20 0.00 0.00 0.00 0.00 175.10 175.33 2fja s SER 619 N -1.66 0.43 -0.01 0.00 1.04 -0.36 -0.12 113.70 113.02 2fja s SER 619 Ca 0.15 -1.05 -0.00 0.00 0.48 0.00 0.00 55.95 55.52 2fja s SER 619 Cb -0.10 0.23 0.01 0.00 0.10 0.00 0.00 66.02 66.26 2fja s SER 619 CO 0.06 -0.64 0.03 -0.75 0.98 0.00 0.00 173.24 172.92 2fja s LYS 620 N -3.96 -0.00 -0.19 4.02 2.20 -0.30 -1.00 119.74 120.51 2fja s LYS 620 Ca 0.12 0.09 -0.05 0.00 -0.36 0.00 0.00 55.97 55.77 2fja s LYS 620 Cb 0.08 -0.09 -0.03 0.00 -1.51 0.00 0.00 37.83 36.28 2fja s LYS 620 CO -0.06 -0.07 0.01 -0.47 -0.36 0.00 0.00 175.35 174.39 2fja s TYR 621 N 0.44 3.08 -0.47 4.03 5.04 -1.26 -1.33 117.35 126.87 2fja s TYR 621 Ca -0.04 -0.32 -0.14 0.00 -2.44 0.00 0.00 57.07 54.14 2fja s TYR 621 Cb -0.05 -2.07 0.09 0.00 0.35 0.00 0.00 41.96 40.28 2fja s TYR 621 CO -0.01 -0.13 0.38 0.34 -1.34 0.00 0.00 175.55 174.78 2fja s ASP 622 N 0.79 6.01 0.24 4.32 3.68 -0.39 -4.14 116.67 127.17 2fja s ASP 622 Ca 0.01 -1.47 -0.06 0.00 2.13 0.00 0.00 52.55 53.16 2fja s ASP 622 Cb -0.14 -2.13 0.34 0.00 -1.45 0.00 0.00 42.92 39.53 2fja s ASP 622 CO 0.02 -0.66 1.83 0.00 0.13 0.00 0.00 175.17 176.49 2fja h ALA 623 N 8.68 1.13 -0.44 3.66 0.00 -1.87 1.04 119.26 131.45 2fja h ALA 623 Ca -0.27 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2fja h ALA 623 Cb 1.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2fja h ALA 623 CO 0.88 0.18 0.16 0.93 0.00 0.00 0.00 179.25 181.40 2fja h GLU 624 N 0.87 0.68 0.00 0.00 5.08 -1.94 -3.01 114.58 116.26 2fja h GLU 624 Ca 0.37 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2fja h GLU 624 Cb 0.23 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2fja h GLU 624 CO -0.20 0.64 -0.70 1.63 -1.00 0.00 0.00 179.01 179.38 2fja n LYS 625 N -4.58 0.21 -3.64 2.33 5.02 -1.08 -4.96 118.16 111.46 2fja n LYS 625 Ca 0.01 0.04 -0.22 0.00 -2.02 0.00 0.00 58.31 56.12 2fja n LYS 625 Cb 0.17 -1.61 0.06 0.00 -0.02 0.00 0.00 35.03 33.62 2fja n LYS 625 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2fja n ASP 626 N -1.91 -2.91 -4.19 4.39 4.64 0.36 -4.99 116.55 111.94 2fja n ASP 626 Ca 0.03 -0.71 -0.24 0.00 -1.38 0.00 0.00 54.79 52.50 2fja n ASP 626 Cb 0.41 -4.51 -0.15 0.00 -1.04 0.00 0.00 41.12 35.83 2fja n ASP 626 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 2fja s GLU 627 N -5.96 1.31 -0.17 -0.67 2.02 -1.04 -4.96 118.70 109.23 2fja s GLU 627 Ca 0.21 -0.75 -0.05 0.00 0.02 0.00 0.00 54.97 54.39 2fja s GLU 627 Cb -0.10 -1.33 -0.03 0.00 0.10 0.00 0.00 34.13 32.77 2fja s GLU 627 CO 0.78 0.35 0.01 -1.58 0.02 0.00 0.00 175.26 174.83 2fja s TRP 628 N -0.62 3.13 -0.05 1.61 0.52 -1.26 -1.27 118.94 121.00 2fja s TRP 628 Ca 0.06 -0.13 0.06 0.00 0.02 0.00 0.00 56.10 56.11 2fja s TRP 628 Cb -0.08 -2.01 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 2fja s TRP 628 CO 0.01 0.06 -0.23 0.99 0.02 0.00 0.00 176.95 177.79 2fja s THR 629 N 0.34 2.29 0.09 2.01 2.01 -0.44 -4.97 115.64 116.97 2fja s THR 629 Ca -0.01 -1.00 0.09 0.00 0.31 0.00 0.00 61.69 61.08 2fja s THR 629 Cb -0.13 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.50 2fja s THR 629 CO 0.02 0.57 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.96 2fja s PHE 630 N -0.36 2.50 -0.01 4.92 0.40 -1.26 -1.15 117.98 123.02 2fja s PHE 630 Ca 0.03 -0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 56.03 2fja s PHE 630 Cb -0.12 -1.37 -0.00 0.00 0.51 0.00 0.00 43.02 42.03 2fja s PHE 630 CO 0.02 0.32 0.07 -2.00 0.70 0.00 0.00 175.22 174.33 2fja s GLU 631 N -1.85 0.30 -0.23 0.44 2.12 0.83 -4.99 118.70 115.32 2fja s GLU 631 Ca 0.16 -0.27 -0.06 0.00 0.36 0.00 0.00 54.97 55.16 2fja s GLU 631 Cb -0.10 0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.38 2fja s GLU 631 CO 0.08 -0.06 0.04 0.15 -0.54 0.00 0.00 175.26 174.92 2fja s LYS 632 N -0.89 3.64 -0.34 4.30 1.02 -1.26 -0.85 119.74 125.36 2fja s LYS 632 Ca -0.10 -0.49 -0.04 0.00 0.02 0.00 0.00 55.97 55.35 2fja s LYS 632 Cb -0.06 -3.22 0.06 0.00 -0.52 0.00 0.00 37.83 34.09 2fja s LYS 632 CO 0.00 -0.10 0.10 0.08 -0.92 0.00 0.00 175.35 174.51 2fja s VAL 633 N 1.34 3.47 0.39 3.17 1.01 -0.32 -4.94 120.40 124.53 2fja s VAL 633 Ca 0.05 -1.39 -0.26 0.00 0.00 0.00 0.00 61.98 60.37 2fja s VAL 633 Cb -0.15 -3.05 -0.11 0.00 0.00 0.00 0.00 36.38 33.07 2fja s VAL 633 CO 0.02 -0.27 1.29 -2.65 0.00 0.00 0.00 175.10 173.49 2fja n PRO 634 N 4.72 2.03 -2.67 2.72 -0.02 -1.26 -0.08 135.00 140.44 2fja n PRO 634 Ca -0.11 0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 61.69 2fja n PRO 634 Cb 0.43 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.48 2fja n PRO 634 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2fja s TYR 635 N -1.16 3.86 -0.02 6.00 5.04 -0.90 -4.79 117.35 125.39 2fja s TYR 635 Ca 0.59 1.85 0.03 0.00 -2.44 0.00 0.00 57.07 57.11 2fja s TYR 635 Cb -0.52 -3.07 -0.01 0.00 0.35 0.00 0.00 41.96 38.71 2fja s TYR 635 CO 0.60 0.16 -0.12 0.14 -1.34 0.00 0.00 175.55 174.99 2fja s VAL 636 N -1.18 0.96 -0.29 3.14 -7.23 -1.26 -4.98 120.40 109.56 2fja s VAL 636 Ca 0.42 -0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 59.81 2fja s VAL 636 Cb -0.28 -0.82 0.00 0.00 0.56 0.00 0.00 36.38 35.85 2fja s VAL 636 CO 0.35 0.28 1.24 -1.58 -0.31 0.00 0.00 175.10 175.08 2fja s GLN 637 N -0.12 3.99 -0.08 4.82 0.74 -1.26 -4.83 119.66 122.92 2fja s GLN 637 Ca 0.02 1.25 -0.04 0.00 0.05 0.00 0.00 55.36 56.64 2fja s GLN 637 Cb -0.06 -3.83 -0.27 0.00 1.10 0.00 0.00 33.01 29.95 2fja s GLN 637 CO 0.00 -1.02 0.51 0.28 -0.55 0.00 0.00 175.29 174.52 2fja h VAL 638 N 5.85 0.76 -3.01 1.34 2.07 -1.95 -3.47 116.25 117.84 2fja h VAL 638 Ca -0.25 -2.48 -0.64 0.00 0.82 0.00 0.00 66.70 64.15 2fja h VAL 638 Cb 1.09 2.56 -0.08 0.00 -1.52 0.00 0.00 31.29 33.34 2fja h VAL 638 CO 1.03 0.82 -0.55 -0.63 0.02 0.00 0.00 177.57 178.26 2fja s ILE 639 N -2.57 4.97 -0.11 4.57 1.09 -1.26 -5.04 121.20 122.85 2fja s ILE 639 Ca -0.17 -0.40 -0.30 0.00 -1.10 0.00 0.00 60.65 58.68 2fja s ILE 639 Cb 0.07 -3.32 -0.03 0.00 -1.06 0.00 0.00 42.46 38.12 2fja s ILE 639 CO 0.80 0.28 1.26 -0.70 -0.10 0.00 0.00 174.94 176.48 2fja s GLU 640 N -2.00 4.28 -0.18 2.79 2.12 -1.26 -4.98 118.70 119.48 2fja s GLU 640 Ca 0.27 1.71 -0.34 0.00 0.36 0.00 0.00 54.97 56.96 2fja s GLU 640 Cb -0.12 -3.68 0.14 0.00 0.26 0.00 0.00 34.13 30.73 2fja s GLU 640 CO 0.18 -0.60 1.18 1.67 -0.54 0.00 0.00 175.26 177.15 2fja s TRP 641 N 2.94 -0.15 0.10 5.30 1.48 -1.26 -4.85 118.94 122.49 2fja s TRP 641 Ca 0.57 0.11 0.02 0.00 -1.06 0.00 0.00 56.10 55.74 2fja s TRP 641 Cb -0.24 0.51 -0.04 0.00 -1.16 0.00 0.00 33.47 32.54 2fja s TRP 641 CO 0.19 -0.23 -0.07 -1.12 -4.06 0.00 0.00 176.95 171.66 2fja s SER 642 N -2.08 1.16 0.00 -2.66 0.01 -1.26 -5.12 113.70 103.75 2fja s SER 642 Ca 0.08 -0.98 0.16 0.00 1.31 0.00 0.00 55.95 56.53 2fja s SER 642 Cb -0.01 0.09 0.97 0.00 0.21 0.00 0.00 66.02 67.28 2fja s SER 642 CO -0.05 -0.44 1.38 0.49 0.41 0.00 0.00 173.24 175.03