#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jyt s ILE 2 N 0.00 5.37 0.27 4.25 2.07 -1.26 -4.67 121.20 127.22 3jyt s ILE 2 Ca 0.00 0.16 -0.24 0.00 -1.41 0.00 0.00 60.65 59.16 3jyt s ILE 2 Cb 0.00 -3.35 -0.09 0.00 0.13 0.00 0.00 42.46 39.15 3jyt s ILE 2 CO 0.00 0.59 0.85 -0.55 -1.91 0.00 0.00 174.94 173.91 3jyt s SER 3 N -0.76 7.26 0.00 4.50 0.15 0.43 -4.79 113.70 120.49 3jyt s SER 3 Ca 0.13 1.67 0.31 0.00 0.70 0.00 0.00 55.95 58.77 3jyt s SER 3 Cb -0.12 -2.52 1.77 0.00 -1.71 0.00 0.00 66.02 63.44 3jyt s SER 3 CO 0.03 0.01 2.16 -0.81 1.20 0.00 0.00 173.24 175.83 3jyt n PRO 4 N 0.78 0.80 -1.59 5.44 -0.04 -1.26 -4.50 135.00 134.63 3jyt n PRO 4 Ca -0.01 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 3jyt n PRO 4 Cb 0.50 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.53 3jyt n PRO 4 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 3jyt n ILE 5 N -1.09 3.91 -1.65 0.52 3.06 -1.26 -4.83 119.36 118.01 3jyt n ILE 5 Ca 0.21 -0.47 -0.47 0.00 -2.50 0.00 0.00 62.75 59.51 3jyt n ILE 5 Cb 0.15 -1.23 -0.05 0.00 0.54 0.00 0.00 39.64 39.06 3jyt n ILE 5 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 3jyt n GLU 6 N -1.48 1.90 -1.19 9.51 1.02 -1.26 -4.85 120.64 124.29 3jyt n GLU 6 Ca 0.14 0.68 -0.30 0.00 -0.02 0.00 0.00 57.16 57.67 3jyt n GLU 6 Cb 0.48 -2.42 0.13 0.00 -0.02 0.00 0.00 31.44 29.62 3jyt n GLU 6 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3jyt s THR 7 N 0.75 2.77 -0.12 2.62 -1.32 -1.26 -4.99 115.64 114.08 3jyt s THR 7 Ca 0.79 0.25 -0.02 0.00 -1.21 0.00 0.00 61.69 61.51 3jyt s THR 7 Cb -0.74 -2.72 -0.02 0.00 -1.51 0.00 0.00 72.50 67.51 3jyt s THR 7 CO 0.41 -0.33 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.73 3jyt s VAL 8 N -2.91 3.62 -0.44 5.08 1.01 -1.26 -5.01 120.40 120.49 3jyt s VAL 8 Ca 0.63 -0.47 -0.28 0.00 0.00 0.00 0.00 61.98 61.85 3jyt s VAL 8 Cb -0.18 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.67 3jyt s VAL 8 CO 0.57 0.53 1.47 -2.84 0.00 0.00 0.00 175.10 174.83 3jyt s PRO 9 N 0.04 3.46 -0.06 2.72 0.02 -1.26 -4.18 135.00 135.74 3jyt s PRO 9 Ca -0.01 0.89 0.03 0.00 0.02 0.00 0.00 61.00 61.93 3jyt s PRO 9 Cb -0.14 -4.08 0.01 0.00 0.02 0.00 0.00 34.50 30.31 3jyt s PRO 9 CO 0.03 -1.71 -0.15 0.14 -0.33 0.00 0.00 177.00 174.98 3jyt s VAL 10 N 5.86 1.31 0.44 3.83 -7.23 -1.26 -5.14 120.40 118.22 3jyt s VAL 10 Ca 0.62 -0.61 0.04 0.00 -1.81 0.00 0.00 61.98 60.22 3jyt s VAL 10 Cb -0.14 -1.16 0.04 0.00 0.56 0.00 0.00 36.38 35.68 3jyt s VAL 10 CO 0.31 0.39 0.33 0.29 -0.31 0.00 0.00 175.10 176.11 3jyt n LYS 11 N 3.51 0.83 -3.61 4.82 5.02 -1.26 -4.69 118.16 122.78 3jyt n LYS 11 Ca -0.20 -2.78 -0.21 0.00 -2.02 0.00 0.00 58.31 53.09 3jyt n LYS 11 Cb 0.52 0.30 -0.03 0.00 -0.02 0.00 0.00 35.03 35.80 3jyt n LYS 11 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3jyt s LEU 12 N 0.00 3.39 0.22 -0.35 1.43 -1.26 -3.01 118.68 119.10 3jyt s LEU 12 Ca 0.25 -0.75 -0.31 0.00 -1.03 0.00 0.00 54.13 52.29 3jyt s LEU 12 Cb -0.02 -2.03 -0.11 0.00 0.03 0.00 0.00 46.19 44.06 3jyt s LEU 12 CO 0.16 -0.62 1.64 -0.54 0.23 0.00 0.00 176.35 177.22 3jyt s LYS 13 N -4.11 4.15 0.04 1.70 -0.14 -0.14 -4.51 119.74 116.73 3jyt s LYS 13 Ca 0.47 2.53 -0.33 0.00 -1.36 0.00 0.00 55.97 57.28 3jyt s LYS 13 Cb -0.03 -3.08 -0.17 0.00 -1.68 0.00 0.00 37.83 32.87 3jyt s LYS 13 CO 0.27 -0.67 0.85 -2.30 -0.76 0.00 0.00 175.35 172.74 3jyt n PRO 14 N 3.46 0.00 -3.53 -1.68 -0.02 -1.26 -2.20 135.00 129.76 3jyt n PRO 14 Ca 0.13 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.45 3jyt n PRO 14 Cb 0.37 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.61 3jyt n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jyt n GLY 15 N 1.43 -1.28 3.43 -1.23 0.00 -1.26 -5.01 105.19 101.27 3jyt n GLY 15 Ca 0.17 0.57 -0.15 0.00 0.00 0.00 0.00 46.02 46.61 3jyt n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jyt s MET 16 N -4.25 0.81 0.46 1.61 -1.94 -0.94 -5.18 119.30 109.88 3jyt s MET 16 Ca 0.00 0.32 0.03 0.00 -1.71 0.00 0.00 55.69 54.34 3jyt s MET 16 Cb -0.00 0.38 0.03 0.00 2.01 0.00 0.00 34.83 37.25 3jyt s MET 16 CO 0.85 -0.20 0.25 -3.47 -0.01 0.00 0.00 175.02 172.44 3jyt n ASP 17 N 1.66 2.69 -4.78 3.03 2.03 -1.26 -4.79 116.55 115.13 3jyt n ASP 17 Ca -0.18 -2.69 -0.29 0.00 0.52 0.00 0.00 54.79 52.15 3jyt n ASP 17 Cb 0.56 0.06 0.13 0.00 -0.72 0.00 0.00 41.12 41.15 3jyt n ASP 17 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 3jyt s GLY 18 N -3.72 1.58 0.53 0.27 0.00 -1.26 -4.92 107.32 99.81 3jyt s GLY 18 Ca 0.19 -0.45 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 3jyt s GLY 18 CO 0.12 0.09 1.17 2.56 0.00 0.00 0.00 173.10 177.04 3jyt s PRO 19 N -5.23 3.36 -0.31 2.90 0.04 -1.26 -4.93 135.00 129.56 3jyt s PRO 19 Ca 0.63 1.75 0.18 0.00 0.04 0.00 0.00 61.00 63.60 3jyt s PRO 19 Cb -0.15 -2.11 0.46 0.00 0.04 0.00 0.00 34.50 32.74 3jyt s PRO 19 CO 0.54 -0.88 1.20 1.63 0.04 0.00 0.00 177.00 179.54 3jyt n LYS 20 N -1.13 1.45 -3.87 4.56 5.02 -1.12 -0.95 118.16 122.12 3jyt n LYS 20 Ca 0.11 -2.72 -0.33 0.00 -2.02 0.00 0.00 58.31 53.35 3jyt n LYS 20 Cb 0.49 -0.87 -0.05 0.00 -0.02 0.00 0.00 35.03 34.59 3jyt n LYS 20 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3jyt s VAL 21 N -2.27 5.38 0.95 -0.18 0.11 0.07 -4.84 120.40 119.62 3jyt s VAL 21 Ca 0.22 -0.15 -0.16 0.00 -2.93 0.00 0.00 61.98 58.97 3jyt s VAL 21 Cb 0.39 -3.57 0.19 0.00 -1.53 0.00 0.00 36.38 31.86 3jyt s VAL 21 CO -0.05 0.27 1.31 -0.75 -3.33 0.00 0.00 175.10 172.55 3jyt s LYS 22 N -2.10 0.74 -0.53 1.54 2.47 -1.26 -3.60 119.74 117.00 3jyt s LYS 22 Ca 0.30 -0.35 -0.17 0.00 -1.56 0.00 0.00 55.97 54.19 3jyt s LYS 22 Cb -0.13 -1.85 0.10 0.00 -1.46 0.00 0.00 37.83 34.49 3jyt s LYS 22 CO 0.21 -2.35 0.54 -1.14 0.16 0.00 0.00 175.35 172.76 3jyt s GLN 23 N -5.85 3.02 -0.15 4.03 2.00 -1.26 -4.20 119.66 117.24 3jyt s GLN 23 Ca 0.73 -1.41 -0.29 0.00 -2.00 0.00 0.00 55.36 52.38 3jyt s GLN 23 Cb -0.05 -4.22 -0.05 0.00 0.80 0.00 0.00 33.01 29.49 3jyt s GLN 23 CO 0.53 -1.29 1.94 1.67 -0.50 0.00 0.00 175.29 177.64 3jyt s TRP 24 N 2.01 1.52 0.16 1.67 1.48 -1.26 -4.87 118.94 119.64 3jyt s TRP 24 Ca 0.07 0.25 -0.12 0.00 -1.06 0.00 0.00 56.10 55.24 3jyt s TRP 24 Cb -0.26 -4.05 -0.08 0.00 -1.16 0.00 0.00 33.47 27.93 3jyt s TRP 24 CO 0.06 -4.11 0.14 -2.30 -4.06 0.00 0.00 176.95 166.67 3jyt n PRO 25 N 8.05 0.00 -4.49 3.25 -0.02 -1.26 -5.01 135.00 135.52 3jyt n PRO 25 Ca 0.23 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.48 3jyt n PRO 25 Cb 0.44 -0.50 -0.10 0.00 -0.02 0.00 0.00 33.50 33.32 3jyt n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3jyt s LEU 26 N 1.87 2.58 0.96 2.45 1.43 -1.26 -5.14 118.68 121.57 3jyt s LEU 26 Ca 0.31 -1.23 -0.11 0.00 -1.03 0.00 0.00 54.13 52.07 3jyt s LEU 26 Cb -0.38 -0.77 0.13 0.00 0.03 0.00 0.00 46.19 45.20 3jyt s LEU 26 CO 0.30 -0.33 0.93 0.35 0.23 0.00 0.00 176.35 177.83 3jyt n THR 27 N -0.70 0.00 0.95 5.49 -2.24 -1.26 -4.83 114.28 111.68 3jyt n THR 27 Ca -0.05 -0.09 0.10 0.00 -2.27 0.00 0.00 64.05 61.73 3jyt n THR 27 Cb 0.64 -0.90 0.50 0.00 -2.10 0.00 0.00 70.33 68.47 3jyt n THR 27 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3jyt n GLU 28 N -3.67 0.31 -0.08 -0.78 2.13 -1.26 -3.03 120.64 114.26 3jyt n GLU 28 Ca 0.10 0.09 -0.10 0.00 0.66 0.00 0.00 57.16 57.91 3jyt n GLU 28 Cb 0.53 -1.50 -0.06 0.00 0.27 0.00 0.00 31.44 30.68 3jyt n GLU 28 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3jyt h GLU 29 N 0.00 0.00 -0.02 5.31 4.81 -2.00 -3.29 114.58 119.39 3jyt h GLU 29 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3jyt h GLU 29 Cb 0.17 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 3jyt h GLU 29 CO 0.00 0.45 0.01 0.87 -0.73 0.00 0.00 179.01 179.61 3jyt h LYS 30 N -1.00 0.03 -0.57 1.92 1.57 -1.91 -2.70 116.57 113.92 3jyt h LYS 30 Ca -0.10 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.79 3jyt h LYS 30 Cb 0.71 -0.01 -0.11 0.00 0.08 0.00 0.00 32.23 32.90 3jyt h LYS 30 CO -0.06 0.10 -0.22 0.82 -0.57 0.00 0.00 179.45 179.52 3jyt h ILE 31 N -0.04 0.32 -1.11 1.86 2.04 -1.75 0.49 117.51 119.31 3jyt h ILE 31 Ca 0.01 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.18 3jyt h ILE 31 Cb 0.07 0.32 -0.10 0.00 -0.74 0.00 0.00 36.82 36.37 3jyt h ILE 31 CO -0.00 0.00 0.71 0.11 0.00 0.00 0.00 178.15 178.97 3jyt h LYS 32 N -0.08 0.30 0.13 2.37 1.57 -1.55 0.24 116.57 119.55 3jyt h LYS 32 Ca 0.26 -0.02 -0.30 0.00 -1.87 0.00 0.00 60.65 58.73 3jyt h LYS 32 Cb 0.49 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 3jyt h LYS 32 CO -0.62 0.20 -1.51 0.00 -0.57 0.00 0.00 179.45 176.95 3jyt h ALA 33 N 1.62 0.17 -0.89 3.86 0.00 -0.09 -2.87 119.26 121.07 3jyt h ALA 33 Ca 0.66 -1.10 0.07 0.00 0.00 0.00 0.00 54.91 54.53 3jyt h ALA 33 Cb 1.80 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 20.00 3jyt h ALA 33 CO -0.33 0.88 0.58 -0.07 0.00 0.00 0.00 179.25 180.31 3jyt h LEU 34 N -0.19 0.87 -0.77 0.00 4.07 0.98 0.40 115.31 120.68 3jyt h LEU 34 Ca -0.32 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.65 3jyt h LEU 34 Cb 1.85 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 43.41 3jyt h LEU 34 CO 0.09 0.56 -0.03 0.58 -1.08 0.00 0.00 178.44 178.56 3jyt h VAL 35 N 0.99 0.06 0.00 1.22 2.07 -0.71 -0.86 116.25 119.02 3jyt h VAL 35 Ca 0.38 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3jyt h VAL 35 Cb 0.22 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3jyt h VAL 35 CO -0.14 0.03 -0.56 -0.08 0.02 0.00 0.00 177.57 176.84 3jyt h GLU 36 N 0.00 0.00 0.00 1.57 4.81 -0.23 -3.24 114.58 117.49 3jyt h GLU 36 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3jyt h GLU 36 Cb 0.76 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.14 3jyt h GLU 36 CO 0.00 0.00 -0.27 -0.89 -0.73 0.00 0.00 179.01 177.13 3jyt n ILE 37 N -2.63 0.67 -0.38 2.32 5.41 0.10 -4.17 119.36 120.69 3jyt n ILE 37 Ca 0.02 0.36 0.32 0.00 1.00 0.00 0.00 62.75 64.46 3jyt n ILE 37 Cb 0.51 -1.92 0.64 0.00 -0.71 0.00 0.00 39.64 38.16 3jyt n ILE 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3jyt h THR 39 N 0.17 0.38 -0.03 0.00 2.02 -1.75 0.87 112.91 114.57 3jyt h THR 39 Ca 0.66 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.81 3jyt h THR 39 Cb 2.16 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 3jyt h THR 39 CO -0.21 0.00 -0.09 -0.08 0.37 0.00 0.00 175.52 175.52 3jyt h GLU 40 N -0.27 0.12 -0.60 6.66 4.57 0.53 -2.26 114.58 123.32 3jyt h GLU 40 Ca 0.13 -0.08 0.11 0.00 -1.18 0.00 0.00 59.36 58.34 3jyt h GLU 40 Cb 0.47 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.99 3jyt h GLU 40 CO -0.38 0.69 0.15 1.98 -1.18 0.00 0.00 179.01 180.27 3jyt h MET 41 N -0.44 0.29 -0.29 1.92 4.05 0.69 0.44 114.93 121.59 3jyt h MET 41 Ca -0.00 -0.02 -0.17 0.00 -0.28 0.00 0.00 59.70 59.24 3jyt h MET 41 Cb 0.69 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.42 3jyt h MET 41 CO 0.02 0.19 -0.46 1.49 0.23 0.00 0.00 176.91 178.37 3jyt h GLU 42 N 0.30 0.83 -0.41 0.39 4.22 0.68 0.17 114.58 120.76 3jyt h GLU 42 Ca 0.31 -0.50 0.05 0.00 0.08 0.00 0.00 59.36 59.30 3jyt h GLU 42 Cb 0.45 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 3jyt h GLU 42 CO -0.38 1.14 0.27 -0.22 -2.18 0.00 0.00 179.01 177.64 3jyt h LYS 43 N 0.61 0.33 -0.13 1.92 3.11 -0.60 0.23 116.57 122.03 3jyt h LYS 43 Ca 0.03 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 3jyt h LYS 43 Cb 1.07 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 32.22 3jyt h LYS 43 CO 0.11 0.22 0.00 0.39 -2.81 0.00 0.00 179.45 177.35 3jyt n GLU 44 N -4.48 1.82 -0.99 1.90 1.02 0.14 -4.94 120.64 115.11 3jyt n GLU 44 Ca 0.05 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.97 3jyt n GLU 44 Cb 0.23 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 3jyt n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3jyt n GLY 45 N 1.19 0.48 0.21 0.62 0.00 0.80 -4.87 105.19 103.62 3jyt n GLY 45 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 3jyt n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jyt h LYS 46 N 1.08 0.00 -2.64 1.61 1.79 -0.90 -3.44 116.57 114.06 3jyt h LYS 46 Ca 0.00 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.36 3jyt h LYS 46 Cb 0.13 0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 30.54 3jyt h LYS 46 CO 0.00 0.00 -0.22 0.96 -1.08 0.00 0.00 179.45 179.11 3jyt s ILE 47 N -3.45 -0.01 -0.07 1.86 -4.36 -1.22 -0.85 121.20 113.10 3jyt s ILE 47 Ca 0.04 0.03 -0.02 0.00 -0.26 0.00 0.00 60.65 60.43 3jyt s ILE 47 Cb 0.09 -0.63 -0.04 0.00 1.25 0.00 0.00 42.46 43.14 3jyt s ILE 47 CO 0.52 0.01 0.04 -0.44 0.24 0.00 0.00 174.94 175.31 3jyt s SER 48 N 0.60 5.51 1.03 4.36 0.01 -0.66 -4.21 113.70 120.33 3jyt s SER 48 Ca -0.03 0.19 -0.12 0.00 1.31 0.00 0.00 55.95 57.30 3jyt s SER 48 Cb -0.05 -1.59 0.21 0.00 0.21 0.00 0.00 66.02 64.80 3jyt s SER 48 CO -0.04 0.36 1.07 -0.54 0.41 0.00 0.00 173.24 174.50 3jyt s LYS 49 N -1.13 0.17 0.13 12.44 1.02 -1.26 -1.05 119.74 130.06 3jyt s LYS 49 Ca 0.16 0.87 -0.07 0.00 0.02 0.00 0.00 55.97 56.96 3jyt s LYS 49 Cb -0.12 -1.68 -0.02 0.00 -0.52 0.00 0.00 37.83 35.50 3jyt s LYS 49 CO 0.05 -3.00 0.19 0.96 -0.92 0.00 0.00 175.35 172.64 3jyt s ILE 50 N -2.71 0.10 0.00 2.17 -4.36 -0.34 -4.73 121.20 111.33 3jyt s ILE 50 Ca 0.66 -1.48 0.00 0.00 -0.26 0.00 0.00 60.65 59.58 3jyt s ILE 50 Cb -0.22 -1.74 0.00 0.00 1.25 0.00 0.00 42.46 41.75 3jyt s ILE 50 CO 0.60 -0.47 0.00 0.61 0.24 0.00 0.00 174.94 175.93 3jyt n GLY 51 N -0.13 5.80 0.26 6.27 0.00 -1.26 -4.56 105.19 111.56 3jyt n GLY 51 Ca -0.09 -1.80 0.10 0.00 0.00 0.00 0.00 46.02 44.24 3jyt n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3jyt h PRO 52 N 0.00 0.00 0.00 1.61 0.13 -2.02 -2.98 132.00 128.74 3jyt h PRO 52 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3jyt h PRO 52 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3jyt h PRO 52 CO 0.00 0.09 0.00 -0.85 -0.23 0.00 0.00 178.00 177.01 3jyt n GLU 53 N -4.03 0.08 -3.39 0.86 0.00 -1.26 -4.28 120.64 108.61 3jyt n GLU 53 Ca -0.02 0.26 -0.44 0.00 0.00 0.00 0.00 57.16 56.95 3jyt n GLU 53 Cb 0.18 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.06 3jyt n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3jyt s ASN 54 N -2.67 6.12 0.50 -1.84 3.84 -1.13 -4.96 114.94 114.80 3jyt s ASN 54 Ca 0.06 -2.01 0.33 0.00 0.21 0.00 0.00 52.86 51.45 3jyt s ASN 54 Cb 0.04 -2.14 1.61 0.00 -0.55 0.00 0.00 41.25 40.21 3jyt s ASN 54 CO 0.11 -0.75 2.00 1.55 -2.79 0.00 0.00 177.10 177.22 3jyt h PRO 55 N 8.52 0.00 -6.30 0.43 0.13 -1.89 -3.46 132.00 129.43 3jyt h PRO 55 Ca -0.20 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.48 3jyt h PRO 55 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 3jyt h PRO 55 CO 0.93 0.00 -0.36 0.71 -0.23 0.00 0.00 178.00 179.05 3jyt s TYR 56 N -3.74 3.06 -0.26 1.56 2.02 -1.26 -4.88 117.35 113.85 3jyt s TYR 56 Ca -0.01 -0.24 -0.27 0.00 -0.37 0.00 0.00 57.07 56.18 3jyt s TYR 56 Cb 0.10 -1.96 0.15 0.00 -0.40 0.00 0.00 41.96 39.85 3jyt s TYR 56 CO 0.41 0.02 1.18 1.21 -1.57 0.00 0.00 175.55 176.80 3jyt s ASN 57 N -4.14 -0.27 0.02 2.29 3.84 -0.13 -4.67 114.94 111.88 3jyt s ASN 57 Ca 0.44 0.44 -0.04 0.00 0.21 0.00 0.00 52.86 53.91 3jyt s ASN 57 Cb -0.09 0.42 -0.01 0.00 -0.55 0.00 0.00 41.25 41.02 3jyt s ASN 57 CO 0.30 -0.15 0.05 0.28 -2.79 0.00 0.00 177.10 174.80 3jyt s THR 58 N -0.33 0.11 0.68 -5.21 -1.32 0.82 -0.75 115.64 109.64 3jyt s THR 58 Ca 0.04 -0.90 -0.11 0.00 -1.21 0.00 0.00 61.69 59.51 3jyt s THR 58 Cb -0.03 -0.49 -0.00 0.00 -1.51 0.00 0.00 72.50 70.47 3jyt s THR 58 CO -0.07 -0.50 1.06 -2.16 -2.21 0.00 0.00 174.62 170.74 3jyt s PRO 59 N -1.74 3.05 0.20 7.08 0.04 -1.26 -4.02 135.00 138.35 3jyt s PRO 59 Ca -0.13 0.74 -0.05 0.00 0.04 0.00 0.00 61.00 61.61 3jyt s PRO 59 Cb -0.07 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 3jyt s PRO 59 CO -0.01 -0.96 0.22 0.14 0.04 0.00 0.00 177.00 176.43 3jyt s VAL 60 N -3.17 0.02 0.00 -0.36 -7.23 -1.26 -0.51 120.40 107.89 3jyt s VAL 60 Ca 0.57 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.98 3jyt s VAL 60 Cb -0.12 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.54 3jyt s VAL 60 CO 0.54 -0.11 0.00 2.22 -0.31 0.00 0.00 175.10 177.44 3jyt n PHE 61 N -0.26 -0.71 -4.16 2.82 -1.74 -0.29 -4.93 117.46 108.18 3jyt n PHE 61 Ca -0.01 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.78 3jyt n PHE 61 Cb 0.64 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.54 3jyt n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3jyt s ALA 62 N -1.23 0.93 -0.02 1.98 0.00 -1.26 -1.57 121.76 120.59 3jyt s ALA 62 Ca 0.00 -1.40 -0.09 0.00 0.00 0.00 0.00 51.96 50.47 3jyt s ALA 62 Cb 0.00 0.43 0.01 0.00 0.00 0.00 0.00 23.12 23.57 3jyt s ALA 62 CO 0.00 -0.34 0.20 0.42 0.00 0.00 0.00 175.76 176.04 3jyt s ILE 63 N -3.80 0.06 0.44 0.00 1.01 -0.58 -4.93 121.20 113.40 3jyt s ILE 63 Ca 0.16 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.32 3jyt s ILE 63 Cb 0.07 -0.46 -0.00 0.00 0.01 0.00 0.00 42.46 42.07 3jyt s ILE 63 CO -0.03 -0.28 0.64 -0.54 0.00 0.00 0.00 174.94 174.74 3jyt s LYS 64 N -1.09 3.05 0.41 2.79 -0.14 -1.26 0.26 119.74 123.77 3jyt s LYS 64 Ca -0.12 -0.58 0.04 0.00 -1.36 0.00 0.00 55.97 53.95 3jyt s LYS 64 Cb -0.06 -2.60 -0.05 0.00 -1.68 0.00 0.00 37.83 33.44 3jyt s LYS 64 CO 0.02 -0.23 0.04 1.03 -0.76 0.00 0.00 175.35 175.45 3jyt s ARG 65 N -4.50 1.94 -0.50 1.68 0.52 -1.17 -4.83 118.95 112.09 3jyt s ARG 65 Ca 0.48 -2.15 -0.33 0.00 -0.52 0.00 0.00 55.73 53.21 3jyt s ARG 65 Cb -0.10 -1.25 -0.13 0.00 0.52 0.00 0.00 34.95 33.99 3jyt s ARG 65 CO 0.37 -0.23 2.32 1.63 0.02 0.00 0.00 175.30 179.40 3jyt n LYS 66 N -0.96 0.80 -4.22 3.54 4.76 -1.26 -1.89 118.16 118.93 3jyt n LYS 66 Ca -0.08 0.17 -0.39 0.00 -2.87 0.00 0.00 58.31 55.14 3jyt n LYS 66 Cb 0.67 -2.40 -0.04 0.00 -1.84 0.00 0.00 35.03 31.41 3jyt n LYS 66 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3jyt n ASP 67 N 10.90 -1.35 -3.91 4.39 2.03 -1.26 -4.94 116.55 122.41 3jyt n ASP 67 Ca 0.46 -1.30 -0.17 0.00 0.52 0.00 0.00 54.79 54.30 3jyt n ASP 67 Cb 0.23 -1.58 -0.15 0.00 -0.72 0.00 0.00 41.12 38.89 3jyt n ASP 67 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3jyt s SER 68 N -4.00 0.64 0.00 1.67 0.15 -0.79 -4.98 113.70 106.40 3jyt s SER 68 Ca 0.23 -0.09 0.13 0.00 0.70 0.00 0.00 55.95 56.92 3jyt s SER 68 Cb -0.13 -0.21 0.58 0.00 -1.71 0.00 0.00 66.02 64.56 3jyt s SER 68 CO 0.99 -0.01 1.39 0.41 1.20 0.00 0.00 173.24 177.22 3jyt n THR 69 N 3.53 0.97 -2.98 6.45 -1.04 -1.26 -4.10 114.28 115.85 3jyt n THR 69 Ca -0.20 0.24 -0.35 0.00 -2.04 0.00 0.00 64.05 61.71 3jyt n THR 69 Cb 0.54 -1.02 -0.06 0.00 -1.82 0.00 0.00 70.33 67.97 3jyt n THR 69 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3jyt s LYS 70 N -2.86 4.26 0.13 -2.82 2.20 -1.26 -5.02 119.74 114.37 3jyt s LYS 70 Ca 0.08 0.98 0.09 0.00 -0.36 0.00 0.00 55.97 56.76 3jyt s LYS 70 Cb 0.09 -2.60 -0.04 0.00 -1.51 0.00 0.00 37.83 33.77 3jyt s LYS 70 CO 0.22 0.22 -0.15 -1.58 -0.36 0.00 0.00 175.35 173.70 3jyt s TRP 71 N -1.80 2.60 -0.15 4.03 0.52 -1.26 -3.02 118.94 119.86 3jyt s TRP 71 Ca 0.52 -0.23 -0.05 0.00 0.02 0.00 0.00 56.10 56.36 3jyt s TRP 71 Cb -0.14 -1.35 -0.03 0.00 -1.15 0.00 0.00 33.47 30.80 3jyt s TRP 71 CO 0.19 0.42 0.01 0.50 0.02 0.00 0.00 176.95 178.09 3jyt s ARG 72 N -2.30 3.66 -0.25 4.98 3.52 0.14 -4.89 118.95 123.81 3jyt s ARG 72 Ca 0.20 -0.43 -0.13 0.00 -0.13 0.00 0.00 55.73 55.24 3jyt s ARG 72 Cb -0.10 -3.00 -0.04 0.00 -1.56 0.00 0.00 34.95 30.24 3jyt s ARG 72 CO 0.12 0.34 0.30 0.21 -0.81 0.00 0.00 175.30 175.46 3jyt s LYS 73 N 0.12 4.05 0.22 5.12 2.20 -1.26 -1.53 119.74 128.66 3jyt s LYS 73 Ca 0.02 -0.07 0.10 0.00 -0.36 0.00 0.00 55.97 55.66 3jyt s LYS 73 Cb -0.13 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.54 3jyt s LYS 73 CO 0.02 -0.14 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.22 3jyt s LEU 74 N 1.64 2.79 -0.10 5.43 1.43 -0.61 -4.56 118.68 124.71 3jyt s LEU 74 Ca 0.13 -0.76 0.03 0.00 -1.03 0.00 0.00 54.13 52.49 3jyt s LEU 74 Cb -0.15 -1.42 0.01 0.00 0.03 0.00 0.00 46.19 44.65 3jyt s LEU 74 CO 0.09 0.08 -0.18 -0.69 0.23 0.00 0.00 176.35 175.88 3jyt s VAL 75 N -1.98 1.61 -1.18 -1.59 1.01 -0.95 -1.14 120.40 116.18 3jyt s VAL 75 Ca 0.26 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.35 3jyt s VAL 75 Cb -0.07 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3jyt s VAL 75 CO 0.15 0.46 2.19 -0.67 0.00 0.00 0.00 175.10 177.23 3jyt n ASP 76 N 3.88 4.03 -0.38 3.32 -0.08 0.33 -4.66 116.55 122.99 3jyt n ASP 76 Ca -0.20 -2.70 0.00 0.00 -1.51 0.00 0.00 54.79 50.37 3jyt n ASP 76 Cb 0.52 -1.40 0.00 0.00 2.34 0.00 0.00 41.12 42.58 3jyt n ASP 76 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3jyt n PHE 77 N 6.12 0.00 -0.27 -0.67 3.01 -1.26 -4.34 117.46 120.05 3jyt n PHE 77 Ca 0.53 0.00 0.03 0.00 1.01 0.00 0.00 57.45 59.02 3jyt n PHE 77 Cb 0.35 -0.06 0.11 0.00 -0.01 0.00 0.00 39.48 39.87 3jyt n PHE 77 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3jyt h ARG 78 N 0.18 0.02 0.69 -1.08 3.08 -1.87 -0.54 114.38 114.85 3jyt h ARG 78 Ca 0.00 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3jyt h ARG 78 Cb 0.30 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.35 3jyt h ARG 78 CO 0.00 0.01 -0.33 0.93 -1.07 0.00 0.00 179.97 179.51 3jyt h GLU 79 N 0.02 -0.89 -0.85 0.04 4.39 -2.01 -2.89 114.58 112.39 3jyt h GLU 79 Ca 0.39 0.06 0.16 0.00 0.34 0.00 0.00 59.36 60.31 3jyt h GLU 79 Cb 0.62 0.20 -0.16 0.00 -0.10 0.00 0.00 28.75 29.31 3jyt h GLU 79 CO -0.77 -0.59 -0.27 1.25 -1.16 0.00 0.00 179.01 177.46 3jyt h LEU 80 N -0.98 -0.99 -0.60 1.33 5.85 -1.77 0.30 115.31 118.45 3jyt h LEU 80 Ca -0.09 0.27 0.12 0.00 0.84 0.00 0.00 57.88 59.02 3jyt h LEU 80 Cb 0.71 0.59 -0.11 0.00 0.37 0.00 0.00 40.66 42.22 3jyt h LEU 80 CO 0.15 -0.29 -0.05 0.78 -0.34 0.00 0.00 178.44 178.69 3jyt h ASN 81 N -0.02 -0.37 -0.56 1.25 2.35 -1.08 1.27 115.58 118.41 3jyt h ASN 81 Ca 0.38 0.16 0.10 0.00 -0.55 0.00 0.00 56.30 56.39 3jyt h ASN 81 Cb 0.62 0.30 -0.08 0.00 0.05 0.00 0.00 38.32 39.21 3jyt h ASN 81 CO -0.88 -0.14 0.12 0.11 -1.65 0.00 0.00 177.43 174.98 3jyt h LYS 82 N 0.07 0.25 -0.00 0.81 1.57 -0.22 0.05 116.57 119.10 3jyt h LYS 82 Ca 0.31 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 3jyt h LYS 82 Cb 0.49 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3jyt h LYS 82 CO -0.55 0.16 -0.13 0.54 -0.57 0.00 0.00 179.45 178.90 3jyt n ARG 83 N -5.12 0.50 -3.28 3.15 1.74 0.49 -4.86 116.66 109.28 3jyt n ARG 83 Ca 0.08 -0.16 -0.37 0.00 -0.77 0.00 0.00 57.85 56.63 3jyt n ARG 83 Cb 0.29 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.18 3jyt n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3jyt s THR 84 N -2.61 4.76 1.10 0.55 2.01 0.41 -0.97 115.64 120.89 3jyt s THR 84 Ca 0.25 1.05 -0.16 0.00 0.31 0.00 0.00 61.69 63.15 3jyt s THR 84 Cb 0.20 -3.82 0.15 0.00 0.01 0.00 0.00 72.50 69.04 3jyt s THR 84 CO 0.51 0.35 0.41 0.00 -0.69 0.00 0.00 174.62 175.20 3jyt n GLN 85 N 1.13 -1.62 -5.09 4.92 10.64 -1.16 -4.54 117.38 121.65 3jyt n GLN 85 Ca -0.07 -0.45 -0.31 0.00 -1.83 0.00 0.00 57.00 54.35 3jyt n GLN 85 Cb 0.51 -1.89 -0.15 0.00 -0.86 0.00 0.00 30.24 27.85 3jyt n GLN 85 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 3jyt s ASP 86 N -2.07 3.28 0.49 2.61 1.47 -1.26 -4.94 116.67 116.25 3jyt s ASP 86 Ca 0.60 -0.46 0.08 0.00 1.18 0.00 0.00 52.55 53.95 3jyt s ASP 86 Cb -0.18 -0.42 0.04 0.00 -0.34 0.00 0.00 42.92 42.02 3jyt s ASP 86 CO 0.66 0.30 0.62 -0.36 0.68 0.00 0.00 175.17 177.07 3jyt s PHE 87 N -0.71 2.16 -0.43 2.11 0.40 -1.26 -5.08 117.98 115.17 3jyt s PHE 87 Ca 0.11 -0.57 -0.12 0.00 -0.60 0.00 0.00 56.93 55.75 3jyt s PHE 87 Cb -0.10 -2.25 0.06 0.00 0.51 0.00 0.00 43.02 41.24 3jyt s PHE 87 CO 0.01 -0.68 0.30 -0.46 0.70 0.00 0.00 175.22 175.08 3jyt s TRP 88 N -2.52 3.28 0.15 0.36 -0.11 -1.26 -5.04 118.94 113.80 3jyt s TRP 88 Ca 0.55 -1.12 -0.34 0.00 1.22 0.00 0.00 56.10 56.41 3jyt s TRP 88 Cb -0.07 -2.88 -0.14 0.00 -1.50 0.00 0.00 33.47 28.88 3jyt s TRP 88 CO 0.34 -0.76 1.55 -1.91 -4.62 0.00 0.00 176.95 171.55 3jyt n GLU 89 N 5.05 2.04 0.01 5.86 4.07 -1.26 -4.89 120.64 131.52 3jyt n GLU 89 Ca -0.11 0.74 0.11 0.00 -0.06 0.00 0.00 57.16 57.83 3jyt n GLU 89 Cb 0.44 -2.49 -0.07 0.00 -0.06 0.00 0.00 31.44 29.26 3jyt n GLU 89 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 3jyt n VAL 90 N 3.32 0.05 -2.46 6.31 3.14 -1.26 -4.76 118.33 122.67 3jyt n VAL 90 Ca 0.17 -0.17 -0.39 0.00 -2.96 0.00 0.00 64.34 61.00 3jyt n VAL 90 Cb 0.28 0.53 -0.03 0.00 -1.06 0.00 0.00 33.84 33.55 3jyt n VAL 90 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 3jyt s GLN 91 N -3.16 3.35 0.05 1.45 2.00 -1.26 -4.88 119.66 117.20 3jyt s GLN 91 Ca 0.04 -0.83 -0.27 0.00 -2.00 0.00 0.00 55.36 52.30 3jyt s GLN 91 Cb 0.15 -5.15 -0.17 0.00 0.80 0.00 0.00 33.01 28.65 3jyt s GLN 91 CO 0.85 -2.41 1.51 -0.07 -0.50 0.00 0.00 175.29 174.67 3jyt h LEU 92 N 13.75 -0.33 0.00 3.68 3.38 -2.02 -3.48 115.31 130.29 3jyt h LEU 92 Ca 0.11 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3jyt h LEU 92 Cb 1.02 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3jyt h LEU 92 CO 1.37 -0.11 0.00 0.61 0.09 0.00 0.00 178.44 180.40 3jyt n GLY 93 N -0.85 5.13 2.92 0.83 0.00 -1.26 -5.18 105.19 106.78 3jyt n GLY 93 Ca -0.10 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.12 3jyt n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jyt s ILE 94 N 1.90 0.03 0.69 -0.61 1.01 -1.26 -5.15 121.20 117.81 3jyt s ILE 94 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 3jyt s ILE 94 Cb 0.00 -0.10 0.01 0.00 0.01 0.00 0.00 42.46 42.38 3jyt s ILE 94 CO 0.00 -0.12 1.07 -2.16 0.00 0.00 0.00 174.94 173.74 3jyt s PRO 95 N -0.34 2.81 -0.07 2.79 0.04 -1.26 -5.05 135.00 133.93 3jyt s PRO 95 Ca -0.04 1.11 -0.01 0.00 0.04 0.00 0.00 61.00 62.10 3jyt s PRO 95 Cb -0.02 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.57 3jyt s PRO 95 CO -0.00 -1.21 0.00 -1.58 0.04 0.00 0.00 177.00 174.25 3jyt s HIS 96 N -2.81 0.63 0.12 0.56 2.46 -1.26 -5.04 115.29 109.95 3jyt s HIS 96 Ca 0.61 -0.14 -0.10 0.00 0.47 0.00 0.00 55.06 55.90 3jyt s HIS 96 Cb -0.16 -0.77 0.11 0.00 -0.13 0.00 0.00 32.58 31.63 3jyt s HIS 96 CO 0.50 -0.31 0.83 -0.35 -2.47 0.00 0.00 174.74 172.94 3jyt n PRO 97 N 5.09 -0.14 0.05 2.88 -0.04 -1.26 0.25 135.00 141.83 3jyt n PRO 97 Ca -0.08 0.82 0.02 0.00 -0.04 0.00 0.00 63.50 64.22 3jyt n PRO 97 Cb 0.50 -1.22 0.09 0.00 -0.04 0.00 0.00 33.50 32.83 3jyt n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3jyt n ALA 98 N -3.70 0.51 0.23 0.55 0.00 -1.26 0.10 120.51 116.94 3jyt n ALA 98 Ca 0.05 0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.62 3jyt n ALA 98 Cb 0.21 -0.55 0.18 0.00 0.00 0.00 0.00 19.45 19.28 3jyt n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jyt n GLY 99 N -1.26 1.60 3.80 0.00 0.00 0.70 -4.07 105.19 105.96 3jyt n GLY 99 Ca -0.00 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 3jyt n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jyt s LEU 100 N -1.29 4.39 0.11 0.99 1.43 0.28 -4.88 118.68 119.72 3jyt s LEU 100 Ca 0.32 1.57 -0.02 0.00 -1.03 0.00 0.00 54.13 54.96 3jyt s LEU 100 Cb 0.19 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 3jyt s LEU 100 CO 0.26 0.04 0.30 -0.54 0.23 0.00 0.00 176.35 176.64 3jyt s LYS 101 N -1.83 3.53 0.12 1.70 1.02 -1.26 -1.08 119.74 121.93 3jyt s LYS 101 Ca 0.43 -0.26 -0.31 0.00 0.02 0.00 0.00 55.97 55.85 3jyt s LYS 101 Cb -0.18 -2.94 -0.09 0.00 -0.52 0.00 0.00 37.83 34.09 3jyt s LYS 101 CO 0.23 0.53 1.67 0.21 -0.92 0.00 0.00 175.35 177.07 3jyt s LYS 102 N -2.60 4.18 0.17 1.68 2.47 -1.25 -4.89 119.74 119.49 3jyt s LYS 102 Ca 0.38 2.42 0.11 0.00 -1.56 0.00 0.00 55.97 57.31 3jyt s LYS 102 Cb -0.12 -3.44 -0.04 0.00 -1.46 0.00 0.00 37.83 32.77 3jyt s LYS 102 CO 0.26 -0.72 -0.22 0.15 0.16 0.00 0.00 175.35 174.98 3jyt s LYS 103 N 2.15 1.60 0.45 4.03 -0.14 -1.26 -5.02 119.74 121.55 3jyt s LYS 103 Ca 0.74 -1.40 0.25 0.00 -1.36 0.00 0.00 55.97 54.20 3jyt s LYS 103 Cb -0.43 -1.94 0.89 0.00 -1.68 0.00 0.00 37.83 34.67 3jyt s LYS 103 CO 0.33 0.43 1.81 -0.22 -0.76 0.00 0.00 175.35 176.93 3jyt h LYS 104 N 3.39 0.00 -2.41 1.68 1.63 -1.78 -3.44 116.57 115.64 3jyt h LYS 104 Ca -0.48 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.26 3jyt h LYS 104 Cb 1.19 0.00 -0.25 0.00 -0.60 0.00 0.00 32.23 32.57 3jyt h LYS 104 CO 0.46 0.18 -0.23 -1.12 -3.45 0.00 0.00 179.45 175.29 3jyt s SER 105 N -6.12 -0.60 0.15 4.20 0.01 0.15 -4.84 113.70 106.66 3jyt s SER 105 Ca 0.02 1.12 0.09 0.00 1.31 0.00 0.00 55.95 58.49 3jyt s SER 105 Cb 0.09 1.22 -0.04 0.00 0.21 0.00 0.00 66.02 67.50 3jyt s SER 105 CO 0.63 -0.22 -0.20 -0.69 0.41 0.00 0.00 173.24 173.17 3jyt s VAL 106 N 1.94 1.90 0.09 3.43 1.01 -1.26 0.27 120.40 127.78 3jyt s VAL 106 Ca -0.07 -1.85 -0.09 0.00 0.00 0.00 0.00 61.98 59.98 3jyt s VAL 106 Cb -0.09 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.45 3jyt s VAL 106 CO -0.15 -0.21 0.19 -0.89 0.00 0.00 0.00 175.10 174.04 3jyt s THR 107 N -1.74 0.14 -0.02 3.92 2.01 0.09 -4.88 115.64 115.16 3jyt s THR 107 Ca 0.14 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 60.98 3jyt s THR 107 Cb -0.07 -1.32 0.02 0.00 0.01 0.00 0.00 72.50 71.14 3jyt s THR 107 CO 0.07 -0.64 -0.00 -0.69 -0.69 0.00 0.00 174.62 172.66 3jyt s VAL 108 N -3.80 0.14 0.03 3.82 1.01 -1.00 -0.82 120.40 119.78 3jyt s VAL 108 Ca 0.04 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.11 3jyt s VAL 108 Cb 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.21 3jyt s VAL 108 CO -0.11 0.10 -0.12 -0.76 0.00 0.00 0.00 175.10 174.21 3jyt s LEU 109 N 0.65 2.17 -0.29 3.92 1.43 0.44 -1.76 118.68 125.24 3jyt s LEU 109 Ca -0.06 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 3jyt s LEU 109 Cb -0.09 -0.51 0.09 0.00 0.03 0.00 0.00 46.19 45.71 3jyt s LEU 109 CO -0.01 0.00 0.04 -0.62 0.23 0.00 0.00 176.35 175.99 3jyt s ASP 110 N -1.09 4.10 0.21 2.29 3.68 -1.26 -0.05 116.67 124.55 3jyt s ASP 110 Ca -0.00 -1.58 -0.32 0.00 2.13 0.00 0.00 52.55 52.78 3jyt s ASP 110 Cb -0.08 -1.14 -0.15 0.00 -1.45 0.00 0.00 42.92 40.11 3jyt s ASP 110 CO 0.01 -0.35 1.21 0.52 0.13 0.00 0.00 175.17 176.70 3jyt n VAL 111 N 4.66 1.09 -3.15 1.11 0.31 -1.14 -4.41 118.33 116.80 3jyt n VAL 111 Ca -0.04 -0.27 -0.37 0.00 -0.01 0.00 0.00 64.34 63.65 3jyt n VAL 111 Cb 0.43 -1.06 -0.06 0.00 -0.91 0.00 0.00 33.84 32.24 3jyt n VAL 111 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3jyt s GLY 112 N -0.01 2.68 -1.37 2.92 0.00 0.18 -4.04 107.32 107.69 3jyt s GLY 112 Ca 0.69 0.14 -0.13 0.00 0.00 0.00 0.00 44.72 45.42 3jyt s GLY 112 CO 0.53 0.54 0.38 1.22 0.00 0.00 0.00 173.10 175.77 3jyt n ASP 113 N 1.18 -1.55 0.00 1.64 8.00 -1.26 -4.59 116.55 119.96 3jyt n ASP 113 Ca -0.05 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.24 3jyt n ASP 113 Cb 0.50 -2.09 0.00 0.00 -0.02 0.00 0.00 41.12 39.52 3jyt n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3jyt n ALA 114 N -4.66 -0.06 -0.16 2.24 0.00 -1.26 -2.80 120.51 113.81 3jyt n ALA 114 Ca -0.23 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.16 3jyt n ALA 114 Cb 0.64 0.24 0.02 0.00 0.00 0.00 0.00 19.45 20.35 3jyt n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3jyt h TYR 115 N 0.00 -0.62 0.00 0.00 -1.99 -1.88 -0.63 116.97 111.85 3jyt h TYR 115 Ca 0.00 0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.79 3jyt h TYR 115 Cb 0.00 0.35 0.00 0.00 2.00 0.00 0.00 36.73 39.08 3jyt h TYR 115 CO -0.24 -0.32 0.00 1.19 -0.00 0.00 0.00 178.16 178.79 3jyt n PHE 116 N -5.41 0.00 0.54 4.88 0.99 -1.15 -0.05 117.46 117.27 3jyt n PHE 116 Ca 0.04 0.00 0.07 0.00 -0.00 0.00 0.00 57.45 57.56 3jyt n PHE 116 Cb 0.32 0.00 -0.09 0.00 -1.00 0.00 0.00 39.48 38.71 3jyt n PHE 116 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 3jyt n SER 117 N -0.73 0.87 -4.53 4.37 7.64 -0.24 -4.80 113.62 116.19 3jyt n SER 117 Ca 0.00 -0.67 -0.37 0.00 1.01 0.00 0.00 58.87 58.84 3jyt n SER 117 Cb 0.00 1.14 -0.12 0.00 -1.01 0.00 0.00 64.21 64.23 3jyt n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3jyt s VAL 118 N -2.51 4.92 0.16 0.44 1.01 0.93 -0.43 120.40 124.92 3jyt s VAL 118 Ca 0.03 0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.72 3jyt s VAL 118 Cb 0.11 -3.34 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 3jyt s VAL 118 CO 0.60 0.28 1.71 -2.16 0.00 0.00 0.00 175.10 175.53 3jyt s PRO 119 N 1.70 4.16 0.30 2.72 0.04 -1.26 0.02 135.00 142.67 3jyt s PRO 119 Ca 0.07 2.52 -0.21 0.00 0.04 0.00 0.00 61.00 63.42 3jyt s PRO 119 Cb -0.16 -3.30 -0.09 0.00 0.04 0.00 0.00 34.50 30.99 3jyt s PRO 119 CO 0.08 -0.74 0.82 -1.17 0.04 0.00 0.00 177.00 176.03 3jyt s LEU 120 N 1.78 4.23 0.21 -3.56 2.96 -0.17 -4.44 118.68 119.69 3jyt s LEU 120 Ca 0.75 1.55 -0.31 0.00 -0.22 0.00 0.00 54.13 55.90 3jyt s LEU 120 Cb -0.46 -3.94 -0.11 0.00 0.50 0.00 0.00 46.19 42.18 3jyt s LEU 120 CO 0.33 -0.10 1.61 1.51 -1.32 0.00 0.00 176.35 178.38 3jyt s ASP 121 N -1.84 6.48 0.51 3.68 -4.77 -1.26 -4.74 116.67 114.74 3jyt s ASP 121 Ca 0.50 2.77 0.43 0.00 -3.30 0.00 0.00 52.55 52.95 3jyt s ASP 121 Cb -0.15 -2.61 1.64 0.00 -1.09 0.00 0.00 42.92 40.72 3jyt s ASP 121 CO 0.20 -0.88 1.58 -0.08 0.70 0.00 0.00 175.17 176.69 3jyt h GLU 122 N 6.21 0.00 0.12 2.11 4.57 -1.94 -1.72 114.58 123.93 3jyt h GLU 122 Ca -0.44 -0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.49 3jyt h GLU 122 Cb 1.21 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 3jyt h GLU 122 CO 0.89 0.00 -1.22 -0.44 -1.18 0.00 0.00 179.01 177.06 3jyt h ASP 123 N 0.00 0.39 -0.08 1.04 3.32 -1.96 -3.37 116.42 115.76 3jyt h ASP 123 Ca 0.92 -0.87 -0.09 0.00 0.02 0.00 0.00 57.03 57.01 3jyt h ASP 123 Cb 3.39 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 42.80 3jyt h ASP 123 CO -0.20 1.54 -0.21 0.15 -1.72 0.00 0.00 179.24 178.81 3jyt h PHE 124 N -0.36 0.54 -0.91 4.55 3.57 -1.61 -3.20 116.94 119.52 3jyt h PHE 124 Ca -0.26 -0.10 0.32 0.00 3.53 0.00 0.00 57.97 61.46 3jyt h PHE 124 Cb 1.70 -0.14 -0.10 0.00 2.79 0.00 0.00 35.95 40.21 3jyt h PHE 124 CO 0.15 0.66 0.58 0.54 -2.23 0.00 0.00 178.31 178.01 3jyt n ARG 125 N -4.15 -0.03 0.01 1.11 1.74 -0.87 -0.15 116.66 114.32 3jyt n ARG 125 Ca -0.00 0.85 0.22 0.00 -0.77 0.00 0.00 57.85 58.15 3jyt n ARG 125 Cb 0.38 -1.66 0.73 0.00 -1.02 0.00 0.00 32.46 30.88 3jyt n ARG 125 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3jyt h LYS 126 N 0.00 0.00 0.00 5.56 1.57 -1.81 -2.53 116.57 119.36 3jyt h LYS 126 Ca 0.59 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.23 3jyt h LYS 126 Cb 1.89 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.17 3jyt h LYS 126 CO -0.32 0.00 -1.24 1.88 -0.57 0.00 0.00 179.45 179.20 3jyt h TYR 127 N 0.00 0.00 0.00 -1.35 0.05 -0.84 -3.34 116.97 111.49 3jyt h TYR 127 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.04 3jyt h TYR 127 Cb 1.20 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.94 3jyt h TYR 127 CO 0.00 0.50 0.00 0.25 -1.05 0.00 0.00 178.16 177.86 3jyt n THR 128 N -2.91 0.26 -2.26 -2.88 -2.24 -0.95 -4.68 114.28 98.62 3jyt n THR 128 Ca -0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 3jyt n THR 128 Cb 0.79 -0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 3jyt n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3jyt s ALA 129 N 0.04 3.50 0.31 6.98 0.00 -1.26 -4.07 121.76 127.27 3jyt s ALA 129 Ca 0.00 1.07 0.01 0.00 0.00 0.00 0.00 51.96 53.03 3jyt s ALA 129 Cb 0.00 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 3jyt s ALA 129 CO 0.00 -0.50 0.36 -0.59 0.00 0.00 0.00 175.76 175.03 3jyt s PHE 130 N 0.10 1.29 -0.02 0.00 -0.71 -1.05 -0.13 117.98 117.46 3jyt s PHE 130 Ca 0.56 -1.41 -0.00 0.00 -1.04 0.00 0.00 56.93 55.04 3jyt s PHE 130 Cb -0.35 -0.36 0.03 0.00 -1.21 0.00 0.00 43.02 41.13 3jyt s PHE 130 CO 0.38 -0.97 0.03 0.99 -1.34 0.00 0.00 175.22 174.31 3jyt s THR 131 N -3.39 -0.03 -0.45 -4.49 2.01 -1.26 -3.20 115.64 104.84 3jyt s THR 131 Ca 0.35 0.22 -0.13 0.00 0.31 0.00 0.00 61.69 62.44 3jyt s THR 131 Cb 0.02 -0.12 0.07 0.00 0.01 0.00 0.00 72.50 72.48 3jyt s THR 131 CO 0.21 0.11 0.33 -0.63 -0.69 0.00 0.00 174.62 173.95 3jyt s ILE 132 N 1.18 4.88 1.07 1.82 1.01 0.13 -4.80 121.20 126.49 3jyt s ILE 132 Ca -0.08 -1.13 -0.22 0.00 0.00 0.00 0.00 60.65 59.22 3jyt s ILE 132 Cb -0.13 -3.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.43 3jyt s ILE 132 CO -0.03 -0.52 -0.54 -2.65 0.00 0.00 0.00 174.94 171.21 3jyt n PRO 133 N 5.10 -0.99 -4.19 2.79 -0.02 -1.26 -2.13 135.00 134.30 3jyt n PRO 133 Ca -0.12 -0.28 -0.25 0.00 -2.02 0.00 0.00 63.50 60.84 3jyt n PRO 133 Cb 0.44 -1.45 -0.07 0.00 -0.02 0.00 0.00 33.50 32.40 3jyt n PRO 133 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3jyt s SER 134 N -1.54 4.99 -0.14 2.55 0.15 -1.26 -4.77 113.70 113.68 3jyt s SER 134 Ca 0.49 -0.37 -0.22 0.00 0.70 0.00 0.00 55.95 56.54 3jyt s SER 134 Cb -0.04 -1.13 -0.25 0.00 -1.71 0.00 0.00 66.02 62.89 3jyt s SER 134 CO 0.67 0.05 0.57 -0.29 1.20 0.00 0.00 173.24 175.43 3jyt h ILE 135 N 2.10 1.30 0.00 6.45 6.09 -1.96 -3.29 117.51 128.19 3jyt h ILE 135 Ca -0.47 -2.34 0.00 0.00 -1.37 0.00 0.00 64.86 60.68 3jyt h ILE 135 Cb 1.22 2.85 0.00 0.00 0.47 0.00 0.00 36.82 41.36 3jyt h ILE 135 CO 0.60 0.57 0.00 -0.46 -3.07 0.00 0.00 178.15 175.79 3jyt n ASN 136 N -4.30 0.00 -3.94 2.19 2.04 -1.26 -4.76 115.26 105.23 3jyt n ASN 136 Ca -0.21 -0.67 -0.31 0.00 -0.44 0.00 0.00 54.58 52.95 3jyt n ASN 136 Cb 0.70 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.91 3jyt n ASN 136 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 3jyt n ASN 137 N -0.53 -2.46 0.00 0.53 3.02 -1.24 -4.80 115.26 109.78 3jyt n ASN 137 Ca 0.00 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.79 3jyt n ASN 137 Cb 0.00 -2.09 0.00 0.00 -0.61 0.00 0.00 39.78 37.08 3jyt n ASN 137 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3jyt n GLU 138 N -3.85 0.00 -1.59 3.52 2.13 -1.26 -5.03 120.64 114.56 3jyt n GLU 138 Ca 0.07 0.00 -0.56 0.00 0.66 0.00 0.00 57.16 57.32 3jyt n GLU 138 Cb 0.48 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.12 3jyt n GLU 138 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3jyt n THR 139 N -0.32 0.04 -1.74 6.31 -1.04 -1.26 -4.83 114.28 111.44 3jyt n THR 139 Ca 0.00 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 3jyt n THR 139 Cb 0.00 -0.60 -0.01 0.00 -1.82 0.00 0.00 70.33 67.90 3jyt n THR 139 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3jyt n PRO 140 N 2.71 2.58 -0.91 -2.82 -0.02 -1.26 -4.42 135.00 130.86 3jyt n PRO 140 Ca 0.21 0.91 -0.35 0.00 -2.02 0.00 0.00 63.50 62.26 3jyt n PRO 140 Cb 0.13 -2.65 0.08 0.00 -0.02 0.00 0.00 33.50 31.03 3jyt n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jyt n GLY 141 N 1.63 -3.39 3.85 -1.23 0.00 -1.26 -4.92 105.19 99.87 3jyt n GLY 141 Ca 0.07 -0.77 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 3jyt n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jyt s ILE 142 N -2.19 5.13 0.03 -0.61 1.01 -0.90 -4.87 121.20 118.80 3jyt s ILE 142 Ca 0.48 0.60 0.08 0.00 0.00 0.00 0.00 60.65 61.81 3jyt s ILE 142 Cb -0.20 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 3jyt s ILE 142 CO 0.75 0.48 -0.22 -0.13 0.00 0.00 0.00 174.94 175.83 3jyt s ARG 143 N -1.36 1.98 0.31 2.79 0.52 -1.26 -0.69 118.95 121.24 3jyt s ARG 143 Ca 0.26 -1.02 0.01 0.00 -0.52 0.00 0.00 55.73 54.46 3jyt s ARG 143 Cb -0.15 -2.10 -0.00 0.00 0.52 0.00 0.00 34.95 33.22 3jyt s ARG 143 CO 0.14 0.53 0.38 0.66 0.02 0.00 0.00 175.30 177.03 3jyt n TYR 144 N 1.76 -1.15 -3.75 -0.53 4.02 -1.19 -1.20 117.16 115.11 3jyt n TYR 144 Ca -0.17 -2.23 -0.13 0.00 -0.01 0.00 0.00 57.90 55.36 3jyt n TYR 144 Cb 0.52 0.42 -0.09 0.00 -0.02 0.00 0.00 39.34 40.17 3jyt n TYR 144 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 176.86 176.99 3jyt s GLN 145 N -2.87 0.61 0.48 -0.72 -2.07 -0.22 -2.54 119.66 112.33 3jyt s GLN 145 Ca 0.29 0.02 -0.21 0.00 -1.82 0.00 0.00 55.36 53.64 3jyt s GLN 145 Cb -0.00 0.28 -0.07 0.00 -1.09 0.00 0.00 33.01 32.12 3jyt s GLN 145 CO 0.21 -0.15 1.11 0.71 -1.32 0.00 0.00 175.29 175.84 3jyt s TYR 146 N -0.88 2.91 -0.02 9.60 1.51 -1.26 -1.66 117.35 127.55 3jyt s TYR 146 Ca -0.10 1.57 0.00 0.00 -1.01 0.00 0.00 57.07 57.53 3jyt s TYR 146 Cb -0.04 -3.24 0.00 0.00 -0.11 0.00 0.00 41.96 38.57 3jyt s TYR 146 CO 0.03 -1.22 0.70 0.09 -1.11 0.00 0.00 175.55 174.04 3jyt n ASN 147 N -0.76 1.40 -4.12 2.29 3.02 -0.03 -4.72 115.26 112.35 3jyt n ASN 147 Ca 0.09 -1.38 -0.09 0.00 -0.03 0.00 0.00 54.58 53.16 3jyt n ASN 147 Cb 0.50 -0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.57 3jyt n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3jyt s VAL 148 N -0.39 0.41 -0.23 2.41 -7.23 -1.25 -1.00 120.40 113.12 3jyt s VAL 148 Ca 0.00 -1.80 -0.42 0.00 -1.81 0.00 0.00 61.98 57.95 3jyt s VAL 148 Cb 0.00 -1.51 -0.18 0.00 0.56 0.00 0.00 36.38 35.25 3jyt s VAL 148 CO 0.00 -0.91 1.46 0.18 -0.31 0.00 0.00 175.10 175.52 3jyt n LEU 149 N 0.15 1.25 -4.83 1.32 4.77 0.10 -4.50 117.00 115.25 3jyt n LEU 149 Ca -0.14 1.14 -0.34 0.00 -0.03 0.00 0.00 56.01 56.64 3jyt n LEU 149 Cb 0.61 -1.00 -0.06 0.00 -2.33 0.00 0.00 43.42 40.63 3jyt n LEU 149 CO 0.28 -1.05 0.46 -2.16 -1.33 0.00 0.00 177.39 173.60 3jyt s PRO 150 N 1.96 4.17 -0.74 3.23 0.04 -1.26 -4.08 135.00 138.31 3jyt s PRO 150 Ca 0.97 0.85 -0.27 0.00 0.04 0.00 0.00 61.00 62.59 3jyt s PRO 150 Cb -1.25 -2.59 0.02 0.00 0.04 0.00 0.00 34.50 30.72 3jyt s PRO 150 CO 0.66 0.23 1.37 -1.14 0.04 0.00 0.00 177.00 178.16 3jyt s GLN 151 N -2.56 3.13 0.00 4.56 0.74 -1.26 -3.14 119.66 121.13 3jyt s GLN 151 Ca 0.51 -0.17 0.00 0.00 0.05 0.00 0.00 55.36 55.74 3jyt s GLN 151 Cb -0.13 -4.27 0.00 0.00 1.10 0.00 0.00 33.01 29.71 3jyt s GLN 151 CO 0.19 -2.24 0.00 0.41 -0.55 0.00 0.00 175.29 173.10 3jyt n GLY 152 N 5.50 1.36 3.75 2.59 0.00 -1.26 -2.23 105.19 114.90 3jyt n GLY 152 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3jyt n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3jyt s TRP 153 N -2.00 3.81 0.47 1.61 -0.00 -1.19 -4.41 118.94 117.24 3jyt s TRP 153 Ca 0.00 1.61 0.33 0.00 -0.00 0.00 0.00 56.10 58.04 3jyt s TRP 153 Cb 0.00 -2.86 1.46 0.00 -0.00 0.00 0.00 33.47 32.06 3jyt s TRP 153 CO 0.00 0.33 1.66 -0.22 -0.00 0.00 0.00 176.95 178.73 3jyt h LYS 154 N 5.22 0.10 0.00 5.86 3.64 -1.93 -2.60 116.57 126.86 3jyt h LYS 154 Ca -0.45 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 58.69 3jyt h LYS 154 Cb 1.21 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 3jyt h LYS 154 CO 0.70 0.06 -1.81 0.41 -2.27 0.00 0.00 179.45 176.54 3jyt n GLY 155 N -1.63 -1.08 0.27 5.01 0.00 -1.26 -4.58 105.19 101.92 3jyt n GLY 155 Ca 0.35 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3jyt n GLY 155 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3jyt n SER 156 N -2.82 -0.42 0.00 1.61 7.64 -0.98 -2.24 113.62 116.41 3jyt n SER 156 Ca -0.17 1.22 0.00 0.00 1.01 0.00 0.00 58.87 60.93 3jyt n SER 156 Cb 0.95 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 3jyt n SER 156 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3jyt n PRO 157 N -5.05 0.00 -0.05 1.43 -0.02 -1.26 0.59 135.00 130.63 3jyt n PRO 157 Ca 0.08 0.66 0.23 0.00 -2.02 0.00 0.00 63.50 62.45 3jyt n PRO 157 Cb 0.29 -1.38 0.70 0.00 -0.02 0.00 0.00 33.50 33.10 3jyt n PRO 157 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3jyt h ALA 158 N -1.57 2.61 0.22 3.55 0.00 -1.80 0.19 119.26 122.45 3jyt h ALA 158 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3jyt h ALA 158 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3jyt h ALA 158 CO 0.00 -0.80 -0.10 0.82 0.00 0.00 0.00 179.25 179.17 3jyt h ILE 159 N 0.00 0.62 -0.04 0.00 2.04 -0.98 -1.37 117.51 117.78 3jyt h ILE 159 Ca 0.31 -0.99 0.03 0.00 1.00 0.00 0.00 64.86 65.20 3jyt h ILE 159 Cb 1.24 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.30 3jyt h ILE 159 CO -0.00 0.16 -0.46 0.15 0.00 0.00 0.00 178.15 177.99 3jyt h PHE 160 N -0.93 -1.34 -0.70 1.37 3.57 0.96 0.94 116.94 120.80 3jyt h PHE 160 Ca -0.03 0.05 0.14 0.00 3.53 0.00 0.00 57.97 61.65 3jyt h PHE 160 Cb 0.49 0.59 -0.13 0.00 2.79 0.00 0.00 35.95 39.68 3jyt h PHE 160 CO 0.06 -0.52 -0.20 1.96 -2.23 0.00 0.00 178.31 177.38 3jyt h GLN 161 N -0.59 -0.02 0.31 1.11 4.20 -1.07 0.71 115.11 119.76 3jyt h GLN 161 Ca 0.04 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3jyt h GLN 161 Cb 0.68 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.46 3jyt h GLN 161 CO -0.36 -0.02 -0.15 1.03 -0.67 0.00 0.00 178.83 178.67 3jyt h SER 162 N -0.02 -0.35 -0.65 1.46 0.87 -0.01 -1.31 113.55 113.53 3jyt h SER 162 Ca 0.33 -0.05 0.13 0.00 -1.23 0.00 0.00 61.79 60.97 3jyt h SER 162 Cb 0.53 0.09 -0.10 0.00 -0.44 0.00 0.00 62.40 62.48 3jyt h SER 162 CO -0.73 -0.18 0.10 0.28 -0.53 0.00 0.00 176.83 175.77 3jyt h SER 163 N -0.51 -0.08 0.28 6.23 0.02 0.27 -1.79 113.55 117.97 3jyt h SER 163 Ca -0.04 0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3jyt h SER 163 Cb 0.38 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 3jyt h SER 163 CO 0.07 -0.05 -0.20 -0.03 -1.14 0.00 0.00 176.83 175.48 3jyt h MET 164 N 0.22 -0.46 -0.99 3.45 -1.53 0.64 -1.82 114.93 114.44 3jyt h MET 164 Ca 0.35 0.03 0.17 0.00 -3.44 0.00 0.00 59.70 56.81 3jyt h MET 164 Cb 0.57 0.10 -0.10 0.00 -0.55 0.00 0.00 31.60 31.62 3jyt h MET 164 CO -0.48 -0.31 0.60 1.15 0.14 0.00 0.00 176.91 178.01 3jyt h THR 165 N -0.48 0.76 -0.12 -0.77 2.02 -0.42 0.28 112.91 114.18 3jyt h THR 165 Ca -0.02 -0.28 -0.10 0.00 0.77 0.00 0.00 66.41 66.78 3jyt h THR 165 Cb 0.42 -0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 3jyt h THR 165 CO 0.00 0.15 -0.37 0.50 0.37 0.00 0.00 175.52 176.16 3jyt h LYS 166 N 0.80 0.25 -0.32 6.66 3.64 -1.03 0.39 116.57 126.97 3jyt h LYS 166 Ca 0.55 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.71 3jyt h LYS 166 Cb 0.77 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 3jyt h LYS 166 CO -0.35 0.59 -0.28 0.82 -2.27 0.00 0.00 179.45 177.96 3jyt h ILE 167 N 0.21 1.28 0.00 2.00 2.04 0.38 -2.86 117.51 120.56 3jyt h ILE 167 Ca 0.02 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.51 3jyt h ILE 167 Cb 0.76 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3jyt h ILE 167 CO 0.06 0.45 -0.44 -0.07 0.00 0.00 0.00 178.15 178.14 3jyt h LEU 168 N 0.56 0.00 -0.99 1.44 3.38 -1.06 -3.37 115.31 115.26 3jyt h LEU 168 Ca 0.07 -0.03 0.24 0.00 0.09 0.00 0.00 57.88 58.25 3jyt h LEU 168 Cb 0.76 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.32 3jyt h LEU 168 CO 0.06 0.02 -0.10 1.21 0.09 0.00 0.00 178.44 179.72 3jyt n GLU 169 N -2.71 -0.08 -0.02 1.13 2.13 0.10 -0.88 120.64 120.31 3jyt n GLU 169 Ca 0.03 1.51 -0.09 0.00 0.66 0.00 0.00 57.16 59.27 3jyt n GLU 169 Cb 0.51 -2.34 0.06 0.00 0.27 0.00 0.00 31.44 29.94 3jyt n GLU 169 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3jyt h PRO 170 N 0.00 0.63 -0.01 5.31 0.13 -1.75 -1.88 132.00 134.43 3jyt h PRO 170 Ca 0.55 -0.35 -0.00 0.00 -0.87 0.00 0.00 66.00 65.32 3jyt h PRO 170 Cb 1.02 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 3jyt h PRO 170 CO -0.97 0.96 -0.01 0.35 -0.23 0.00 0.00 178.00 178.09 3jyt h PHE 171 N 0.50 0.03 -0.72 1.56 3.57 -1.25 -0.65 116.94 119.97 3jyt h PHE 171 Ca 0.03 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.54 3jyt h PHE 171 Cb 1.00 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.69 3jyt h PHE 171 CO 0.05 0.51 0.48 0.87 -2.23 0.00 0.00 178.31 177.98 3jyt h LYS 172 N -0.45 0.91 -0.58 1.11 1.57 -1.12 0.24 116.57 118.26 3jyt h LYS 172 Ca 0.00 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 3jyt h LYS 172 Cb 0.51 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3jyt h LYS 172 CO 0.00 0.60 0.01 -0.22 -0.57 0.00 0.00 179.45 179.28 3jyt h LYS 173 N 0.94 0.99 -0.01 3.15 3.64 -1.15 -1.49 116.57 122.63 3jyt h LYS 173 Ca 0.27 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3jyt h LYS 173 Cb -0.05 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 3jyt h LYS 173 CO -0.07 0.96 -0.07 0.94 -2.27 0.00 0.00 179.45 178.94 3jyt n GLN 174 N -4.19 1.54 -2.63 1.90 7.27 -0.27 -4.19 117.38 116.80 3jyt n GLN 174 Ca 0.03 -0.96 -0.08 0.00 0.07 0.00 0.00 57.00 56.06 3jyt n GLN 174 Cb 0.33 -1.48 0.04 0.00 2.41 0.00 0.00 30.24 31.53 3jyt n GLN 174 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 3jyt n ASN 175 N 0.10 2.38 -0.43 1.69 3.02 0.75 -4.95 115.26 117.81 3jyt n ASN 175 Ca 0.17 -2.62 0.37 0.00 -0.03 0.00 0.00 54.58 52.47 3jyt n ASN 175 Cb 0.38 -0.47 0.57 0.00 -0.61 0.00 0.00 39.78 39.65 3jyt n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3jyt n PRO 176 N -0.49 0.01 0.00 3.52 -0.04 -0.60 -0.55 135.00 136.85 3jyt n PRO 176 Ca 0.16 0.91 0.15 0.00 -0.04 0.00 0.00 63.50 64.69 3jyt n PRO 176 Cb 0.82 -2.17 0.80 0.00 -0.04 0.00 0.00 33.50 32.91 3jyt n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3jyt n ASP 177 N -3.36 0.50 -4.28 3.54 8.00 -1.26 -4.74 116.55 114.94 3jyt n ASP 177 Ca 0.31 -1.14 -0.35 0.00 0.71 0.00 0.00 54.79 54.32 3jyt n ASP 177 Cb 1.57 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 42.52 3jyt n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3jyt s ILE 178 N -2.02 3.34 0.30 0.53 1.01 0.28 -4.59 121.20 120.04 3jyt s ILE 178 Ca 0.44 -0.68 -0.29 0.00 0.00 0.00 0.00 60.65 60.12 3jyt s ILE 178 Cb 0.22 -2.60 -0.09 0.00 0.01 0.00 0.00 42.46 39.99 3jyt s ILE 178 CO 0.36 0.30 1.10 -0.69 0.00 0.00 0.00 174.94 176.02 3jyt s VAL 179 N 1.44 3.46 -0.39 2.92 1.01 -0.37 -4.91 120.40 123.56 3jyt s VAL 179 Ca 0.04 1.42 0.01 0.00 0.00 0.00 0.00 61.98 63.45 3jyt s VAL 179 Cb -0.15 -3.88 0.15 0.00 0.00 0.00 0.00 36.38 32.49 3jyt s VAL 179 CO -0.03 0.30 0.25 -0.63 0.00 0.00 0.00 175.10 174.99 3jyt s ILE 180 N -1.23 0.47 -0.17 2.22 1.01 -1.26 -0.61 121.20 121.63 3jyt s ILE 180 Ca 0.47 -2.09 -0.29 0.00 0.00 0.00 0.00 60.65 58.73 3jyt s ILE 180 Cb -0.31 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.78 3jyt s ILE 180 CO 0.40 -1.02 1.68 -0.31 0.00 0.00 0.00 174.94 175.69 3jyt s TYR 181 N 0.70 1.98 -0.11 3.97 1.51 -0.14 -4.82 117.35 120.43 3jyt s TYR 181 Ca 0.21 0.43 0.02 0.00 -1.01 0.00 0.00 57.07 56.71 3jyt s TYR 181 Cb -0.18 -3.97 -0.01 0.00 -0.11 0.00 0.00 41.96 37.69 3jyt s TYR 181 CO -0.03 -3.32 -0.18 1.14 -1.11 0.00 0.00 175.55 172.04 3jyt s GLN 182 N 4.64 3.20 -0.27 -0.62 -2.07 -1.26 -1.19 119.66 122.08 3jyt s GLN 182 Ca 0.74 -0.77 -0.02 0.00 -1.82 0.00 0.00 55.36 53.49 3jyt s GLN 182 Cb -0.28 -2.47 0.09 0.00 -1.09 0.00 0.00 33.01 29.26 3jyt s GLN 182 CO 0.30 0.22 0.09 -0.47 -1.32 0.00 0.00 175.29 174.11 3jyt s TYR 183 N 0.30 1.20 0.00 9.60 5.04 -0.61 -4.99 117.35 127.88 3jyt s TYR 183 Ca -0.13 -1.29 0.00 0.00 -2.44 0.00 0.00 57.07 53.21 3jyt s TYR 183 Cb -0.17 -1.33 0.00 0.00 0.35 0.00 0.00 41.96 40.81 3jyt s TYR 183 CO 0.07 -0.79 0.00 -0.12 -1.34 0.00 0.00 175.55 173.37 3jyt n MET 184 N 5.00 0.00 -0.06 4.97 1.56 -1.26 -0.68 117.12 126.65 3jyt n MET 184 Ca -0.05 0.00 0.09 0.00 -0.27 0.00 0.00 57.70 57.47 3jyt n MET 184 Cb 0.43 0.00 0.11 0.00 2.15 0.00 0.00 33.22 35.92 3jyt n MET 184 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 3jyt n ASP 185 N 9.81 2.72 -4.57 6.12 5.75 -1.26 -4.82 116.55 130.30 3jyt n ASP 185 Ca 0.00 -1.81 -0.43 0.00 -0.01 0.00 0.00 54.79 52.54 3jyt n ASP 185 Cb 0.00 -0.08 -0.04 0.00 -1.03 0.00 0.00 41.12 39.97 3jyt n ASP 185 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3jyt s ASP 186 N -1.41 6.52 -0.14 -1.12 2.15 0.15 -2.87 116.67 119.95 3jyt s ASP 186 Ca 0.25 0.17 -0.06 0.00 0.43 0.00 0.00 52.55 53.34 3jyt s ASP 186 Cb 0.16 -2.44 -0.04 0.00 -0.30 0.00 0.00 42.92 40.30 3jyt s ASP 186 CO 0.23 -0.99 0.09 -0.76 -0.17 0.00 0.00 175.17 173.57 3jyt s LEU 187 N 3.64 4.09 -0.23 -1.34 1.43 0.92 -1.58 118.68 125.60 3jyt s LEU 187 Ca 0.36 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 3jyt s LEU 187 Cb -0.11 -2.00 0.06 0.00 0.03 0.00 0.00 46.19 44.17 3jyt s LEU 187 CO 0.24 0.33 -0.05 -0.47 0.23 0.00 0.00 176.35 176.63 3jyt s TYR 188 N -0.55 2.36 -0.30 0.29 6.14 -0.33 0.17 117.35 125.13 3jyt s TYR 188 Ca 0.11 -1.72 -0.13 0.00 0.64 0.00 0.00 57.07 55.97 3jyt s TYR 188 Cb -0.12 -1.57 -0.04 0.00 0.42 0.00 0.00 41.96 40.66 3jyt s TYR 188 CO 0.02 -0.77 0.25 0.08 0.64 0.00 0.00 175.55 175.77 3jyt s VAL 189 N 1.41 5.27 -0.11 3.14 1.01 -0.00 -0.97 120.40 130.14 3jyt s VAL 189 Ca -0.06 0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 3jyt s VAL 189 Cb -0.19 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 3jyt s VAL 189 CO -0.06 0.13 -0.03 -0.83 0.00 0.00 0.00 175.10 174.32 3jyt s GLY 190 N 1.73 1.77 0.10 4.51 0.00 0.22 -0.73 107.32 114.92 3jyt s GLY 190 Ca 0.09 -0.83 -0.06 0.00 0.00 0.00 0.00 44.72 43.92 3jyt s GLY 190 CO 0.11 -0.37 0.15 -0.45 0.00 0.00 0.00 173.10 172.54 3jyt s SER 191 N -0.33 0.21 -0.07 1.64 0.15 0.14 -1.24 113.70 114.20 3jyt s SER 191 Ca 0.06 -0.84 0.12 0.00 0.70 0.00 0.00 55.95 55.99 3jyt s SER 191 Cb -0.12 0.32 0.32 0.00 -1.71 0.00 0.00 66.02 64.83 3jyt s SER 191 CO 0.02 -0.74 1.25 -0.67 1.20 0.00 0.00 173.24 174.30 3jyt n ASP 192 N -0.06 2.98 -4.90 5.45 -0.08 -1.26 -0.67 116.55 118.01 3jyt n ASP 192 Ca -0.12 -2.47 -0.29 0.00 -1.51 0.00 0.00 54.79 50.40 3jyt n ASP 192 Cb 0.62 -0.32 0.07 0.00 2.34 0.00 0.00 41.12 43.84 3jyt n ASP 192 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3jyt s LEU 193 N -1.83 2.66 0.51 -2.67 1.43 -1.26 -4.75 118.68 112.77 3jyt s LEU 193 Ca 0.26 0.84 -0.17 0.00 -1.03 0.00 0.00 54.13 54.03 3jyt s LEU 193 Cb 0.19 -3.44 -0.08 0.00 0.03 0.00 0.00 46.19 42.90 3jyt s LEU 193 CO 0.09 -1.71 0.99 -1.61 0.23 0.00 0.00 176.35 174.34 3jyt s GLU 194 N -5.47 3.91 0.18 1.70 0.41 -1.26 -4.34 118.70 113.83 3jyt s GLU 194 Ca 0.61 1.01 -0.16 0.00 -0.41 0.00 0.00 54.97 56.01 3jyt s GLU 194 Cb -0.11 -2.13 0.16 0.00 -1.78 0.00 0.00 34.13 30.27 3jyt s GLU 194 CO 0.49 -0.31 1.29 -0.89 -0.49 0.00 0.00 175.26 175.36 3jyt n ILE 195 N -1.51 -0.46 0.00 -1.63 5.41 -1.26 -0.13 119.36 119.78 3jyt n ILE 195 Ca 0.07 1.97 0.00 0.00 1.00 0.00 0.00 62.75 65.78 3jyt n ILE 195 Cb 0.54 -2.57 0.00 0.00 -0.71 0.00 0.00 39.64 36.90 3jyt n ILE 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3jyt n GLY 196 N -1.37 -3.61 0.32 7.39 0.00 -1.26 -0.49 105.19 106.17 3jyt n GLY 196 Ca 0.07 0.74 0.15 0.00 0.00 0.00 0.00 46.02 46.99 3jyt n GLY 196 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3jyt h GLN 197 N 0.00 0.00 0.44 1.61 4.20 -1.64 -2.46 115.11 117.26 3jyt h GLN 197 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3jyt h GLN 197 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3jyt h GLN 197 CO 0.00 0.00 -0.21 1.25 -0.67 0.00 0.00 178.83 179.20 3jyt h HIS 198 N 0.00 -0.54 -1.11 2.96 2.76 0.06 -1.40 115.15 117.87 3jyt h HIS 198 Ca 0.12 -0.01 0.32 0.00 -2.20 0.00 0.00 60.37 58.59 3jyt h HIS 198 Cb 0.49 0.18 -0.05 0.00 1.55 0.00 0.00 27.41 29.58 3jyt h HIS 198 CO 0.00 -0.27 0.79 0.00 -1.30 0.00 0.00 177.93 177.16 3jyt h ARG 199 N -1.09 0.03 -0.06 5.26 -0.00 -0.44 0.51 114.38 118.59 3jyt h ARG 199 Ca -0.06 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.39 3jyt h ARG 199 Cb 0.52 -0.01 -0.00 0.00 0.00 0.00 0.00 29.97 30.49 3jyt h ARG 199 CO 0.10 0.02 -0.08 1.15 0.00 0.00 0.00 179.97 181.16 3jyt h THR 200 N 0.03 1.39 -0.36 2.04 2.02 -1.28 -2.55 112.91 114.20 3jyt h THR 200 Ca 0.53 -1.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 3jyt h THR 200 Cb 2.08 2.13 -0.02 0.00 -1.74 0.00 0.00 68.15 70.60 3jyt h THR 200 CO -0.03 0.36 0.13 0.11 0.37 0.00 0.00 175.52 176.46 3jyt h LYS 201 N -0.31 0.51 -0.18 6.66 1.79 0.96 -1.48 116.57 124.52 3jyt h LYS 201 Ca 0.01 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3jyt h LYS 201 Cb 0.62 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 3jyt h LYS 201 CO 0.02 0.43 0.09 0.97 -1.08 0.00 0.00 179.45 179.89 3jyt h ILE 202 N 0.51 1.06 -0.01 1.86 6.09 -0.36 0.68 117.51 127.33 3jyt h ILE 202 Ca 0.12 -0.17 -0.01 0.00 -1.37 0.00 0.00 64.86 63.43 3jyt h ILE 202 Cb 0.12 0.82 0.00 0.00 0.47 0.00 0.00 36.82 38.24 3jyt h ILE 202 CO -0.01 0.07 -0.05 -0.08 -3.07 0.00 0.00 178.15 175.01 3jyt h GLU 203 N 0.25 0.05 -0.54 2.19 4.57 -0.87 -1.56 114.58 118.68 3jyt h GLU 203 Ca 0.07 -0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.29 3jyt h GLU 203 Cb 0.02 0.01 -0.11 0.00 -0.16 0.00 0.00 28.75 28.51 3jyt h GLU 203 CO -0.01 0.71 -0.39 0.93 -1.18 0.00 0.00 179.01 179.06 3jyt h GLU 204 N -0.59 -0.22 -0.59 1.92 5.08 -0.85 0.45 114.58 119.79 3jyt h GLU 204 Ca -0.00 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.46 3jyt h GLU 204 Cb 0.72 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.95 3jyt h GLU 204 CO 0.01 -0.14 0.21 1.25 -1.00 0.00 0.00 179.01 179.34 3jyt h LEU 205 N -0.23 0.21 0.72 1.33 5.85 -0.87 0.10 115.31 122.42 3jyt h LEU 205 Ca 0.19 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 3jyt h LEU 205 Cb 0.56 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 3jyt h LEU 205 CO -0.66 0.13 -0.45 0.03 -0.34 0.00 0.00 178.44 177.15 3jyt h ARG 206 N 0.39 -1.06 -0.63 1.25 3.08 0.67 -1.04 114.38 117.05 3jyt h ARG 206 Ca 0.29 0.07 0.10 0.00 0.07 0.00 0.00 59.98 60.51 3jyt h ARG 206 Cb 0.36 0.24 -0.07 0.00 0.08 0.00 0.00 29.97 30.57 3jyt h ARG 206 CO -0.30 -0.71 0.25 1.96 -1.07 0.00 0.00 179.97 180.10 3jyt h GLN 207 N -1.10 0.42 -0.06 0.04 4.20 0.01 0.12 115.11 118.74 3jyt h GLN 207 Ca -0.09 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.61 3jyt h GLN 207 Cb 0.89 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.52 3jyt h GLN 207 CO 0.09 0.28 -0.48 1.25 -0.67 0.00 0.00 178.83 179.30 3jyt h HIS 208 N 0.43 -1.43 -0.50 2.96 2.76 -0.56 0.35 115.15 119.18 3jyt h HIS 208 Ca 0.32 0.05 0.10 0.00 -2.20 0.00 0.00 60.37 58.64 3jyt h HIS 208 Cb 0.39 0.63 -0.10 0.00 1.55 0.00 0.00 27.41 29.88 3jyt h HIS 208 CO -0.16 -0.50 -0.15 -0.07 -1.30 0.00 0.00 177.93 175.75 3jyt h LEU 209 N -0.56 -0.55 -0.72 0.26 3.38 0.13 -1.07 115.31 116.19 3jyt h LEU 209 Ca 0.02 0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.17 3jyt h LEU 209 Cb 0.62 0.34 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 3jyt h LEU 209 CO -0.36 -0.19 0.46 0.25 0.09 0.00 0.00 178.44 178.69 3jyt h LEU 210 N -0.03 0.77 -2.37 1.67 5.85 0.89 0.51 115.31 122.61 3jyt h LEU 210 Ca 0.24 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.98 3jyt h LEU 210 Cb 0.40 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 3jyt h LEU 210 CO -0.53 0.55 0.18 -0.09 -0.34 0.00 0.00 178.44 178.20 3jyt h ARG 211 N 0.92 0.00 -0.63 1.25 2.43 0.92 0.92 114.38 120.19 3jyt h ARG 211 Ca 0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 3jyt h ARG 211 Cb -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3jyt h ARG 211 CO -0.09 0.00 0.00 0.91 -1.51 0.00 0.00 179.97 179.28 3jyt n TRP 212 N -3.42 1.54 -0.74 2.20 7.02 0.06 -4.91 117.44 119.20 3jyt n TRP 212 Ca -0.00 -0.63 0.00 0.00 -1.02 0.00 0.00 57.50 55.84 3jyt n TRP 212 Cb 0.27 -0.28 0.00 0.00 -2.42 0.00 0.00 31.31 28.88 3jyt n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3jyt n GLY 213 N 1.02 0.59 3.19 6.99 0.00 0.32 -4.38 105.19 112.93 3jyt n GLY 213 Ca 0.26 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 3jyt n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jyt s LEU 214 N 0.00 4.42 0.17 0.99 1.43 0.16 -4.29 118.68 121.56 3jyt s LEU 214 Ca 0.00 -1.45 -0.30 0.00 -1.03 0.00 0.00 54.13 51.35 3jyt s LEU 214 Cb 0.00 -1.79 -0.07 0.00 0.03 0.00 0.00 46.19 44.35 3jyt s LEU 214 CO 0.00 -0.37 1.03 0.42 0.23 0.00 0.00 176.35 177.66 3jyt s THR 215 N 1.27 4.09 -0.69 5.49 -4.23 -1.26 -1.04 115.64 119.28 3jyt s THR 215 Ca -0.00 1.84 0.05 0.00 -1.18 0.00 0.00 61.69 62.40 3jyt s THR 215 Cb -0.21 -4.17 0.19 0.00 1.34 0.00 0.00 72.50 69.65 3jyt s THR 215 CO -0.01 0.33 0.55 0.35 -0.54 0.00 0.00 174.62 175.30 3jyt n THR 216 N 2.32 1.75 -0.66 3.99 -2.24 -1.26 -0.64 114.28 117.53 3jyt n THR 216 Ca 0.02 -4.92 -0.31 0.00 -2.27 0.00 0.00 64.05 56.57 3jyt n THR 216 Cb 0.47 -2.16 0.18 0.00 -2.10 0.00 0.00 70.33 66.72 3jyt n THR 216 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3jyt s PRO 217 N -1.68 0.71 -1.07 -0.78 0.04 -1.26 -4.85 135.00 126.11 3jyt s PRO 217 Ca 0.28 1.45 -0.22 0.00 0.04 0.00 0.00 61.00 62.56 3jyt s PRO 217 Cb 0.00 -1.70 -0.00 0.00 0.04 0.00 0.00 34.50 32.84 3jyt s PRO 217 CO -0.14 -2.81 1.75 -0.51 0.04 0.00 0.00 177.00 175.33 3jyt s ASP 218 N -2.64 5.88 -0.20 6.66 1.11 -1.26 -3.29 116.67 122.94 3jyt s ASP 218 Ca 0.67 -1.47 0.08 0.00 0.18 0.00 0.00 52.55 52.01 3jyt s ASP 218 Cb -0.23 -2.57 0.24 0.00 1.07 0.00 0.00 42.92 41.42 3jyt s ASP 218 CO 0.59 -2.11 1.17 1.17 1.18 0.00 0.00 175.17 177.17 3jyt n LYS 219 N 8.66 0.79 -3.84 8.23 4.81 -1.26 -5.07 118.16 130.48 3jyt n LYS 219 Ca 0.41 -0.88 -0.36 0.00 -0.87 0.00 0.00 58.31 56.60 3jyt n LYS 219 Cb 0.48 0.37 -0.13 0.00 0.02 0.00 0.00 35.03 35.77 3jyt n LYS 219 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 3jyt s LYS 220 N 0.08 2.42 -0.03 1.64 -2.85 -1.21 -4.07 119.74 115.71 3jyt s LYS 220 Ca 0.05 -1.33 -0.32 0.00 -1.00 0.00 0.00 55.97 53.37 3jyt s LYS 220 Cb 0.26 -3.32 -0.11 0.00 -2.06 0.00 0.00 37.83 32.60 3jyt s LYS 220 CO -0.08 -0.70 1.92 0.72 0.10 0.00 0.00 175.35 177.31 3jyt n HIS 221 N 4.67 2.41 0.00 1.78 8.25 -0.73 -4.88 115.22 126.73 3jyt n HIS 221 Ca -0.11 -0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.18 3jyt n HIS 221 Cb 0.43 -2.72 0.00 0.00 1.12 0.00 0.00 29.99 28.82 3jyt n HIS 221 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3jyt n GLN 222 N 6.99 0.00 -1.69 -0.41 6.02 -1.26 -2.37 117.38 124.66 3jyt n GLN 222 Ca 0.21 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 57.01 3jyt n GLN 222 Cb 0.34 -0.05 0.06 0.00 1.02 0.00 0.00 30.24 31.62 3jyt n GLN 222 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 3jyt n LYS 223 N -1.51 3.15 -0.05 -1.09 3.00 -1.26 -4.72 118.16 115.69 3jyt n LYS 223 Ca 0.00 -3.92 0.08 0.00 -0.00 0.00 0.00 58.31 54.48 3jyt n LYS 223 Cb 0.00 -2.16 0.39 0.00 0.00 0.00 0.00 35.03 33.26 3jyt n LYS 223 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3jyt n GLU 224 N -0.81 1.34 -1.59 1.64 4.71 -1.26 -4.89 120.64 119.78 3jyt n GLU 224 Ca 0.42 -0.52 -0.55 0.00 -0.01 0.00 0.00 57.16 56.49 3jyt n GLU 224 Cb 0.91 -1.30 -0.07 0.00 -1.01 0.00 0.00 31.44 29.97 3jyt n GLU 224 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 3jyt n PRO 225 N -0.23 0.78 -2.54 3.49 -0.02 -1.26 -3.25 135.00 131.97 3jyt n PRO 225 Ca 0.13 0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 3jyt n PRO 225 Cb 0.18 -1.89 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 3jyt n PRO 225 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3jyt s PRO 226 N 0.84 4.50 0.44 0.52 0.04 -1.26 -5.05 135.00 135.02 3jyt s PRO 226 Ca 0.89 1.63 -0.17 0.00 0.04 0.00 0.00 61.00 63.39 3jyt s PRO 226 Cb -1.08 -3.38 -0.09 0.00 0.04 0.00 0.00 34.50 29.99 3jyt s PRO 226 CO 0.53 -0.13 0.89 -0.06 0.04 0.00 0.00 177.00 178.28 3jyt s PHE 227 N 0.85 3.40 -0.23 0.56 0.40 -0.64 -4.77 117.98 117.55 3jyt s PHE 227 Ca 0.55 1.40 -0.08 0.00 -0.60 0.00 0.00 56.93 58.20 3jyt s PHE 227 Cb -0.26 -2.71 -0.04 0.00 0.51 0.00 0.00 43.02 40.52 3jyt s PHE 227 CO 0.29 -0.16 0.08 -0.51 0.70 0.00 0.00 175.22 175.62 3jyt s LEU 228 N -3.57 3.67 -0.20 -0.37 1.43 -1.26 -0.52 118.68 117.85 3jyt s LEU 228 Ca 0.58 -0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.50 3jyt s LEU 228 Cb -0.10 -1.97 0.06 0.00 0.03 0.00 0.00 46.19 44.22 3jyt s LEU 228 CO 0.23 0.05 0.49 0.86 0.23 0.00 0.00 176.35 178.21 3jyt s TRP 229 N 1.14 -0.73 -1.01 0.29 -0.00 -1.21 -4.93 118.94 112.49 3jyt s TRP 229 Ca 0.05 1.52 -0.08 0.00 -0.00 0.00 0.00 56.10 57.59 3jyt s TRP 229 Cb -0.14 0.36 0.07 0.00 -0.00 0.00 0.00 33.47 33.76 3jyt s TRP 229 CO 0.04 -0.39 0.32 -1.33 -0.00 0.00 0.00 176.95 175.59 3jyt n MET 230 N 4.18 -2.66 -1.49 5.86 2.81 -1.26 -0.63 117.12 123.93 3jyt n MET 230 Ca -0.22 0.30 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 3jyt n MET 230 Cb 0.56 -4.91 0.00 0.00 -0.71 0.00 0.00 33.22 28.16 3jyt n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3jyt n GLY 231 N -0.92 0.39 0.00 3.03 0.00 -1.26 -5.04 105.19 101.39 3jyt n GLY 231 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 3jyt n GLY 231 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3jyt n TYR 232 N -3.48 0.00 -3.58 1.61 4.01 0.19 -2.68 117.16 113.23 3jyt n TYR 232 Ca 0.00 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.50 3jyt n TYR 232 Cb 0.25 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.12 3jyt n TYR 232 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 3jyt s GLU 233 N -0.72 0.09 -0.46 -0.72 2.12 0.16 -3.29 118.70 115.88 3jyt s GLU 233 Ca 0.00 -0.02 -0.22 0.00 0.36 0.00 0.00 54.97 55.09 3jyt s GLU 233 Cb 0.00 -1.67 0.03 0.00 0.26 0.00 0.00 34.13 32.75 3jyt s GLU 233 CO 0.00 -0.68 0.73 -0.51 -0.54 0.00 0.00 175.26 174.26 3jyt s LEU 234 N 2.18 4.42 0.32 2.70 1.43 0.32 -2.17 118.68 127.88 3jyt s LEU 234 Ca 0.03 -0.33 0.06 0.00 -1.03 0.00 0.00 54.13 52.87 3jyt s LEU 234 Cb -0.16 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.26 3jyt s LEU 234 CO -0.10 -0.89 0.45 -1.00 0.23 0.00 0.00 176.35 175.04 3jyt s HIS 235 N 3.10 3.19 0.32 0.29 3.76 0.33 -1.62 115.29 124.65 3jyt s HIS 235 Ca 0.25 -0.16 0.07 0.00 -0.15 0.00 0.00 55.06 55.08 3jyt s HIS 235 Cb -0.14 -1.92 0.90 0.00 1.11 0.00 0.00 32.58 32.53 3jyt s HIS 235 CO 0.20 0.07 1.61 -1.35 -0.85 0.00 0.00 174.74 174.42 3jyt h PRO 236 N 0.93 0.12 0.00 8.40 0.11 -1.96 -3.19 132.00 136.40 3jyt h PRO 236 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3jyt h PRO 236 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3jyt h PRO 236 CO 0.55 0.08 0.00 -0.25 -0.21 0.00 0.00 178.00 178.16 3jyt n ASP 237 N -5.29 0.69 -3.77 -2.05 8.00 -1.26 -4.93 116.55 107.93 3jyt n ASP 237 Ca 0.26 -1.30 -0.10 0.00 0.71 0.00 0.00 54.79 54.36 3jyt n ASP 237 Cb 0.86 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.92 3jyt n ASP 237 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3jyt s LYS 238 N -0.30 1.67 0.17 -1.24 -2.85 -1.21 -4.40 119.74 111.58 3jyt s LYS 238 Ca 0.00 -1.36 -0.11 0.00 -1.00 0.00 0.00 55.97 53.50 3jyt s LYS 238 Cb 0.00 0.48 -0.00 0.00 -2.06 0.00 0.00 37.83 36.25 3jyt s LYS 238 CO 0.00 -0.70 0.33 1.67 0.10 0.00 0.00 175.35 176.75 3jyt s TRP 239 N -3.70 0.30 -0.06 1.78 1.48 0.09 -0.52 118.94 118.31 3jyt s TRP 239 Ca 0.24 -0.66 -0.30 0.00 -1.06 0.00 0.00 56.10 54.32 3jyt s TRP 239 Cb -0.01 0.03 0.09 0.00 -1.16 0.00 0.00 33.47 32.43 3jyt s TRP 239 CO 0.11 -0.76 0.81 -0.08 -4.06 0.00 0.00 176.95 172.97 3jyt s THR 240 N -3.95 0.00 0.43 0.66 -1.32 -0.92 -1.02 115.64 109.53 3jyt s THR 240 Ca 0.16 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.39 3jyt s THR 240 Cb 0.02 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.94 3jyt s THR 240 CO -0.00 0.00 1.21 0.68 -2.21 0.00 0.00 174.62 174.30 3jyt s VAL 241 N -1.66 2.92 0.85 5.08 -7.23 -1.26 -0.66 120.40 118.43 3jyt s VAL 241 Ca -0.05 0.75 -0.11 0.00 -1.81 0.00 0.00 61.98 60.77 3jyt s VAL 241 Cb -0.00 -3.41 0.10 0.00 0.56 0.00 0.00 36.38 33.63 3jyt s VAL 241 CO 0.02 0.04 1.11 -1.10 -0.31 0.00 0.00 175.10 174.87 3jyt s GLN 242 N -2.48 1.62 -0.49 4.82 -0.21 -1.09 -4.76 119.66 117.07 3jyt s GLN 242 Ca 0.61 1.24 -0.37 0.00 0.02 0.00 0.00 55.36 56.86 3jyt s GLN 242 Cb -0.32 -1.82 -0.17 0.00 1.00 0.00 0.00 33.01 31.70 3jyt s GLN 242 CO 0.40 -2.11 1.92 -2.30 -2.12 0.00 0.00 175.29 171.09 3jyt n PRO 243 N -3.85 0.00 -3.45 2.91 -0.02 -1.26 -4.85 135.00 124.48 3jyt n PRO 243 Ca 0.10 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 3jyt n PRO 243 Cb 0.53 -1.31 -0.05 0.00 -0.02 0.00 0.00 33.50 32.65 3jyt n PRO 243 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 3jyt n ILE 244 N 5.77 3.45 -2.03 4.25 3.06 -1.26 -5.07 119.36 127.54 3jyt n ILE 244 Ca 0.49 -5.32 -0.42 0.00 -2.50 0.00 0.00 62.75 55.00 3jyt n ILE 244 Cb -0.03 -2.27 -0.03 0.00 0.54 0.00 0.00 39.64 37.85 3jyt n ILE 244 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 3jyt s VAL 245 N -1.89 3.36 0.32 9.51 1.01 -1.26 -5.05 120.40 126.41 3jyt s VAL 245 Ca 0.31 0.70 -0.04 0.00 0.00 0.00 0.00 61.98 62.95 3jyt s VAL 245 Cb -0.00 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.87 3jyt s VAL 245 CO -0.06 -0.02 0.59 -0.76 0.00 0.00 0.00 175.10 174.85 3jyt s LEU 246 N 2.96 4.00 -0.43 3.92 1.43 -1.26 -5.05 118.68 124.25 3jyt s LEU 246 Ca 0.71 0.71 -0.26 0.00 -1.03 0.00 0.00 54.13 54.26 3jyt s LEU 246 Cb -0.36 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.34 3jyt s LEU 246 CO 0.30 -0.26 0.97 -2.16 0.23 0.00 0.00 176.35 175.43 3jyt s PRO 247 N -3.81 3.69 -0.50 1.29 0.04 -1.26 -5.01 135.00 129.45 3jyt s PRO 247 Ca 0.44 0.41 -0.26 0.00 0.04 0.00 0.00 61.00 61.63 3jyt s PRO 247 Cb -0.10 -3.87 0.03 0.00 0.04 0.00 0.00 34.50 30.59 3jyt s PRO 247 CO 0.32 -1.15 1.00 -2.00 0.04 0.00 0.00 177.00 175.22 3jyt s GLU 248 N 3.79 3.53 0.27 4.56 2.12 -1.26 -4.99 118.70 126.72 3jyt s GLU 248 Ca 0.40 0.17 -0.00 0.00 0.36 0.00 0.00 54.97 55.89 3jyt s GLU 248 Cb -0.10 -3.96 -0.02 0.00 0.26 0.00 0.00 34.13 30.30 3jyt s GLU 248 CO 0.24 -1.37 0.29 -1.59 -0.54 0.00 0.00 175.26 172.29 3jyt s LYS 249 N 4.09 1.55 0.00 4.30 -2.85 -1.26 -5.12 119.74 120.45 3jyt s LYS 249 Ca 0.39 -1.72 0.00 0.00 -1.00 0.00 0.00 55.97 53.64 3jyt s LYS 249 Cb -0.10 0.35 0.00 0.00 -2.06 0.00 0.00 37.83 36.02 3jyt s LYS 249 CO 0.26 -0.58 0.00 -0.40 0.10 0.00 0.00 175.35 174.73 3jyt n ASP 250 N -0.88 0.00 -4.65 0.03 5.68 -1.26 -4.94 116.55 110.53 3jyt n ASP 250 Ca 0.03 0.03 -0.40 0.00 -0.50 0.00 0.00 54.79 53.95 3jyt n ASP 250 Cb 0.64 -0.16 -0.06 0.00 -1.14 0.00 0.00 41.12 40.39 3jyt n ASP 250 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3jyt s SER 251 N -1.92 6.59 -0.25 -1.12 1.04 -1.26 -5.06 113.70 111.72 3jyt s SER 251 Ca 0.00 0.71 -0.13 0.00 0.48 0.00 0.00 55.95 57.01 3jyt s SER 251 Cb 0.00 -2.32 -0.04 0.00 0.10 0.00 0.00 66.02 63.76 3jyt s SER 251 CO 0.00 -0.27 0.30 0.26 0.98 0.00 0.00 173.24 174.51 3jyt s TRP 252 N 2.02 3.28 0.77 5.02 0.52 -1.26 -5.05 118.94 124.23 3jyt s TRP 252 Ca 0.26 0.35 -0.08 0.00 0.02 0.00 0.00 56.10 56.65 3jyt s TRP 252 Cb -0.16 -2.47 0.11 0.00 -1.15 0.00 0.00 33.47 29.80 3jyt s TRP 252 CO 0.09 -0.12 1.08 0.95 0.02 0.00 0.00 176.95 178.98 3jyt s THR 253 N 1.68 2.18 0.11 2.01 -4.23 -1.26 -1.67 115.64 114.45 3jyt s THR 253 Ca 0.13 -0.27 -0.14 0.00 -1.18 0.00 0.00 61.69 60.23 3jyt s THR 253 Cb -0.15 -2.91 -0.09 0.00 1.34 0.00 0.00 72.50 70.69 3jyt s THR 253 CO 0.09 0.00 1.41 0.58 -0.54 0.00 0.00 174.62 176.16 3jyt h VAL 254 N -0.83 1.30 0.00 2.29 2.07 -1.73 -2.81 116.25 116.54 3jyt h VAL 254 Ca -0.43 -1.55 -0.05 0.00 0.82 0.00 0.00 66.70 65.49 3jyt h VAL 254 Cb 1.29 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 3jyt h VAL 254 CO 0.51 0.50 -0.24 -0.55 0.02 0.00 0.00 177.57 177.81 3jyt h ASN 255 N 0.52 0.00 0.19 0.57 7.08 -1.87 -1.79 115.58 120.28 3jyt h ASN 255 Ca 0.04 0.00 0.01 0.00 -3.08 0.00 0.00 56.30 53.26 3jyt h ASN 255 Cb 0.96 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.18 3jyt h ASN 255 CO 0.09 0.24 -0.21 0.44 -2.08 0.00 0.00 177.43 175.91 3jyt h ASP 256 N 0.00 -0.56 -0.56 6.14 3.32 -1.83 0.80 116.42 123.74 3jyt h ASP 256 Ca -0.00 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.18 3jyt h ASP 256 Cb 0.71 0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 3jyt h ASP 256 CO 0.03 -0.31 0.37 0.40 -1.72 0.00 0.00 179.24 178.02 3jyt h ILE 257 N -0.44 0.94 -0.30 0.35 1.08 -1.19 -0.44 117.51 117.50 3jyt h ILE 257 Ca 0.00 -0.15 -0.02 0.00 -0.39 0.00 0.00 64.86 64.30 3jyt h ILE 257 Cb 0.42 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 34.62 3jyt h ILE 257 CO -0.06 0.08 0.10 0.00 -0.69 0.00 0.00 178.15 177.58 3jyt h LYS 259 N 0.33 1.25 0.64 0.00 1.57 0.20 -0.91 116.57 119.65 3jyt h LYS 259 Ca 0.10 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 3jyt h LYS 259 Cb 0.24 -0.26 0.01 0.00 0.08 0.00 0.00 32.23 32.29 3jyt h LYS 259 CO -0.00 0.88 -0.31 -0.07 -0.57 0.00 0.00 179.45 179.38 3jyt h LEU 260 N 1.27 -0.72 -1.08 2.94 4.07 -0.81 -1.48 115.31 119.50 3jyt h LEU 260 Ca 0.33 0.02 0.20 0.00 0.08 0.00 0.00 57.88 58.52 3jyt h LEU 260 Cb -0.04 0.19 -0.10 0.00 1.08 0.00 0.00 40.66 41.78 3jyt h LEU 260 CO -0.06 -0.51 0.61 0.58 -1.08 0.00 0.00 178.44 177.98 3jyt h VAL 261 N -0.87 0.68 0.70 1.22 2.07 -1.11 0.21 116.25 119.14 3jyt h VAL 261 Ca -0.09 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3jyt h VAL 261 Cb 0.66 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3jyt h VAL 261 CO 0.14 0.13 -0.44 1.23 0.02 0.00 0.00 177.57 178.65 3jyt h GLY 262 N 0.69 -1.19 0.40 2.17 0.00 -1.04 0.12 103.07 104.22 3jyt h GLY 262 Ca 0.58 0.50 0.05 0.00 0.00 0.00 0.00 47.33 48.46 3jyt h GLY 262 CO -0.36 -0.41 -0.12 0.50 0.00 0.00 0.00 176.54 176.14 3jyt h LYS 263 N -1.08 -0.10 -0.45 4.80 1.57 -0.13 0.43 116.57 121.62 3jyt h LYS 263 Ca -0.09 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3jyt h LYS 263 Cb 0.87 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 3jyt h LYS 263 CO 0.08 -0.06 0.30 -0.07 -0.57 0.00 0.00 179.45 179.12 3jyt h LEU 264 N -0.10 0.46 -1.44 2.94 3.38 -0.97 0.66 115.31 120.23 3jyt h LEU 264 Ca 0.12 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3jyt h LEU 264 Cb 0.29 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3jyt h LEU 264 CO -0.29 0.32 -0.28 0.78 0.09 0.00 0.00 178.44 179.06 3jyt h ASN 265 N 0.54 0.00 -0.06 -0.43 2.35 0.12 0.15 115.58 118.25 3jyt h ASN 265 Ca 0.17 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.71 3jyt h ASN 265 Cb 0.04 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.42 3jyt h ASN 265 CO -0.04 0.28 -0.77 -0.25 -1.65 0.00 0.00 177.43 175.00 3jyt h TRP 266 N 0.00 0.97 -0.46 1.19 -0.00 0.19 -3.20 115.95 114.63 3jyt h TRP 266 Ca -0.00 -0.43 -0.06 0.00 -0.00 0.00 0.00 58.89 58.40 3jyt h TRP 266 Cb 0.53 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.52 3jyt h TRP 266 CO 0.00 1.25 0.04 0.00 -0.00 0.00 0.00 178.44 179.73 3jyt h ALA 267 N 0.63 0.62 0.00 2.65 0.00 0.36 -3.25 119.26 120.27 3jyt h ALA 267 Ca -0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3jyt h ALA 267 Cb 1.39 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3jyt h ALA 267 CO 0.15 0.38 0.01 -1.13 0.00 0.00 0.00 179.25 178.66 3jyt n SER 268 N -4.41 0.00 0.04 0.00 3.41 0.45 -1.18 113.62 111.92 3jyt n SER 268 Ca 0.00 0.01 0.11 0.00 -0.26 0.00 0.00 58.87 58.74 3jyt n SER 268 Cb 0.27 -0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.24 3jyt n SER 268 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3jyt n GLN 269 N -0.76 0.34 0.00 4.33 10.64 -1.23 -2.90 117.38 127.80 3jyt n GLN 269 Ca 0.00 0.01 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 3jyt n GLN 269 Cb 0.01 -1.62 0.00 0.00 -0.86 0.00 0.00 30.24 27.77 3jyt n GLN 269 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.06 176.74 3jyt n ILE 270 N -2.07 0.00 -2.21 -0.39 0.13 -0.32 -0.48 119.36 114.02 3jyt n ILE 270 Ca 0.02 0.00 -0.42 0.00 -1.10 0.00 0.00 62.75 61.24 3jyt n ILE 270 Cb 0.46 -0.35 -0.03 0.00 -0.84 0.00 0.00 39.64 38.88 3jyt n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 3jyt s TYR 271 N -1.58 2.60 0.38 9.51 2.02 -0.91 -4.69 117.35 124.67 3jyt s TYR 271 Ca 0.00 0.68 -0.20 0.00 -0.37 0.00 0.00 57.07 57.18 3jyt s TYR 271 Cb 0.00 -3.70 -0.10 0.00 -0.40 0.00 0.00 41.96 37.76 3jyt s TYR 271 CO 0.00 -2.67 0.89 -1.25 -1.57 0.00 0.00 175.55 170.95 3jyt s PRO 272 N 3.14 4.23 -1.24 -1.71 0.04 -1.26 -4.29 135.00 133.91 3jyt s PRO 272 Ca 0.64 1.03 -0.01 0.00 0.04 0.00 0.00 61.00 62.71 3jyt s PRO 272 Cb -0.29 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 31.88 3jyt s PRO 272 CO 0.24 0.08 0.07 0.41 0.04 0.00 0.00 177.00 177.84 3jyt n GLY 273 N -0.34 -0.23 3.77 0.56 0.00 -1.26 -5.01 105.19 102.69 3jyt n GLY 273 Ca 0.05 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 3jyt n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jyt s ILE 274 N -2.78 3.20 0.05 -0.61 -1.09 -1.26 -4.97 121.20 113.74 3jyt s ILE 274 Ca 0.04 0.79 0.06 0.00 -2.23 0.00 0.00 60.65 59.30 3jyt s ILE 274 Cb -0.02 -3.34 -0.02 0.00 -1.58 0.00 0.00 42.46 37.50 3jyt s ILE 274 CO 0.04 -0.12 -0.16 -1.59 -1.23 0.00 0.00 174.94 171.88 3jyt s LYS 275 N -3.11 1.05 0.00 2.79 -2.85 -1.26 -4.96 119.74 111.40 3jyt s LYS 275 Ca 0.70 -0.87 0.00 0.00 -1.00 0.00 0.00 55.97 54.79 3jyt s LYS 275 Cb -0.25 -1.11 0.00 0.00 -2.06 0.00 0.00 37.83 34.41 3jyt s LYS 275 CO 0.28 0.27 0.00 1.33 0.10 0.00 0.00 175.35 177.34 3jyt n VAL 276 N 1.71 0.00 -0.15 1.79 0.24 -1.26 -4.91 118.33 115.75 3jyt n VAL 276 Ca -0.18 -0.05 -0.04 0.00 -2.04 0.00 0.00 64.34 62.03 3jyt n VAL 276 Cb 0.54 0.39 -0.04 0.00 -1.47 0.00 0.00 33.84 33.26 3jyt n VAL 276 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3jyt n ARG 277 N -0.58 -0.15 0.00 7.34 3.00 -1.26 0.25 116.66 125.25 3jyt n ARG 277 Ca 0.00 0.69 0.05 0.00 -0.00 0.00 0.00 57.85 58.59 3jyt n ARG 277 Cb 0.00 -1.02 0.22 0.00 0.00 0.00 0.00 32.46 31.65 3jyt n ARG 277 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 3jyt n GLN 278 N -3.97 0.06 -0.12 -0.14 1.13 -1.26 0.28 117.38 113.36 3jyt n GLN 278 Ca 0.01 0.28 -0.15 0.00 -1.94 0.00 0.00 57.00 55.19 3jyt n GLN 278 Cb 0.09 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 28.82 3jyt n GLN 278 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 3jyt n LEU 279 N -1.41 2.22 -0.01 1.08 7.94 0.14 -3.55 117.00 123.41 3jyt n LEU 279 Ca 0.03 -0.10 -0.13 0.00 -1.11 0.00 0.00 56.01 54.70 3jyt n LEU 279 Cb 0.09 -0.52 -0.02 0.00 0.53 0.00 0.00 43.42 43.51 3jyt n LEU 279 CO 0.08 0.80 0.37 0.77 -1.11 0.00 0.00 177.39 178.30 3jyt h SER 280 N 0.00 0.79 -0.89 1.96 4.64 -0.66 -1.99 113.55 117.39 3jyt h SER 280 Ca -0.54 -0.47 0.11 0.00 -0.47 0.00 0.00 61.79 60.41 3jyt h SER 280 Cb 1.94 -0.23 -0.08 0.00 -0.31 0.00 0.00 62.40 63.72 3jyt h SER 280 CO -0.06 1.24 0.52 0.50 -0.87 0.00 0.00 176.83 178.17 3jyt h LYS 281 N 0.49 0.82 0.00 4.77 3.64 -0.36 0.34 116.57 126.26 3jyt h LYS 281 Ca -0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3jyt h LYS 281 Cb 1.26 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3jyt h LYS 281 CO 0.13 0.54 0.00 -0.11 -2.27 0.00 0.00 179.45 177.74 3jyt n LEU 282 N -4.72 0.00 -1.60 5.20 7.94 -0.75 -2.49 117.00 120.59 3jyt n LEU 282 Ca 0.16 0.01 -0.06 0.00 -1.11 0.00 0.00 56.01 55.01 3jyt n LEU 282 Cb 0.33 -0.01 0.09 0.00 0.53 0.00 0.00 43.42 44.36 3jyt n LEU 282 CO 0.26 -0.01 0.19 0.18 -1.11 0.00 0.00 177.39 176.90 3jyt n LEU 283 N -0.96 3.03 -0.00 -1.96 4.77 0.12 -4.81 117.00 117.19 3jyt n LEU 283 Ca 0.00 -3.76 -0.21 0.00 -0.03 0.00 0.00 56.01 52.01 3jyt n LEU 283 Cb 0.00 -0.22 -0.14 0.00 -2.33 0.00 0.00 43.42 40.74 3jyt n LEU 283 CO 0.00 1.45 -0.47 0.03 -1.33 0.00 0.00 177.39 177.07 3jyt h ARG 284 N 1.67 0.22 -5.40 3.23 3.08 -1.62 -3.41 114.38 112.16 3jyt h ARG 284 Ca 0.07 -0.38 -0.30 0.00 0.07 0.00 0.00 59.98 59.44 3jyt h ARG 284 Cb 1.37 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.53 3jyt h ARG 284 CO 0.31 1.18 0.98 0.41 -1.07 0.00 0.00 179.97 181.78 3jyt n GLY 285 N 1.75 0.87 3.68 0.04 0.00 -1.26 -4.88 105.19 105.39 3jyt n GLY 285 Ca -0.26 -0.60 -0.57 0.00 0.00 0.00 0.00 46.02 44.59 3jyt n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3jyt n THR 286 N 7.92 0.30 -2.51 2.61 -2.24 -1.26 -4.91 114.28 114.19 3jyt n THR 286 Ca 0.45 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 62.15 3jyt n THR 286 Cb 0.46 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 3jyt n THR 286 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3jyt n LYS 287 N 5.73 0.00 -2.20 -0.78 4.76 -1.26 -5.14 118.16 119.27 3jyt n LYS 287 Ca 0.28 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.30 3jyt n LYS 287 Cb 0.14 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.30 3jyt n LYS 287 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3jyt s ALA 288 N -1.48 3.57 -0.36 7.82 0.00 -1.26 -4.89 121.76 125.16 3jyt s ALA 288 Ca 0.00 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.05 3jyt s ALA 288 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 3jyt s ALA 288 CO 0.00 -0.59 0.74 1.28 0.00 0.00 0.00 175.76 177.19 3jyt n LEU 289 N 3.84 2.05 0.00 0.00 4.32 -1.26 -0.84 117.00 125.10 3jyt n LEU 289 Ca 0.11 -1.02 0.00 0.00 -0.02 0.00 0.00 56.01 55.07 3jyt n LEU 289 Cb 0.43 -0.45 0.00 0.00 -1.62 0.00 0.00 43.42 41.78 3jyt n LEU 289 CO 0.58 0.37 0.00 0.35 -1.22 0.00 0.00 177.39 177.47 3jyt n THR 290 N 0.37 0.00 -2.84 -5.08 -2.24 -1.26 -4.02 114.28 99.21 3jyt n THR 290 Ca 0.00 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.35 3jyt n THR 290 Cb 0.37 1.78 -0.04 0.00 -2.10 0.00 0.00 70.33 70.34 3jyt n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3jyt s GLU 291 N -0.00 4.21 0.12 -0.78 2.12 -0.02 -4.87 118.70 119.48 3jyt s GLU 291 Ca 0.00 1.03 -0.31 0.00 0.36 0.00 0.00 54.97 56.05 3jyt s GLU 291 Cb 0.00 -3.64 -0.09 0.00 0.26 0.00 0.00 34.13 30.66 3jyt s GLU 291 CO 0.00 -0.52 1.59 0.08 -0.54 0.00 0.00 175.26 175.87 3jyt s VAL 292 N 2.84 2.83 -0.01 3.70 1.01 -1.26 -2.86 120.40 126.65 3jyt s VAL 292 Ca 0.37 0.49 0.07 0.00 0.00 0.00 0.00 61.98 62.91 3jyt s VAL 292 Cb -0.15 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 3jyt s VAL 292 CO 0.08 0.02 -0.22 -0.51 0.00 0.00 0.00 175.10 174.47 3jyt s ILE 293 N 1.73 2.44 0.66 2.22 2.07 -0.67 -4.98 121.20 124.67 3jyt s ILE 293 Ca 0.71 -1.04 -0.11 0.00 -1.41 0.00 0.00 60.65 58.80 3jyt s ILE 293 Cb -0.42 -1.92 -0.01 0.00 0.13 0.00 0.00 42.46 40.24 3jyt s ILE 293 CO 0.31 0.53 1.05 -2.16 -1.91 0.00 0.00 174.94 172.76 3jyt s PRO 294 N -0.82 3.18 -0.18 3.50 0.04 -1.26 -4.42 135.00 135.04 3jyt s PRO 294 Ca 0.11 0.91 -0.07 0.00 0.04 0.00 0.00 61.00 62.00 3jyt s PRO 294 Cb -0.10 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3jyt s PRO 294 CO 0.01 -0.91 0.05 -0.51 0.04 0.00 0.00 177.00 175.68 3jyt s LEU 295 N -5.33 3.68 0.70 -3.56 1.43 -1.26 -5.08 118.68 109.27 3jyt s LEU 295 Ca 0.58 0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.61 3jyt s LEU 295 Cb -0.13 -1.93 0.05 0.00 0.03 0.00 0.00 46.19 44.21 3jyt s LEU 295 CO 0.53 0.15 1.04 0.42 0.23 0.00 0.00 176.35 178.72 3jyt s THR 296 N 0.49 2.64 0.01 5.49 -4.23 -1.26 -4.82 115.64 113.96 3jyt s THR 296 Ca 0.02 -0.06 -0.13 0.00 -1.18 0.00 0.00 61.69 60.33 3jyt s THR 296 Cb -0.13 -3.15 -0.07 0.00 1.34 0.00 0.00 72.50 70.49 3jyt s THR 296 CO 0.01 -0.17 0.90 -0.08 -0.54 0.00 0.00 174.62 174.74 3jyt h GLU 297 N -0.62 -0.46 -1.50 3.99 4.81 -1.98 1.24 114.58 120.06 3jyt h GLU 297 Ca -0.45 0.03 0.44 0.00 -0.13 0.00 0.00 59.36 59.25 3jyt h GLU 297 Cb 1.30 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.72 3jyt h GLU 297 CO 0.62 -0.31 1.07 0.93 -0.73 0.00 0.00 179.01 180.59 3jyt h GLU 298 N -0.63 0.02 0.02 1.92 3.07 -1.95 0.10 114.58 117.13 3jyt h GLU 298 Ca -0.05 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 3jyt h GLU 298 Cb 0.37 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3jyt h GLU 298 CO 0.08 0.02 -0.01 0.00 -1.40 0.00 0.00 179.01 177.70 3jyt h ALA 299 N 1.28 -0.05 -0.78 3.43 0.00 -1.69 -2.99 119.26 118.46 3jyt h ALA 299 Ca 0.73 -0.00 0.31 0.00 0.00 0.00 0.00 54.91 55.94 3jyt h ALA 299 Cb 2.84 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 20.52 3jyt h ALA 299 CO -0.06 -0.05 0.45 0.39 0.00 0.00 0.00 179.25 179.99 3jyt n GLU 300 N -2.98 -0.04 0.09 0.00 -0.58 0.42 -0.21 120.64 117.35 3jyt n GLU 300 Ca -0.00 0.94 -0.05 0.00 -0.42 0.00 0.00 57.16 57.62 3jyt n GLU 300 Cb 0.01 -1.73 -0.03 0.00 -0.57 0.00 0.00 31.44 29.12 3jyt n GLU 300 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3jyt h LEU 301 N 0.00 -0.27 -1.66 -4.62 3.38 -1.33 -2.93 115.31 107.88 3jyt h LEU 301 Ca 0.60 -0.01 0.42 0.00 0.09 0.00 0.00 57.88 58.97 3jyt h LEU 301 Cb 1.69 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 42.42 3jyt h LEU 301 CO -0.47 0.20 0.94 -0.08 0.09 0.00 0.00 178.44 179.12 3jyt h GLU 302 N -1.08 0.09 0.05 1.13 4.81 -0.43 0.45 114.58 119.61 3jyt h GLU 302 Ca -0.03 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3jyt h GLU 302 Cb 0.27 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3jyt h GLU 302 CO 0.05 0.06 -0.03 1.25 -0.73 0.00 0.00 179.01 179.62 3jyt h LEU 303 N 0.10 -0.06 -1.39 1.64 5.85 -1.10 -2.78 115.31 117.57 3jyt h LEU 303 Ca 0.75 0.00 0.24 0.00 0.84 0.00 0.00 57.88 59.71 3jyt h LEU 303 Cb 2.58 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 43.55 3jyt h LEU 303 CO -0.22 -0.03 0.64 0.00 -0.34 0.00 0.00 178.44 178.49 3jyt h ALA 304 N -1.94 2.17 0.52 1.25 0.00 -0.90 0.24 119.26 120.60 3jyt h ALA 304 Ca -0.01 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3jyt h ALA 304 Cb 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3jyt h ALA 304 CO 0.01 -0.53 -0.35 0.93 0.00 0.00 0.00 179.25 179.31 3jyt h GLU 305 N 0.44 -0.80 -0.18 0.00 5.08 -0.22 -1.49 114.58 117.41 3jyt h GLU 305 Ca 0.55 0.05 0.04 0.00 -1.00 0.00 0.00 59.36 59.00 3jyt h GLU 305 Cb 1.32 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.71 3jyt h GLU 305 CO -0.26 -0.53 -0.11 -0.91 -1.00 0.00 0.00 179.01 176.21 3jyt h ASN 306 N -0.83 -0.35 -0.43 1.42 2.35 -1.05 -0.39 115.58 116.31 3jyt h ASN 306 Ca -0.07 0.08 0.12 0.00 -0.55 0.00 0.00 56.30 55.88 3jyt h ASN 306 Cb 0.67 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.21 3jyt h ASN 306 CO 0.05 -0.14 0.79 -0.09 -1.65 0.00 0.00 177.43 176.38 3jyt h ARG 307 N -0.10 0.00 0.00 0.81 2.43 -0.28 0.64 114.38 117.89 3jyt h ARG 307 Ca 0.10 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3jyt h ARG 307 Cb 0.25 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3jyt h ARG 307 CO -0.24 0.00 -0.10 0.93 -1.51 0.00 0.00 179.97 179.05 3jyt h GLU 308 N 0.00 0.00 -0.97 0.20 4.39 0.00 -3.33 114.58 114.86 3jyt h GLU 308 Ca 0.20 0.00 0.31 0.00 0.34 0.00 0.00 59.36 60.21 3jyt h GLU 308 Cb 1.78 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 30.27 3jyt h GLU 308 CO -0.00 0.49 0.46 0.82 -1.16 0.00 0.00 179.01 179.62 3jyt h ILE 309 N -1.00 0.26 0.00 3.13 2.04 0.62 1.18 117.51 123.73 3jyt h ILE 309 Ca -0.02 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3jyt h ILE 309 Cb 0.53 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 3jyt h ILE 309 CO -0.01 0.05 0.00 0.18 0.00 0.00 0.00 178.15 178.36 3jyt n LEU 310 N -5.14 0.00 -0.00 1.44 4.77 -0.72 -2.79 117.00 114.57 3jyt n LEU 310 Ca 0.30 0.44 -0.18 0.00 -0.03 0.00 0.00 56.01 56.53 3jyt n LEU 310 Cb 0.94 -0.44 -0.14 0.00 -2.33 0.00 0.00 43.42 41.45 3jyt n LEU 310 CO 0.07 -0.25 0.06 0.11 -1.33 0.00 0.00 177.39 176.05 3jyt h LYS 311 N 0.00 0.18 -6.26 3.23 1.57 0.13 -3.44 116.57 111.99 3jyt h LYS 311 Ca 0.00 -0.31 -0.55 0.00 -1.87 0.00 0.00 60.65 57.92 3jyt h LYS 311 Cb 0.18 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3jyt h LYS 311 CO 0.00 1.15 1.02 -1.83 -0.57 0.00 0.00 179.45 179.22 3jyt s GLU 312 N -2.36 4.20 0.50 3.15 -1.05 -1.12 -4.95 118.70 117.06 3jyt s GLU 312 Ca -0.17 2.06 -0.22 0.00 -0.15 0.00 0.00 54.97 56.49 3jyt s GLU 312 Cb 0.00 -3.88 -0.06 0.00 -0.44 0.00 0.00 34.13 29.75 3jyt s GLU 312 CO 0.76 -0.79 1.27 -1.25 0.95 0.00 0.00 175.26 176.21 3jyt s PRO 313 N 3.70 3.46 0.19 -4.83 0.04 -1.26 -5.00 135.00 131.30 3jyt s PRO 313 Ca 0.69 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.75 3jyt s PRO 313 Cb -0.31 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.83 3jyt s PRO 313 CO 0.26 -0.86 0.06 0.14 0.04 0.00 0.00 177.00 176.64 3jyt s VAL 314 N -1.41 0.39 0.30 -0.36 -7.23 -1.26 -5.16 120.40 105.66 3jyt s VAL 314 Ca 0.67 -1.97 -0.20 0.00 -1.81 0.00 0.00 61.98 58.67 3jyt s VAL 314 Cb -0.35 -2.28 0.03 0.00 0.56 0.00 0.00 36.38 34.34 3jyt s VAL 314 CO 0.42 -0.29 0.73 -1.38 -0.31 0.00 0.00 175.10 174.27 3jyt s HIS 315 N -3.87 -0.14 0.27 2.82 -3.43 -1.26 -4.86 115.29 104.83 3jyt s HIS 315 Ca 0.30 -0.35 0.03 0.00 -0.80 0.00 0.00 55.06 54.24 3jyt s HIS 315 Cb 0.07 0.73 -0.06 0.00 -1.43 0.00 0.00 32.58 31.89 3jyt s HIS 315 CO 0.07 -1.29 0.04 0.20 -2.00 0.00 0.00 174.74 171.76 3jyt s GLY 316 N -2.94 1.80 0.40 -1.38 0.00 -0.19 -4.88 107.32 100.14 3jyt s GLY 316 Ca 0.12 -1.91 0.03 0.00 0.00 0.00 0.00 44.72 42.96 3jyt s GLY 316 CO 0.08 -1.72 0.28 -0.62 0.00 0.00 0.00 173.10 171.13 3jyt n VAL 317 N -0.54 0.00 -2.88 1.40 0.31 -0.76 -0.73 118.33 115.13 3jyt n VAL 317 Ca -0.03 -1.60 -0.21 0.00 -0.01 0.00 0.00 64.34 62.49 3jyt n VAL 317 Cb 0.65 -0.13 0.09 0.00 -0.91 0.00 0.00 33.84 33.54 3jyt n VAL 317 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 3jyt s TYR 318 N -2.00 1.25 -0.16 3.52 2.02 -1.26 -4.48 117.35 116.23 3jyt s TYR 318 Ca 0.22 -0.62 -0.09 0.00 -0.37 0.00 0.00 57.07 56.21 3jyt s TYR 318 Cb -0.02 -2.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.01 3jyt s TYR 318 CO 0.14 -1.48 0.13 -0.47 -1.57 0.00 0.00 175.55 172.30 3jyt s TYR 319 N -2.89 3.49 -0.28 2.71 5.04 -0.24 -4.91 117.35 120.27 3jyt s TYR 319 Ca 0.65 0.41 0.03 0.00 -2.44 0.00 0.00 57.07 55.72 3jyt s TYR 319 Cb -0.05 -2.06 0.07 0.00 0.35 0.00 0.00 41.96 40.28 3jyt s TYR 319 CO 0.42 0.49 -0.04 0.34 -1.34 0.00 0.00 175.55 175.42 3jyt s ASP 320 N -0.27 4.39 0.53 4.32 2.15 -1.26 -3.86 116.67 122.66 3jyt s ASP 320 Ca 0.11 -1.60 0.29 0.00 0.43 0.00 0.00 52.55 51.79 3jyt s ASP 320 Cb -0.11 -1.45 1.45 0.00 -0.30 0.00 0.00 42.92 42.51 3jyt s ASP 320 CO 0.01 -0.27 2.05 1.55 -0.17 0.00 0.00 175.17 178.34 3jyt h PRO 321 N 7.78 0.00 -0.98 4.34 0.13 -1.98 -2.76 132.00 138.54 3jyt h PRO 321 Ca -0.14 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.94 3jyt h PRO 321 Cb 1.04 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.14 3jyt h PRO 321 CO 0.47 0.11 0.07 -1.13 -0.23 0.00 0.00 178.00 177.28 3jyt n SER 322 N -3.48 2.62 -3.66 1.44 3.41 -1.26 -4.69 113.62 108.01 3jyt n SER 322 Ca -0.01 -2.22 -0.09 0.00 -0.26 0.00 0.00 58.87 56.29 3jyt n SER 322 Cb 0.26 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.58 3jyt n SER 322 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3jyt s LYS 323 N -0.81 0.60 0.41 4.33 2.20 -1.04 -5.15 119.74 120.29 3jyt s LYS 323 Ca 0.09 1.05 -0.22 0.00 -0.36 0.00 0.00 55.97 56.53 3jyt s LYS 323 Cb 0.07 0.10 -0.13 0.00 -1.51 0.00 0.00 37.83 36.36 3jyt s LYS 323 CO 0.02 -0.15 0.48 -0.25 -0.36 0.00 0.00 175.35 175.10 3jyt n ASP 324 N 4.18 -1.16 -4.42 1.43 8.00 -1.26 -4.83 116.55 118.49 3jyt n ASP 324 Ca -0.21 0.90 -0.43 0.00 0.71 0.00 0.00 54.79 55.76 3jyt n ASP 324 Cb 0.57 -1.08 -0.09 0.00 -0.02 0.00 0.00 41.12 40.50 3jyt n ASP 324 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3jyt s LEU 325 N 2.13 5.20 0.12 0.64 2.96 -1.26 -4.49 118.68 123.98 3jyt s LEU 325 Ca 0.63 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 3jyt s LEU 325 Cb -0.61 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 3jyt s LEU 325 CO 0.59 -0.50 0.15 -0.63 -1.32 0.00 0.00 176.35 174.64 3jyt s ILE 326 N 1.64 4.72 -0.08 6.68 -1.09 0.31 -1.11 121.20 132.28 3jyt s ILE 326 Ca 0.04 -0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 57.55 3jyt s ILE 326 Cb -0.21 -3.36 0.03 0.00 -1.58 0.00 0.00 42.46 37.34 3jyt s ILE 326 CO 0.08 -0.01 0.19 0.00 -1.23 0.00 0.00 174.94 173.98 3jyt s ALA 327 N -1.61 -0.46 0.11 9.38 0.00 -0.73 -0.84 121.76 127.62 3jyt s ALA 327 Ca 0.31 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.98 3jyt s ALA 327 Cb -0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 3jyt s ALA 327 CO 0.24 -0.12 -0.14 -2.00 0.00 0.00 0.00 175.76 173.74 3jyt s GLU 328 N 0.49 0.99 0.02 0.00 2.12 -0.64 -2.03 118.70 119.66 3jyt s GLU 328 Ca -0.03 -1.18 -0.04 0.00 0.36 0.00 0.00 54.97 54.07 3jyt s GLU 328 Cb -0.05 -0.91 -0.01 0.00 0.26 0.00 0.00 34.13 33.42 3jyt s GLU 328 CO -0.02 0.18 0.07 -1.50 -0.54 0.00 0.00 175.26 173.45 3jyt s ILE 329 N -1.94 0.12 0.04 -3.70 2.07 -1.20 -2.20 121.20 114.39 3jyt s ILE 329 Ca 0.07 -0.98 -0.00 0.00 -1.41 0.00 0.00 60.65 58.33 3jyt s ILE 329 Cb -0.06 -0.64 -0.03 0.00 0.13 0.00 0.00 42.46 41.85 3jyt s ILE 329 CO 0.03 -0.54 -0.03 -1.10 -1.91 0.00 0.00 174.94 171.39 3jyt s GLN 330 N -2.05 0.53 0.21 3.50 1.11 -0.68 -4.34 119.66 117.94 3jyt s GLN 330 Ca -0.10 -1.04 -0.28 0.00 0.01 0.00 0.00 55.36 53.95 3jyt s GLN 330 Cb -0.05 0.15 -0.09 0.00 -1.01 0.00 0.00 33.01 32.01 3jyt s GLN 330 CO -0.02 -0.08 0.87 0.21 0.01 0.00 0.00 175.29 176.27 3jyt s LYS 331 N -3.16 4.73 0.00 2.91 2.20 -1.26 -1.69 119.74 123.48 3jyt s LYS 331 Ca 0.00 1.35 0.08 0.00 -0.36 0.00 0.00 55.97 57.04 3jyt s LYS 331 Cb 0.02 -3.27 0.13 0.00 -1.51 0.00 0.00 37.83 33.21 3jyt s LYS 331 CO -0.07 0.54 0.94 1.04 -0.36 0.00 0.00 175.35 177.44 3jyt n GLN 332 N 1.52 1.36 -0.07 4.03 6.02 -1.07 -4.76 117.38 124.41 3jyt n GLN 332 Ca -0.03 -1.38 0.01 0.00 -0.01 0.00 0.00 57.00 55.58 3jyt n GLN 332 Cb 0.48 -1.17 -0.00 0.00 1.02 0.00 0.00 30.24 30.56 3jyt n GLN 332 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3jyt n GLY 333 N 0.35 -2.02 4.15 1.08 0.00 -1.22 -4.81 105.19 102.72 3jyt n GLY 333 Ca 0.06 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 3jyt n GLY 333 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jyt n GLN 334 N -2.55 -3.26 -0.16 1.61 10.64 -1.26 -0.94 117.38 121.45 3jyt n GLN 334 Ca -0.00 0.38 0.00 0.00 -1.83 0.00 0.00 57.00 55.55 3jyt n GLN 334 Cb 0.03 -5.13 0.00 0.00 -0.86 0.00 0.00 30.24 24.29 3jyt n GLN 334 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3jyt n GLY 335 N -1.37 1.93 3.91 2.61 0.00 -1.26 -5.04 105.19 105.96 3jyt n GLY 335 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 3jyt n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3jyt s GLN 336 N -0.26 3.61 -0.09 1.61 -0.21 -0.12 -4.65 119.66 119.55 3jyt s GLN 336 Ca 0.00 0.09 -0.13 0.00 0.02 0.00 0.00 55.36 55.34 3jyt s GLN 336 Cb 0.00 -2.52 0.03 0.00 1.00 0.00 0.00 33.01 31.52 3jyt s GLN 336 CO 0.00 0.03 0.34 -1.58 -2.12 0.00 0.00 175.29 171.96 3jyt s TRP 337 N -2.37 -0.32 0.32 0.91 0.52 -0.96 -2.60 118.94 114.43 3jyt s TRP 337 Ca 0.46 0.71 0.09 0.00 0.02 0.00 0.00 56.10 57.37 3jyt s TRP 337 Cb -0.10 0.12 -0.06 0.00 -1.15 0.00 0.00 33.47 32.28 3jyt s TRP 337 CO 0.36 -0.26 -0.09 0.99 0.02 0.00 0.00 176.95 177.96 3jyt s THR 338 N -0.36 2.08 0.12 2.01 2.01 -0.68 -1.56 115.64 119.25 3jyt s THR 338 Ca -0.05 -2.19 -0.26 0.00 0.31 0.00 0.00 61.69 59.50 3jyt s THR 338 Cb -0.03 -2.57 0.07 0.00 0.01 0.00 0.00 72.50 69.98 3jyt s THR 338 CO 0.02 -0.24 0.90 -0.72 -0.69 0.00 0.00 174.62 173.88 3jyt s TYR 339 N -2.72 -0.23 0.06 4.92 1.13 0.13 -1.69 117.35 118.96 3jyt s TYR 339 Ca 0.31 -0.03 -0.14 0.00 -1.41 0.00 0.00 57.07 55.80 3jyt s TYR 339 Cb 0.02 0.61 0.02 0.00 -1.10 0.00 0.00 41.96 41.51 3jyt s TYR 339 CO 0.15 -0.78 0.32 1.14 -2.51 0.00 0.00 175.55 173.87 3jyt s GLN 340 N -3.31 0.87 -0.08 -3.49 0.00 -0.93 -0.13 119.66 112.58 3jyt s GLN 340 Ca 0.09 -0.58 0.04 0.00 -0.00 0.00 0.00 55.36 54.91 3jyt s GLN 340 Cb -0.02 0.38 0.00 0.00 0.00 0.00 0.00 33.01 33.37 3jyt s GLN 340 CO -0.02 -0.29 -0.20 0.42 0.00 0.00 0.00 175.29 175.20 3jyt s ILE 341 N -2.91 1.71 0.13 3.63 1.01 0.09 -1.62 121.20 123.24 3jyt s ILE 341 Ca -0.02 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.80 3jyt s ILE 341 Cb 0.00 -1.49 -0.00 0.00 0.01 0.00 0.00 42.46 40.98 3jyt s ILE 341 CO -0.06 0.48 0.16 0.00 0.00 0.00 0.00 174.94 175.53 3jyt n TYR 342 N 3.47 -0.66 0.00 3.97 4.11 -0.02 0.79 117.16 128.83 3jyt n TYR 342 Ca -0.20 -0.94 0.00 0.00 -0.00 0.00 0.00 57.90 56.77 3jyt n TYR 342 Cb 0.53 0.18 0.00 0.00 -0.00 0.00 0.00 39.34 40.04 3jyt n TYR 342 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 3jyt n GLN 343 N -0.22 4.19 -3.82 -3.48 6.02 -1.26 -0.53 117.38 118.28 3jyt n GLN 343 Ca 0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.75 3jyt n GLN 343 Cb 0.22 -0.46 -0.17 0.00 1.02 0.00 0.00 30.24 30.86 3jyt n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3jyt s GLU 344 N -0.23 1.00 -0.03 -1.09 0.41 -1.26 -4.88 118.70 112.62 3jyt s GLU 344 Ca 0.00 -0.16 -0.39 0.00 -0.41 0.00 0.00 54.97 54.01 3jyt s GLU 344 Cb 0.00 -1.46 -0.19 0.00 -1.78 0.00 0.00 34.13 30.70 3jyt s GLU 344 CO 0.00 -0.36 1.07 -2.30 -0.49 0.00 0.00 175.26 173.18 3jyt n PRO 345 N 5.03 0.00 -0.06 0.39 -0.02 -1.26 -0.37 135.00 138.72 3jyt n PRO 345 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 3jyt n PRO 345 Cb 0.49 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 3jyt n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3jyt n PHE 346 N 1.61 0.00 -3.83 6.00 3.72 -1.26 -4.89 117.46 118.81 3jyt n PHE 346 Ca 0.20 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.32 3jyt n PHE 346 Cb 0.07 -0.14 -0.11 0.00 -0.94 0.00 0.00 39.48 38.36 3jyt n PHE 346 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3jyt n LYS 347 N -2.00 1.99 -3.26 -1.08 5.02 0.50 -5.08 118.16 114.25 3jyt n LYS 347 Ca 0.00 -4.52 -0.29 0.00 -2.02 0.00 0.00 58.31 51.48 3jyt n LYS 347 Cb 0.00 -2.30 -0.04 0.00 -0.02 0.00 0.00 35.03 32.68 3jyt n LYS 347 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3jyt s ASN 348 N -1.49 6.49 -0.08 4.39 4.22 -1.26 -4.11 114.94 123.10 3jyt s ASN 348 Ca 0.27 0.83 -0.22 0.00 -2.14 0.00 0.00 52.86 51.59 3jyt s ASN 348 Cb -0.02 -2.19 -0.29 0.00 1.28 0.00 0.00 41.25 40.02 3jyt s ASN 348 CO -0.15 -0.21 0.80 -0.07 -2.04 0.00 0.00 177.10 175.43 3jyt h LEU 349 N 1.75 0.35 -7.50 3.54 4.07 0.13 -2.01 115.31 115.64 3jyt h LEU 349 Ca -0.47 -0.94 -0.07 0.00 0.08 0.00 0.00 57.88 56.48 3jyt h LEU 349 Cb 1.19 -0.11 -0.15 0.00 1.08 0.00 0.00 40.66 42.66 3jyt h LEU 349 CO 0.66 1.35 -0.18 -0.75 -1.08 0.00 0.00 178.44 178.44 3jyt s LYS 350 N -2.39 0.92 0.36 1.13 2.20 -1.13 -4.23 119.74 116.60 3jyt s LYS 350 Ca -0.16 -0.61 0.05 0.00 -0.36 0.00 0.00 55.97 54.89 3jyt s LYS 350 Cb 0.01 0.40 -0.07 0.00 -1.51 0.00 0.00 37.83 36.66 3jyt s LYS 350 CO 0.79 -0.32 0.04 0.95 -0.36 0.00 0.00 175.35 176.45 3jyt s THR 351 N -3.14 1.43 -0.02 3.43 -4.23 0.37 -0.73 115.64 112.76 3jyt s THR 351 Ca -0.01 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.29 3jyt s THR 351 Cb 0.01 -2.83 0.07 0.00 1.34 0.00 0.00 72.50 71.09 3jyt s THR 351 CO -0.07 0.00 0.97 0.61 -0.54 0.00 0.00 174.62 175.59 3jyt n GLY 352 N -0.80 0.32 3.26 3.99 0.00 0.81 -4.11 105.19 108.66 3jyt n GLY 352 Ca -0.04 -1.00 -0.16 0.00 0.00 0.00 0.00 46.02 44.83 3jyt n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jyt s LYS 353 N -2.01 1.51 -0.31 1.61 -2.85 -1.26 -0.69 119.74 115.74 3jyt s LYS 353 Ca 0.23 -1.82 0.04 0.00 -1.00 0.00 0.00 55.97 53.41 3jyt s LYS 353 Cb -0.01 0.31 0.17 0.00 -2.06 0.00 0.00 37.83 36.24 3jyt s LYS 353 CO -0.00 -0.54 0.46 -0.47 0.10 0.00 0.00 175.35 174.90 3jyt s TYR 354 N -3.76 -1.15 -0.48 1.78 6.14 -0.60 -4.96 117.35 114.32 3jyt s TYR 354 Ca 0.39 0.29 0.12 0.00 0.64 0.00 0.00 57.07 58.51 3jyt s TYR 354 Cb 0.04 -0.06 0.34 0.00 0.42 0.00 0.00 41.96 42.71 3jyt s TYR 354 CO 0.20 -1.02 1.27 0.00 0.64 0.00 0.00 175.55 176.63 3jyt n ALA 355 N 5.11 2.44 -2.64 3.97 0.00 -1.26 -2.27 120.51 125.85 3jyt n ALA 355 Ca 0.04 -1.65 -0.41 0.00 0.00 0.00 0.00 53.44 51.42 3jyt n ALA 355 Cb 0.50 -0.47 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 3jyt n ALA 355 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3jyt s ARG 356 N -1.78 4.18 -1.15 0.00 3.52 -1.26 -4.85 118.95 117.61 3jyt s ARG 356 Ca 0.27 0.80 -0.14 0.00 -0.13 0.00 0.00 55.73 56.53 3jyt s ARG 356 Cb 0.19 -3.63 0.17 0.00 -1.56 0.00 0.00 34.95 30.13 3jyt s ARG 356 CO 0.10 -0.43 1.35 -1.64 -0.81 0.00 0.00 175.30 173.87 3jyt s MET 357 N 2.54 4.00 -0.30 5.12 -1.94 -1.26 -4.98 119.30 122.47 3jyt s MET 357 Ca 0.32 -2.47 -0.29 0.00 -1.71 0.00 0.00 55.69 51.54 3jyt s MET 357 Cb -0.16 -5.00 -0.02 0.00 2.01 0.00 0.00 34.83 31.67 3jyt s MET 357 CO 0.09 -1.73 1.69 1.03 -0.01 0.00 0.00 175.02 176.09 3jyt s ARG 358 N 1.59 3.52 0.00 2.03 0.52 -1.26 -4.77 118.95 120.58 3jyt s ARG 358 Ca 0.40 1.45 0.00 0.00 -0.52 0.00 0.00 55.73 57.06 3jyt s ARG 358 Cb -0.04 -4.12 0.00 0.00 0.52 0.00 0.00 34.95 31.31 3jyt s ARG 358 CO -0.02 -1.63 0.00 0.41 0.02 0.00 0.00 175.30 174.08 3jyt n GLY 359 N 5.13 -2.22 0.00 -3.53 0.00 -1.26 -4.80 105.19 98.52 3jyt n GLY 359 Ca 0.21 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 44.02 3jyt n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyt n ALA 360 N 0.17 1.50 -3.28 4.61 0.00 -1.26 -4.88 120.51 117.37 3jyt n ALA 360 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 3jyt n ALA 360 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 3jyt n ALA 360 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3jyt n HIS 361 N -0.87 -0.15 -4.43 0.00 8.25 -1.26 -3.06 115.22 113.69 3jyt n HIS 361 Ca 0.00 -3.55 -0.23 0.00 -0.26 0.00 0.00 57.72 53.67 3jyt n HIS 361 Cb 0.00 -0.21 -0.08 0.00 1.12 0.00 0.00 29.99 30.82 3jyt n HIS 361 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3jyt s THR 362 N -0.96 0.39 0.00 1.59 -4.23 -1.22 -4.84 115.64 106.38 3jyt s THR 362 Ca 0.35 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 3jyt s THR 362 Cb 0.13 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.58 3jyt s THR 362 CO -0.13 0.00 0.00 -0.46 -0.54 0.00 0.00 174.62 173.49 3jyt n ASN 363 N -1.36 1.31 -0.05 3.99 0.23 -1.26 -3.04 115.26 115.09 3jyt n ASN 363 Ca -0.02 -0.62 -0.14 0.00 -0.53 0.00 0.00 54.58 53.27 3jyt n ASN 363 Cb 0.64 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.27 3jyt n ASN 363 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3jyt h ASP 364 N 0.00 0.59 0.22 0.53 3.32 -1.95 -1.80 116.42 117.33 3jyt h ASP 364 Ca 0.00 -0.56 -0.01 0.00 0.02 0.00 0.00 57.03 56.48 3jyt h ASP 364 Cb 0.00 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 3jyt h ASP 364 CO 0.00 1.04 -0.03 0.58 -1.72 0.00 0.00 179.24 179.12 3jyt h VAL 365 N 0.16 0.24 0.02 -1.35 2.07 -1.95 1.11 116.25 116.55 3jyt h VAL 365 Ca 0.00 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 3jyt h VAL 365 Cb 0.95 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 3jyt h VAL 365 CO 0.08 0.03 -0.01 0.11 0.02 0.00 0.00 177.57 177.80 3jyt h LYS 366 N 0.00 -0.02 0.00 1.57 1.57 -1.94 -2.74 116.57 115.02 3jyt h LYS 366 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3jyt h LYS 366 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3jyt h LYS 366 CO 0.00 0.75 0.00 1.96 -0.57 0.00 0.00 179.45 181.59 3jyt h GLN 367 N -0.92 0.00 0.06 3.15 4.20 -0.32 0.17 115.11 121.44 3jyt h GLN 367 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 3jyt h GLN 367 Cb 0.78 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.56 3jyt h GLN 367 CO 0.00 0.00 -0.44 1.25 -0.67 0.00 0.00 178.83 178.97 3jyt h LEU 368 N 0.00 0.18 -1.40 1.46 5.85 0.12 -2.99 115.31 118.53 3jyt h LEU 368 Ca 0.00 -0.95 -0.06 0.00 0.84 0.00 0.00 57.88 57.71 3jyt h LEU 368 Cb 0.24 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3jyt h LEU 368 CO 0.00 1.20 -0.30 0.71 -0.34 0.00 0.00 178.44 179.71 3jyt h THR 369 N -0.74 1.14 -0.36 1.05 1.35 -1.14 -0.75 112.91 113.45 3jyt h THR 369 Ca -0.09 -1.06 -0.00 0.00 -0.55 0.00 0.00 66.41 64.71 3jyt h THR 369 Cb 1.28 1.58 -0.02 0.00 -1.73 0.00 0.00 68.15 69.27 3jyt h THR 369 CO 0.04 0.30 0.21 -0.33 -0.25 0.00 0.00 175.52 175.49 3jyt h GLU 370 N 0.00 0.48 0.24 4.72 5.08 -0.70 -2.44 114.58 121.96 3jyt h GLU 370 Ca -0.00 -0.04 -0.33 0.00 -1.00 0.00 0.00 59.36 57.99 3jyt h GLU 370 Cb 0.56 -0.10 0.03 0.00 0.50 0.00 0.00 28.75 29.74 3jyt h GLU 370 CO 0.04 0.34 -1.46 0.00 -1.00 0.00 0.00 179.01 176.93 3jyt h ALA 371 N 1.74 -0.12 -0.63 3.43 0.00 -1.09 -3.22 119.26 119.37 3jyt h ALA 371 Ca 0.13 -0.87 0.15 0.00 0.00 0.00 0.00 54.91 54.32 3jyt h ALA 371 Cb -0.01 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3jyt h ALA 371 CO -0.02 0.74 0.44 0.28 0.00 0.00 0.00 179.25 180.69 3jyt h VAL 372 N 0.14 0.76 0.26 0.00 2.07 -0.71 -1.04 116.25 117.73 3jyt h VAL 372 Ca -0.25 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3jyt h VAL 372 Cb 2.15 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3jyt h VAL 372 CO 0.27 0.03 -0.13 1.56 0.02 0.00 0.00 177.57 179.32 3jyt h GLN 373 N 0.18 -0.34 -0.92 1.57 4.20 -1.57 -1.98 115.11 116.25 3jyt h GLN 373 Ca 0.30 0.02 0.18 0.00 0.06 0.00 0.00 58.65 59.21 3jyt h GLN 373 Cb 0.95 0.08 -0.17 0.00 0.30 0.00 0.00 27.48 28.64 3jyt h GLN 373 CO -0.05 -0.01 -0.25 1.17 -0.67 0.00 0.00 178.83 179.02 3jyt n LYS 374 N -5.02 -0.10 0.06 1.46 3.00 -0.62 0.72 118.16 117.65 3jyt n LYS 374 Ca -0.08 1.43 -0.03 0.00 -0.00 0.00 0.00 58.31 59.63 3jyt n LYS 374 Cb 0.25 -2.13 0.21 0.00 0.00 0.00 0.00 35.03 33.37 3jyt n LYS 374 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 3jyt h ILE 375 N 0.00 1.28 0.23 3.15 2.04 -1.25 -2.07 117.51 120.90 3jyt h ILE 375 Ca 0.42 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 3jyt h ILE 375 Cb 0.65 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 3jyt h ILE 375 CO -0.94 0.43 -0.11 0.74 0.00 0.00 0.00 178.15 178.27 3jyt h THR 376 N 0.31 0.56 -0.08 -0.27 2.02 0.11 0.91 112.91 116.48 3jyt h THR 376 Ca 0.04 -0.97 0.01 0.00 0.77 0.00 0.00 66.41 66.26 3jyt h THR 376 Cb 0.74 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3jyt h THR 376 CO 0.06 0.15 -0.08 0.74 0.37 0.00 0.00 175.52 176.75 3jyt h THR 377 N -0.95 0.00 -0.72 3.16 2.02 -1.07 0.29 112.91 115.65 3jyt h THR 377 Ca -0.03 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.26 3jyt h THR 377 Cb 0.47 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.76 3jyt h THR 377 CO 0.05 0.00 -0.41 -0.08 0.37 0.00 0.00 175.52 175.45 3jyt h GLU 378 N -0.04 -0.13 -0.98 6.66 4.81 -1.47 0.28 114.58 123.70 3jyt h GLU 378 Ca 0.01 0.01 0.20 0.00 -0.13 0.00 0.00 59.36 59.45 3jyt h GLU 378 Cb 0.08 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.38 3jyt h GLU 378 CO -0.10 -0.09 0.57 1.03 -0.73 0.00 0.00 179.01 179.70 3jyt h SER 379 N -0.14 0.70 0.47 1.04 0.87 0.37 0.11 113.55 116.97 3jyt h SER 379 Ca 0.23 0.11 -0.14 0.00 -1.23 0.00 0.00 61.79 60.76 3jyt h SER 379 Cb 0.56 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 3jyt h SER 379 CO -0.78 0.21 -0.62 0.40 -0.53 0.00 0.00 176.83 175.51 3jyt h ILE 380 N 0.68 1.41 -0.03 2.23 2.04 0.30 0.36 117.51 124.51 3jyt h ILE 380 Ca 0.58 -2.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.34 3jyt h ILE 380 Cb 0.96 2.08 -0.01 0.00 -0.74 0.00 0.00 36.82 39.11 3jyt h ILE 380 CO -0.41 0.60 -0.17 0.58 0.00 0.00 0.00 178.15 178.75 3jyt h VAL 381 N 0.10 1.14 0.00 1.67 2.07 0.67 0.24 116.25 122.15 3jyt h VAL 381 Ca -0.01 -0.64 -0.40 0.00 0.82 0.00 0.00 66.70 66.46 3jyt h VAL 381 Cb 1.12 1.30 -0.07 0.00 -1.52 0.00 0.00 31.29 32.12 3jyt h VAL 381 CO 0.09 0.19 -2.47 -0.38 0.02 0.00 0.00 177.57 175.02 3jyt n ILE 382 N -4.32 1.51 0.30 4.57 5.41 -0.57 -4.66 119.36 121.61 3jyt n ILE 382 Ca -0.02 -0.53 0.03 0.00 1.00 0.00 0.00 62.75 63.23 3jyt n ILE 382 Cb 0.25 -1.53 0.01 0.00 -0.71 0.00 0.00 39.64 37.66 3jyt n ILE 382 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 3jyt n TRP 383 N -3.48 0.00 -2.17 1.39 8.01 0.12 -4.69 117.44 116.62 3jyt n TRP 383 Ca -0.47 0.00 -0.16 0.00 -1.31 0.00 0.00 57.50 55.55 3jyt n TRP 383 Cb 0.97 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.24 3jyt n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3jyt n GLY 384 N 0.61 0.04 3.29 6.99 0.00 0.84 -4.91 105.19 112.05 3jyt n GLY 384 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 3jyt n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3jyt s LYS 385 N -4.60 1.39 -0.12 1.61 2.20 -1.26 -4.95 119.74 114.01 3jyt s LYS 385 Ca 0.00 -1.76 -0.00 0.00 -0.36 0.00 0.00 55.97 53.85 3jyt s LYS 385 Cb 0.00 -0.11 0.03 0.00 -1.51 0.00 0.00 37.83 36.23 3jyt s LYS 385 CO 0.00 -0.34 -0.08 -0.08 -0.36 0.00 0.00 175.35 174.49 3jyt s THR 386 N -3.83 1.09 0.69 3.43 -1.32 -1.26 -2.98 115.64 111.46 3jyt s THR 386 Ca 0.38 -0.37 -0.17 0.00 -1.21 0.00 0.00 61.69 60.32 3jyt s THR 386 Cb 0.07 -1.12 -0.00 0.00 -1.51 0.00 0.00 72.50 69.94 3jyt s THR 386 CO 0.14 0.34 1.04 -0.81 -2.21 0.00 0.00 174.62 173.12 3jyt n PRO 387 N 4.92 0.68 -2.95 7.08 -0.04 -1.26 -4.97 135.00 138.46 3jyt n PRO 387 Ca -0.13 0.29 -0.31 0.00 -0.04 0.00 0.00 63.50 63.31 3jyt n PRO 387 Cb 0.50 -2.28 -0.04 0.00 -0.04 0.00 0.00 33.50 31.63 3jyt n PRO 387 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3jyt s LYS 388 N -3.27 3.89 0.33 0.54 1.02 -0.27 -4.78 119.74 117.20 3jyt s LYS 388 Ca 0.76 0.58 0.09 0.00 0.02 0.00 0.00 55.97 57.42 3jyt s LYS 388 Cb -0.36 -2.39 -0.05 0.00 -0.52 0.00 0.00 37.83 34.50 3jyt s LYS 388 CO 0.47 0.03 0.05 -0.06 -0.92 0.00 0.00 175.35 174.93 3jyt s PHE 389 N -2.22 2.61 -0.17 3.18 0.08 -0.77 -1.77 117.98 118.92 3jyt s PHE 389 Ca 0.53 -0.40 -0.03 0.00 0.12 0.00 0.00 56.93 57.14 3jyt s PHE 389 Cb -0.10 -1.51 0.06 0.00 -0.57 0.00 0.00 43.02 40.89 3jyt s PHE 389 CO 0.25 0.45 0.05 0.15 -0.10 0.00 0.00 175.22 176.01 3jyt s LYS 390 N -3.75 0.49 -0.02 0.44 1.02 -0.86 -1.58 119.74 115.48 3jyt s LYS 390 Ca 0.35 -0.26 0.07 0.00 0.02 0.00 0.00 55.97 56.15 3jyt s LYS 390 Cb -0.01 -1.88 -0.02 0.00 -0.52 0.00 0.00 37.83 35.40 3jyt s LYS 390 CO 0.20 -0.60 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.31 3jyt s LEU 391 N 1.95 2.04 0.00 3.17 1.43 -0.90 -3.27 118.68 123.10 3jyt s LEU 391 Ca 0.01 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 3jyt s LEU 391 Cb -0.16 -1.11 0.00 0.00 0.03 0.00 0.00 46.19 44.95 3jyt s LEU 391 CO -0.08 0.26 1.02 -2.65 0.23 0.00 0.00 176.35 175.14 3jyt n PRO 392 N 2.55 0.76 -3.98 1.29 -0.02 -1.26 -1.56 135.00 132.79 3jyt n PRO 392 Ca -0.15 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.08 3jyt n PRO 392 Cb 0.53 -1.12 -0.17 0.00 -0.02 0.00 0.00 33.50 32.72 3jyt n PRO 392 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3jyt s ILE 393 N 0.32 0.82 0.23 4.25 2.07 -1.26 0.95 121.20 128.59 3jyt s ILE 393 Ca 0.00 -0.19 -0.29 0.00 -1.41 0.00 0.00 60.65 58.76 3jyt s ILE 393 Cb 0.00 -0.86 -0.16 0.00 0.13 0.00 0.00 42.46 41.57 3jyt s ILE 393 CO 0.00 0.32 0.84 0.00 -1.91 0.00 0.00 174.94 174.19 3jyt n GLN 394 N 4.77 0.76 0.00 3.50 1.13 -1.26 -4.79 117.38 121.49 3jyt n GLN 394 Ca -0.14 0.27 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 3jyt n GLN 394 Cb 0.50 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 29.34 3jyt n GLN 394 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 3jyt n LYS 395 N 0.97 0.00 -0.09 -1.09 3.00 -1.26 -1.70 118.16 118.00 3jyt n LYS 395 Ca 0.14 0.38 -0.16 0.00 -0.00 0.00 0.00 58.31 58.67 3jyt n LYS 395 Cb 0.28 -1.59 -0.07 0.00 0.00 0.00 0.00 35.03 33.65 3jyt n LYS 395 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3jyt n GLU 396 N -1.37 0.39 0.28 1.64 1.02 -1.26 -3.82 120.64 117.52 3jyt n GLU 396 Ca 0.00 0.13 0.07 0.00 -0.02 0.00 0.00 57.16 57.34 3jyt n GLU 396 Cb 0.09 -1.22 0.36 0.00 -0.02 0.00 0.00 31.44 30.65 3jyt n GLU 396 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3jyt h THR 397 N -0.35 0.00 0.00 2.62 2.02 -1.67 0.43 112.91 115.97 3jyt h THR 397 Ca -0.41 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.61 3jyt h THR 397 Cb 1.47 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 3jyt h THR 397 CO -0.18 0.00 -1.00 -0.25 0.37 0.00 0.00 175.52 174.46 3jyt h TRP 398 N 0.00 0.00 0.00 3.16 2.91 -1.73 -2.89 115.95 117.41 3jyt h TRP 398 Ca 0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 3jyt h TRP 398 Cb 1.20 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.85 3jyt h TRP 398 CO 0.00 1.02 0.03 0.39 -1.03 0.00 0.00 178.44 178.85 3jyt n GLU 399 N -4.50 0.00 0.00 2.65 1.02 0.14 -1.75 120.64 118.20 3jyt n GLU 399 Ca -0.24 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 3jyt n GLU 399 Cb 0.54 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3jyt n GLU 399 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3jyt n THR 400 N -1.10 0.00 -0.44 2.62 -1.04 -0.23 -4.07 114.28 110.01 3jyt n THR 400 Ca 0.00 0.21 0.37 0.00 -2.04 0.00 0.00 64.05 62.59 3jyt n THR 400 Cb 0.03 -1.13 0.65 0.00 -1.82 0.00 0.00 70.33 68.07 3jyt n THR 400 CO 0.00 0.00 0.00 -0.25 -0.64 0.00 0.00 175.07 174.18 3jyt h TRP 401 N 0.00 0.56 0.00 -1.42 2.91 -1.21 0.67 115.95 117.46 3jyt h TRP 401 Ca 0.00 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.00 3jyt h TRP 401 Cb 0.00 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.51 3jyt h TRP 401 CO 0.00 -0.26 -0.30 0.11 -1.03 0.00 0.00 178.44 176.96 3jyt h TRP 402 N 0.06 0.00 0.00 2.65 5.08 -1.60 0.23 115.95 122.37 3jyt h TRP 402 Ca 0.84 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.81 3jyt h TRP 402 Cb 2.62 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.78 3jyt h TRP 402 CO -0.01 0.74 0.00 -2.37 -1.28 0.00 0.00 178.44 175.52 3jyt n THR 403 N -4.62 1.12 -0.02 0.12 5.66 -0.96 -1.74 114.28 113.85 3jyt n THR 403 Ca -0.12 0.66 0.06 0.00 -3.05 0.00 0.00 64.05 61.60 3jyt n THR 403 Cb 0.38 -1.65 -0.12 0.00 -1.55 0.00 0.00 70.33 67.39 3jyt n THR 403 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3jyt n GLU 404 N -2.17 0.64 -2.04 1.09 -0.58 0.19 -4.99 120.64 112.77 3jyt n GLU 404 Ca -0.01 -0.12 -0.31 0.00 -0.42 0.00 0.00 57.16 56.30 3jyt n GLU 404 Cb 0.05 -1.36 -0.00 0.00 -0.57 0.00 0.00 31.44 29.55 3jyt n GLU 404 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 3jyt s TYR 405 N -2.95 3.57 -0.88 -0.32 5.04 0.79 -4.97 117.35 117.63 3jyt s TYR 405 Ca -0.06 1.35 0.26 0.00 -2.44 0.00 0.00 57.07 56.18 3jyt s TYR 405 Cb 0.09 -2.74 0.77 0.00 0.35 0.00 0.00 41.96 40.42 3jyt s TYR 405 CO 0.63 -0.58 1.63 -2.67 -1.34 0.00 0.00 175.55 173.21 3jyt n TRP 406 N -2.36 0.27 -4.05 4.97 2.14 -1.26 -4.85 117.44 112.31 3jyt n TRP 406 Ca 0.06 0.08 -0.30 0.00 2.07 0.00 0.00 57.50 59.41 3jyt n TRP 406 Cb 0.54 -0.53 -0.06 0.00 -0.81 0.00 0.00 31.31 30.44 3jyt n TRP 406 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 3jyt s GLN 407 N -3.05 2.92 -1.26 -2.67 -0.21 -1.26 -5.05 119.66 109.08 3jyt s GLN 407 Ca 0.11 -0.71 -0.15 0.00 0.02 0.00 0.00 55.36 54.63 3jyt s GLN 407 Cb 0.16 -2.73 0.13 0.00 1.00 0.00 0.00 33.01 31.57 3jyt s GLN 407 CO 0.63 0.55 1.59 0.00 -2.12 0.00 0.00 175.29 175.95 3jyt n ALA 408 N 0.30 3.81 -2.24 6.09 0.00 -1.26 -4.99 120.51 122.22 3jyt n ALA 408 Ca -0.08 -4.07 -0.40 0.00 0.00 0.00 0.00 53.44 48.89 3jyt n ALA 408 Cb 0.52 -3.30 -0.05 0.00 0.00 0.00 0.00 19.45 16.62 3jyt n ALA 408 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3jyt s THR 409 N 2.70 4.57 0.02 0.00 2.01 -1.26 -5.07 115.64 118.61 3jyt s THR 409 Ca 0.48 1.72 0.03 0.00 0.31 0.00 0.00 61.69 64.23 3jyt s THR 409 Cb 0.01 -4.15 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 3jyt s THR 409 CO 0.03 0.41 -0.10 0.86 -0.69 0.00 0.00 174.62 175.13 3jyt s TRP 410 N -0.42 0.92 -0.07 4.92 -0.00 -1.26 -4.98 118.94 118.05 3jyt s TRP 410 Ca 0.39 -0.30 0.01 0.00 -0.00 0.00 0.00 56.10 56.19 3jyt s TRP 410 Cb -0.22 -0.56 0.02 0.00 -0.00 0.00 0.00 33.47 32.71 3jyt s TRP 410 CO 0.25 -0.01 -0.06 0.42 -0.00 0.00 0.00 176.95 177.55 3jyt s ILE 411 N -0.71 0.74 0.28 5.86 1.01 -1.26 -5.02 121.20 122.10 3jyt s ILE 411 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 3jyt s ILE 411 Cb -0.06 -0.76 0.06 0.00 0.01 0.00 0.00 42.46 41.70 3jyt s ILE 411 CO 0.00 0.29 0.13 -2.65 0.00 0.00 0.00 174.94 172.72 3jyt n PRO 412 N 4.37 -0.69 -1.68 2.79 -0.02 -1.26 -4.78 135.00 133.73 3jyt n PRO 412 Ca -0.19 -0.22 -0.44 0.00 -2.02 0.00 0.00 63.50 60.63 3jyt n PRO 412 Cb 0.51 -0.40 -0.04 0.00 -0.02 0.00 0.00 33.50 33.55 3jyt n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3jyt n GLU 413 N -1.36 2.58 -3.79 -0.52 2.13 -1.26 -4.91 120.64 113.52 3jyt n GLU 413 Ca 0.02 0.94 -0.12 0.00 0.66 0.00 0.00 57.16 58.66 3jyt n GLU 413 Cb 0.09 -2.83 -0.08 0.00 0.27 0.00 0.00 31.44 28.89 3jyt n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 3jyt s TRP 414 N 3.40 -0.09 0.50 4.31 1.48 -1.26 -1.84 118.94 125.44 3jyt s TRP 414 Ca 0.87 0.05 0.02 0.00 -1.06 0.00 0.00 56.10 55.98 3jyt s TRP 414 Cb -0.55 0.05 -0.01 0.00 -1.16 0.00 0.00 33.47 31.81 3jyt s TRP 414 CO 0.43 -0.40 0.06 -1.21 -4.06 0.00 0.00 176.95 171.76 3jyt s GLU 415 N -1.79 2.19 0.12 3.25 2.02 -0.62 -4.95 118.70 118.91 3jyt s GLU 415 Ca -0.11 -2.31 0.03 0.00 0.02 0.00 0.00 54.97 52.61 3jyt s GLU 415 Cb -0.04 -1.63 -0.04 0.00 0.10 0.00 0.00 34.13 32.52 3jyt s GLU 415 CO 0.01 -0.36 0.14 0.12 0.02 0.00 0.00 175.26 175.19 3jyt s PHE 416 N -2.84 3.25 -0.30 1.61 5.36 -1.26 -2.12 117.98 121.67 3jyt s PHE 416 Ca 0.13 0.07 -0.03 0.00 -0.96 0.00 0.00 56.93 56.14 3jyt s PHE 416 Cb 0.02 -1.60 0.10 0.00 -0.34 0.00 0.00 43.02 41.20 3jyt s PHE 416 CO 0.07 0.53 0.13 0.54 -1.46 0.00 0.00 175.22 175.03 3jyt s VAL 417 N -1.57 0.25 -0.81 3.12 0.11 -0.60 -4.73 120.40 116.17 3jyt s VAL 417 Ca 0.31 -1.04 -0.25 0.00 -2.93 0.00 0.00 61.98 58.07 3jyt s VAL 417 Cb -0.11 -1.21 -0.07 0.00 -1.53 0.00 0.00 36.38 33.45 3jyt s VAL 417 CO 0.24 -0.73 2.09 0.21 -3.33 0.00 0.00 175.10 173.58 3jyt s ASN 418 N 1.86 4.77 -0.37 3.54 2.47 -1.26 -4.11 114.94 121.85 3jyt s ASN 418 Ca 0.10 -0.25 0.03 0.00 0.42 0.00 0.00 52.86 53.16 3jyt s ASN 418 Cb -0.17 -2.55 0.15 0.00 -1.45 0.00 0.00 41.25 37.24 3jyt s ASN 418 CO -0.31 -3.02 0.37 0.28 -3.72 0.00 0.00 177.10 170.71 3jyt s THR 419 N 11.37 -0.31 0.86 -5.21 -1.32 -1.26 -5.12 115.64 114.65 3jyt s THR 419 Ca 0.77 -1.02 -0.15 0.00 -1.21 0.00 0.00 61.69 60.08 3jyt s THR 419 Cb -0.10 -0.69 -0.03 0.00 -1.51 0.00 0.00 72.50 70.17 3jyt s THR 419 CO 0.06 -0.60 0.24 -0.81 -2.21 0.00 0.00 174.62 171.30 3jyt n PRO 420 N 4.23 -0.03 -2.33 7.08 -0.04 -1.26 -4.15 135.00 138.51 3jyt n PRO 420 Ca 0.11 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.20 3jyt n PRO 420 Cb 0.45 -1.68 -0.03 0.00 -0.04 0.00 0.00 33.50 32.20 3jyt n PRO 420 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3jyt s PRO 421 N -2.97 3.08 1.07 0.54 0.02 -1.26 -4.98 135.00 130.50 3jyt s PRO 421 Ca 0.57 0.33 -0.16 0.00 0.02 0.00 0.00 61.00 61.76 3jyt s PRO 421 Cb -0.27 -4.22 0.10 0.00 0.02 0.00 0.00 34.50 30.14 3jyt s PRO 421 CO 0.66 -2.22 0.25 1.28 -0.33 0.00 0.00 177.00 176.65 3jyt n LEU 422 N 10.42 -1.40 -4.17 -5.54 4.77 -1.26 -4.62 117.00 115.20 3jyt n LEU 422 Ca 0.12 0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.80 3jyt n LEU 422 Cb 0.50 -1.08 -0.15 0.00 -2.33 0.00 0.00 43.42 40.36 3jyt n LEU 422 CO 0.71 -3.25 -0.49 0.54 -1.33 0.00 0.00 177.39 173.56 3jyt s VAL 423 N -2.31 2.40 -0.02 4.08 0.11 0.27 -4.99 120.40 119.94 3jyt s VAL 423 Ca 0.58 -0.84 -0.07 0.00 -2.93 0.00 0.00 61.98 58.72 3jyt s VAL 423 Cb -0.16 -2.04 0.01 0.00 -1.53 0.00 0.00 36.38 32.65 3jyt s VAL 423 CO 0.66 0.50 0.15 -1.59 -3.33 0.00 0.00 175.10 171.50 3jyt s LYS 424 N 1.34 0.41 0.10 1.54 -2.85 -1.26 -4.08 119.74 114.94 3jyt s LYS 424 Ca 0.05 -0.21 -0.31 0.00 -1.00 0.00 0.00 55.97 54.50 3jyt s LYS 424 Cb -0.13 0.18 -0.10 0.00 -2.06 0.00 0.00 37.83 35.71 3jyt s LYS 424 CO -0.10 -0.09 1.87 1.28 0.10 0.00 0.00 175.35 178.40 3jyt n LEU 425 N 1.88 4.07 0.00 2.77 4.77 -1.26 -4.84 117.00 124.39 3jyt n LEU 425 Ca -0.20 0.97 0.03 0.00 -0.03 0.00 0.00 56.01 56.78 3jyt n LEU 425 Cb 0.56 -1.54 0.13 0.00 -2.33 0.00 0.00 43.42 40.25 3jyt n LEU 425 CO 0.21 0.18 0.57 0.79 -1.33 0.00 0.00 177.39 177.81 3jyt n TRP 426 N 6.02 0.00 0.00 -1.77 5.03 -1.26 -4.85 117.44 120.62 3jyt n TRP 426 Ca 0.18 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.71 3jyt n TRP 426 Cb 0.38 -0.42 0.00 0.00 -1.03 0.00 0.00 31.31 30.23 3jyt n TRP 426 CO 0.00 0.00 0.00 2.48 -0.03 0.00 0.00 177.69 180.14 3jyt n TYR 427 N -1.42 0.00 -3.96 -5.99 -0.00 -1.26 -4.73 117.16 99.80 3jyt n TYR 427 Ca 0.02 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.78 3jyt n TYR 427 Cb 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.39 3jyt n TYR 427 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 3jyt n GLN 428 N -0.19 1.24 -3.51 -3.48 1.13 -1.26 -4.96 117.38 106.35 3jyt n GLN 428 Ca 0.00 -1.67 -0.17 0.00 -1.94 0.00 0.00 57.00 53.22 3jyt n GLN 428 Cb 0.00 0.29 -0.13 0.00 0.11 0.00 0.00 30.24 30.52 3jyt n GLN 428 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3jyt s LEU 429 N 0.00 -0.15 0.02 1.08 1.43 -1.26 -4.82 118.68 114.97 3jyt s LEU 429 Ca 0.09 -0.11 -0.38 0.00 -1.03 0.00 0.00 54.13 52.69 3jyt s LEU 429 Cb -0.01 0.44 -0.18 0.00 0.03 0.00 0.00 46.19 46.48 3jyt s LEU 429 CO 0.05 -0.31 1.29 -0.62 0.23 0.00 0.00 176.35 176.99 3jyt n GLU 430 N 5.32 0.75 -0.78 1.70 -0.58 0.23 -4.85 120.64 122.43 3jyt n GLU 430 Ca -0.05 0.27 0.08 0.00 -0.42 0.00 0.00 57.16 57.04 3jyt n GLU 430 Cb 0.50 -1.87 0.38 0.00 -0.57 0.00 0.00 31.44 29.88 3jyt n GLU 430 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3jyt n LYS 431 N 2.44 4.41 -3.60 3.49 4.76 -1.26 -4.39 118.16 124.01 3jyt n LYS 431 Ca 0.20 -3.06 -0.09 0.00 -2.87 0.00 0.00 58.31 52.49 3jyt n LYS 431 Cb 0.14 -2.13 -0.10 0.00 -1.84 0.00 0.00 35.03 31.11 3jyt n LYS 431 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3jyt s GLU 432 N -2.52 0.31 0.12 1.97 2.56 -1.26 -5.12 118.70 114.75 3jyt s GLU 432 Ca 0.52 0.92 -0.21 0.00 0.00 0.00 0.00 54.97 56.20 3jyt s GLU 432 Cb 0.39 0.15 -0.12 0.00 2.00 0.00 0.00 34.13 36.54 3jyt s GLU 432 CO 0.18 -0.32 0.43 -2.30 -0.56 0.00 0.00 175.26 172.69 3jyt n PRO 433 N 5.38 0.00 -2.96 4.30 -0.02 -1.26 -4.87 135.00 135.57 3jyt n PRO 433 Ca -0.07 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.98 3jyt n PRO 433 Cb 0.50 -0.76 -0.05 0.00 -0.02 0.00 0.00 33.50 33.16 3jyt n PRO 433 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3jyt s ILE 434 N -0.58 4.57 0.54 4.25 1.01 -1.26 -5.04 121.20 124.70 3jyt s ILE 434 Ca 0.48 -0.02 -0.21 0.00 0.00 0.00 0.00 60.65 60.90 3jyt s ILE 434 Cb -0.69 -4.45 -0.06 0.00 0.01 0.00 0.00 42.46 37.26 3jyt s ILE 434 CO 0.39 -1.00 1.13 0.52 0.00 0.00 0.00 174.94 175.99 3jyt n VAL 435 N 5.97 3.43 -3.45 2.92 0.31 -1.26 -2.99 118.33 123.25 3jyt n VAL 435 Ca -0.02 -0.50 -0.22 0.00 -0.01 0.00 0.00 64.34 63.59 3jyt n VAL 435 Cb 0.47 -1.36 0.05 0.00 -0.91 0.00 0.00 33.84 32.09 3jyt n VAL 435 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3jyt n GLY 436 N 1.05 -1.10 3.16 2.92 0.00 -1.26 -5.00 105.19 104.97 3jyt n GLY 436 Ca 0.11 0.52 -0.09 0.00 0.00 0.00 0.00 46.02 46.56 3jyt n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyt s ALA 437 N -3.39 -1.05 -0.42 4.61 0.00 -1.16 -5.01 121.76 115.34 3jyt s ALA 437 Ca 0.43 1.30 -0.40 0.00 0.00 0.00 0.00 51.96 53.29 3jyt s ALA 437 Cb -0.11 -1.34 -0.15 0.00 0.00 0.00 0.00 23.12 21.52 3jyt s ALA 437 CO 0.80 -0.84 2.13 -1.91 0.00 0.00 0.00 175.76 175.95 3jyt n GLU 438 N 5.38 0.57 -2.63 0.00 2.13 -1.26 -4.67 120.64 120.15 3jyt n GLU 438 Ca -0.07 0.16 -0.42 0.00 0.66 0.00 0.00 57.16 57.49 3jyt n GLU 438 Cb 0.50 -1.99 -0.03 0.00 0.27 0.00 0.00 31.44 30.19 3jyt n GLU 438 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3jyt s THR 439 N 6.45 3.97 0.44 6.31 2.01 -1.26 -3.42 115.64 130.13 3jyt s THR 439 Ca 1.14 -0.29 -0.21 0.00 0.31 0.00 0.00 61.69 62.64 3jyt s THR 439 Cb -1.17 -4.92 -0.11 0.00 0.01 0.00 0.00 72.50 66.31 3jyt s THR 439 CO 0.58 -1.80 0.96 -0.36 -0.69 0.00 0.00 174.62 173.32 3jyt s PHE 440 N 4.94 3.29 -0.28 4.92 0.40 -0.23 -1.68 117.98 129.34 3jyt s PHE 440 Ca 0.37 1.60 0.02 0.00 -0.60 0.00 0.00 56.93 58.31 3jyt s PHE 440 Cb -0.06 -2.87 0.08 0.00 0.51 0.00 0.00 43.02 40.68 3jyt s PHE 440 CO 0.03 -0.19 -0.01 0.71 0.70 0.00 0.00 175.22 176.46 3jyt s TYR 441 N -2.19 2.78 0.09 0.36 1.51 0.22 -3.19 117.35 116.93 3jyt s TYR 441 Ca 0.62 -2.17 0.04 0.00 -1.01 0.00 0.00 57.07 54.55 3jyt s TYR 441 Cb -0.10 -2.01 -0.04 0.00 -0.11 0.00 0.00 41.96 39.70 3jyt s TYR 441 CO 0.15 -0.85 0.04 0.54 -1.11 0.00 0.00 175.55 174.31 3jyt s VAL 442 N 1.25 4.25 0.00 0.71 0.11 -1.19 -1.60 120.40 123.93 3jyt s VAL 442 Ca 0.01 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 3jyt s VAL 442 Cb -0.19 -3.04 0.00 0.00 -1.53 0.00 0.00 36.38 31.62 3jyt s VAL 442 CO -0.09 0.12 0.00 -0.67 -3.33 0.00 0.00 175.10 171.13 3jyt n ASP 443 N 0.52 0.00 -0.78 3.54 2.03 -0.36 -4.68 116.55 116.81 3jyt n ASP 443 Ca -0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.21 3jyt n ASP 443 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 3jyt n ASP 443 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3jyt n GLY 444 N -0.24 1.06 0.00 0.27 0.00 -1.26 0.39 105.19 105.41 3jyt n GLY 444 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3jyt n GLY 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyt n ALA 445 N -3.00 0.00 -3.11 4.61 0.00 0.31 -4.74 120.51 114.57 3jyt n ALA 445 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3jyt n ALA 445 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 3jyt n ALA 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jyt s ALA 446 N -2.00 0.17 -0.08 0.00 0.00 -1.26 0.26 121.76 118.85 3jyt s ALA 446 Ca 0.00 -1.17 -0.03 0.00 0.00 0.00 0.00 51.96 50.77 3jyt s ALA 446 Cb 0.00 1.06 -0.04 0.00 0.00 0.00 0.00 23.12 24.15 3jyt s ALA 446 CO 0.00 -0.84 0.05 1.21 0.00 0.00 0.00 175.76 176.18 3jyt s ASN 447 N -3.13 5.57 0.00 0.00 2.47 -0.30 -4.88 114.94 114.68 3jyt s ASN 447 Ca 0.25 0.21 0.00 0.00 0.42 0.00 0.00 52.86 53.75 3jyt s ASN 447 Cb -0.01 -1.63 0.00 0.00 -1.45 0.00 0.00 41.25 38.16 3jyt s ASN 447 CO 0.14 0.36 0.75 0.54 -3.72 0.00 0.00 177.10 175.18 3jyt n ARG 448 N 1.91 0.00 0.10 0.43 1.74 -1.26 -3.31 116.66 116.27 3jyt n ARG 448 Ca -0.18 0.68 -0.01 0.00 -0.77 0.00 0.00 57.85 57.57 3jyt n ARG 448 Cb 0.54 -1.25 -0.04 0.00 -1.02 0.00 0.00 32.46 30.69 3jyt n ARG 448 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3jyt h GLU 449 N 0.00 0.00 -7.38 5.56 5.08 -1.99 -3.46 114.58 112.39 3jyt h GLU 449 Ca 0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 3jyt h GLU 449 Cb 0.00 0.00 0.07 0.00 0.50 0.00 0.00 28.75 29.32 3jyt h GLU 449 CO 0.00 0.65 0.38 0.95 -1.00 0.00 0.00 179.01 179.99 3jyt s THR 450 N -2.87 3.91 0.00 1.13 -4.23 -1.21 -5.05 115.64 107.33 3jyt s THR 450 Ca 0.02 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 3jyt s THR 450 Cb 0.08 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.32 3jyt s THR 450 CO 0.78 -0.77 0.98 0.29 -0.54 0.00 0.00 174.62 175.36 3jyt n LYS 451 N -2.86 0.00 -0.20 3.99 4.76 -1.26 -4.55 118.16 118.04 3jyt n LYS 451 Ca 0.06 0.48 0.00 0.00 -2.87 0.00 0.00 58.31 55.98 3jyt n LYS 451 Cb 0.56 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.27 3jyt n LYS 451 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3jyt n LEU 452 N -1.94 0.00 0.00 -0.35 4.32 -1.26 -2.43 117.00 115.33 3jyt n LEU 452 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 3jyt n LEU 452 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3jyt n LEU 452 CO 0.00 -0.28 0.00 0.61 -1.22 0.00 0.00 177.39 176.50 3jyt n GLY 453 N 5.00 1.02 3.82 -0.72 0.00 -0.39 -1.15 105.19 112.78 3jyt n GLY 453 Ca 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 46.02 45.37 3jyt n GLY 453 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jyt s LYS 454 N 0.84 1.06 0.02 1.61 -2.85 0.71 -0.87 119.74 120.27 3jyt s LYS 454 Ca 0.00 -0.65 -0.28 0.00 -1.00 0.00 0.00 55.97 54.04 3jyt s LYS 454 Cb 0.00 0.32 0.08 0.00 -2.06 0.00 0.00 37.83 36.17 3jyt s LYS 454 CO 0.00 -0.49 0.70 0.00 0.10 0.00 0.00 175.35 175.65 3jyt s ALA 455 N -2.48 -1.73 0.18 0.59 0.00 -1.12 0.11 121.76 117.31 3jyt s ALA 455 Ca 0.19 1.01 -0.22 0.00 0.00 0.00 0.00 51.96 52.95 3jyt s ALA 455 Cb -0.01 0.30 0.08 0.00 0.00 0.00 0.00 23.12 23.48 3jyt s ALA 455 CO 0.03 -0.54 1.05 0.41 0.00 0.00 0.00 175.76 176.71 3jyt n GLY 456 N 0.32 0.58 3.35 0.00 0.00 0.16 -0.85 105.19 108.75 3jyt n GLY 456 Ca -0.17 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 3jyt n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3jyt s TYR 457 N -2.08 1.69 -0.18 1.61 -0.85 -0.81 -1.23 117.35 115.51 3jyt s TYR 457 Ca 0.23 -1.49 -0.12 0.00 -0.52 0.00 0.00 57.07 55.17 3jyt s TYR 457 Cb -0.03 -0.84 0.06 0.00 0.38 0.00 0.00 41.96 41.52 3jyt s TYR 457 CO 0.05 -0.64 0.45 0.14 -1.52 0.00 0.00 175.55 174.03 3jyt s VAL 458 N -3.47 -0.01 0.32 -3.49 -7.23 -0.63 -3.27 120.40 102.61 3jyt s VAL 458 Ca 0.35 0.05 0.02 0.00 -1.81 0.00 0.00 61.98 60.59 3jyt s VAL 458 Cb 0.03 -0.65 -0.03 0.00 0.56 0.00 0.00 36.38 36.29 3jyt s VAL 458 CO 0.21 0.02 0.50 0.42 -0.31 0.00 0.00 175.10 175.94 3jyt s THR 459 N 0.99 5.08 -0.80 5.32 -4.23 -1.01 0.69 115.64 121.69 3jyt s THR 459 Ca -0.06 -0.63 0.26 0.00 -1.18 0.00 0.00 61.69 60.08 3jyt s THR 459 Cb -0.06 -3.84 0.17 0.00 1.34 0.00 0.00 72.50 70.11 3jyt s THR 459 CO -0.08 -0.48 1.63 -0.46 -0.54 0.00 0.00 174.62 174.69 3jyt n ASN 460 N -1.69 0.57 -1.50 3.99 6.94 -0.68 -2.83 115.26 120.07 3jyt n ASN 460 Ca -0.06 0.32 0.11 0.00 -0.02 0.00 0.00 54.58 54.93 3jyt n ASN 460 Cb 0.56 -0.32 0.35 0.00 -2.36 0.00 0.00 39.78 38.01 3jyt n ASN 460 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 3jyt n LYS 461 N -1.96 3.28 -1.37 -3.83 2.85 -1.26 -5.00 118.16 110.86 3jyt n LYS 461 Ca 0.05 -2.80 -0.00 0.00 -1.05 0.00 0.00 58.31 54.51 3jyt n LYS 461 Cb 0.40 -1.75 -0.00 0.00 -0.65 0.00 0.00 35.03 33.03 3jyt n LYS 461 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3jyt n GLY 462 N 1.40 -2.94 3.64 2.58 0.00 -1.13 -5.13 105.19 103.62 3jyt n GLY 462 Ca 0.26 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 3jyt n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3jyt s ARG 463 N -1.29 0.29 -0.02 1.61 3.52 -1.26 -4.88 118.95 116.92 3jyt s ARG 463 Ca -0.00 0.44 0.04 0.00 -0.13 0.00 0.00 55.73 56.07 3jyt s ARG 463 Cb 0.00 0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.47 3jyt s ARG 463 CO 0.01 -0.05 -0.13 -1.14 -0.81 0.00 0.00 175.30 173.18 3jyt s GLN 464 N 0.85 1.20 0.01 5.12 0.74 -1.26 -2.39 119.66 123.94 3jyt s GLN 464 Ca -0.04 -0.47 -0.24 0.00 0.05 0.00 0.00 55.36 54.67 3jyt s GLN 464 Cb -0.04 -1.12 0.05 0.00 1.10 0.00 0.00 33.01 33.00 3jyt s GLN 464 CO -0.12 0.24 0.53 0.21 -0.55 0.00 0.00 175.29 175.60 3jyt s LYS 465 N -0.13 0.99 -0.23 1.67 2.20 -1.20 -5.05 119.74 117.99 3jyt s LYS 465 Ca 0.01 -0.10 -0.27 0.00 -0.36 0.00 0.00 55.97 55.25 3jyt s LYS 465 Cb -0.07 0.46 0.11 0.00 -1.51 0.00 0.00 37.83 36.82 3jyt s LYS 465 CO 0.00 -0.34 0.96 0.14 -0.36 0.00 0.00 175.35 175.76 3jyt s VAL 466 N -1.98 0.00 0.00 4.02 -7.23 -1.26 -1.91 120.40 112.04 3jyt s VAL 466 Ca -0.08 0.00 0.05 0.00 -1.81 0.00 0.00 61.98 60.14 3jyt s VAL 466 Cb -0.01 -1.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.92 3jyt s VAL 466 CO 0.02 0.00 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.98 3jyt s VAL 467 N -0.21 1.12 -0.87 1.32 1.01 -0.03 -4.98 120.40 117.76 3jyt s VAL 467 Ca 0.00 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.02 3jyt s VAL 467 Cb -0.03 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.40 3jyt s VAL 467 CO -0.02 0.23 1.62 -2.16 0.00 0.00 0.00 175.10 174.77 3jyt s PRO 468 N -0.55 3.08 0.31 2.72 0.04 -1.26 -2.80 135.00 136.54 3jyt s PRO 468 Ca 0.04 -0.45 -0.25 0.00 0.04 0.00 0.00 61.00 60.38 3jyt s PRO 468 Cb -0.06 -4.89 -0.10 0.00 0.04 0.00 0.00 34.50 29.49 3jyt s PRO 468 CO -0.00 -2.60 0.91 -0.51 0.04 0.00 0.00 177.00 174.84 3jyt s LEU 469 N 7.18 4.32 -0.18 -3.56 1.43 -0.05 -4.95 118.68 122.88 3jyt s LEU 469 Ca 0.54 1.77 0.01 0.00 -1.03 0.00 0.00 54.13 55.42 3jyt s LEU 469 Cb -0.05 -3.98 0.02 0.00 0.03 0.00 0.00 46.19 42.21 3jyt s LEU 469 CO 0.02 -0.07 -0.20 -0.89 0.23 0.00 0.00 176.35 175.45 3jyt s THR 470 N -1.63 2.10 0.00 5.49 2.01 -1.26 -1.26 115.64 121.10 3jyt s THR 470 Ca 0.50 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.57 3jyt s THR 470 Cb -0.18 -1.88 0.00 0.00 0.01 0.00 0.00 72.50 70.45 3jyt s THR 470 CO 0.23 0.54 0.00 0.59 -0.69 0.00 0.00 174.62 175.29 3jyt n ASN 471 N 4.55 -3.10 -4.23 3.53 3.02 -1.02 -4.96 115.26 113.05 3jyt n ASN 471 Ca -0.21 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.05 3jyt n ASN 471 Cb 0.50 -1.06 0.21 0.00 -0.61 0.00 0.00 39.78 38.83 3jyt n ASN 471 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3jyt s THR 472 N -2.02 1.80 0.32 3.41 -1.32 -1.26 -5.03 115.64 111.53 3jyt s THR 472 Ca 0.00 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 3jyt s THR 472 Cb 0.00 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.45 3jyt s THR 472 CO 0.00 0.00 0.15 0.42 -2.21 0.00 0.00 174.62 172.98 3jyt s THR 473 N -3.00 0.42 0.56 5.08 -4.23 -1.26 -4.86 115.64 108.36 3jyt s THR 473 Ca 0.68 -2.00 0.37 0.00 -1.18 0.00 0.00 61.69 59.56 3jyt s THR 473 Cb -0.14 -2.51 0.54 0.00 1.34 0.00 0.00 72.50 71.73 3jyt s THR 473 CO 0.57 0.00 1.71 0.78 -0.54 0.00 0.00 174.62 177.13 3jyt h ASN 474 N 2.16 0.00 0.00 3.99 4.21 -1.96 -2.23 115.58 121.75 3jyt h ASN 474 Ca -0.34 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 56.82 3jyt h ASN 474 Cb 1.25 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 38.40 3jyt h ASN 474 CO 0.54 0.00 -1.99 0.00 -1.29 0.00 0.00 177.43 174.69 3jyt n GLN 475 N -3.93 0.57 0.00 0.81 3.00 -1.26 -4.06 117.38 112.51 3jyt n GLN 475 Ca 0.26 0.36 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 3jyt n GLN 475 Cb 1.34 -1.57 0.00 0.00 0.00 0.00 0.00 30.24 30.01 3jyt n GLN 475 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3jyt n LYS 476 N -4.33 0.00 0.00 -1.09 5.02 -0.87 -2.40 118.16 114.49 3jyt n LYS 476 Ca -0.43 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 3jyt n LYS 476 Cb 0.78 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 3jyt n LYS 476 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3jyt n THR 477 N -1.05 0.00 -0.24 -0.18 -2.24 -1.03 -3.24 114.28 106.29 3jyt n THR 477 Ca 0.00 0.36 0.19 0.00 -2.27 0.00 0.00 64.05 62.33 3jyt n THR 477 Cb 0.12 -1.31 0.36 0.00 -2.10 0.00 0.00 70.33 67.39 3jyt n THR 477 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3jyt n GLU 478 N -2.12 -0.05 0.01 -0.78 4.07 -1.01 -0.13 120.64 120.63 3jyt n GLU 478 Ca 0.00 1.03 -0.04 0.00 -0.06 0.00 0.00 57.16 58.09 3jyt n GLU 478 Cb 0.00 -1.78 -0.03 0.00 -0.06 0.00 0.00 31.44 29.58 3jyt n GLU 478 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 3jyt h LEU 479 N 0.00 -0.11 -1.91 4.31 3.38 -1.76 -2.72 115.31 116.49 3jyt h LEU 479 Ca 0.56 -0.12 0.52 0.00 0.09 0.00 0.00 57.88 58.92 3jyt h LEU 479 Cb 1.39 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 42.08 3jyt h LEU 479 CO -0.60 0.43 1.25 -0.61 0.09 0.00 0.00 178.44 178.99 3jyt h GLN 480 N -1.02 0.01 0.05 1.13 5.75 -0.57 0.52 115.11 120.97 3jyt h GLN 480 Ca -0.01 -0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.37 3jyt h GLN 480 Cb 0.23 -0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.79 3jyt h GLN 480 CO 0.02 0.01 -0.49 0.00 -2.65 0.00 0.00 178.83 175.72 3jyt h ALA 481 N 1.16 -0.00 0.00 3.38 0.00 -0.57 -3.23 119.26 120.00 3jyt h ALA 481 Ca 0.86 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3jyt h ALA 481 Cb 3.36 0.04 0.00 0.00 0.00 0.00 0.00 17.79 21.19 3jyt h ALA 481 CO -0.07 0.24 0.00 -0.89 0.00 0.00 0.00 179.25 178.53 3jyt n ILE 482 N -4.32 0.96 -0.02 0.00 5.41 0.17 -2.35 119.36 119.21 3jyt n ILE 482 Ca -0.11 0.24 -0.16 0.00 1.00 0.00 0.00 62.75 63.72 3jyt n ILE 482 Cb 0.65 -1.05 -0.05 0.00 -0.71 0.00 0.00 39.64 38.48 3jyt n ILE 482 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 3jyt h TYR 483 N 0.00 1.00 0.10 1.39 3.20 -1.35 -3.30 116.97 118.02 3jyt h TYR 483 Ca 0.00 -0.42 -0.28 0.00 3.14 0.00 0.00 58.73 61.17 3jyt h TYR 483 Cb 0.15 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3jyt h TYR 483 CO 0.00 1.24 -1.32 -0.07 -1.64 0.00 0.00 178.16 176.37 3jyt h LEU 484 N 0.53 0.32 -0.26 2.82 3.38 -1.60 -3.30 115.31 117.20 3jyt h LEU 484 Ca -0.03 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.55 3jyt h LEU 484 Cb 1.33 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3jyt h LEU 484 CO 0.15 1.31 0.00 0.00 0.09 0.00 0.00 178.44 179.99 3jyt n ALA 485 N -2.55 1.62 0.00 1.53 0.00 -1.16 -0.01 120.51 119.95 3jyt n ALA 485 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3jyt n ALA 485 Cb 1.02 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 3jyt n ALA 485 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3jyt n LEU 486 N -0.27 0.03 -0.05 0.00 4.77 -1.24 -4.47 117.00 115.77 3jyt n LEU 486 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3jyt n LEU 486 Cb 0.01 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3jyt n LEU 486 CO 0.00 -0.04 0.57 0.06 -1.33 0.00 0.00 177.39 176.65 3jyt h GLN 487 N 0.00 0.70 -1.19 3.23 3.07 -1.57 -2.50 115.11 116.85 3jyt h GLN 487 Ca 0.00 -0.37 -0.24 0.00 0.09 0.00 0.00 58.65 58.14 3jyt h GLN 487 Cb 0.93 0.01 -0.13 0.00 0.08 0.00 0.00 27.48 28.38 3jyt h GLN 487 CO 0.00 0.98 0.30 -0.25 0.09 0.00 0.00 178.83 179.95 3jyt n ASP 488 N -4.03 4.30 -3.52 0.06 9.92 0.99 -4.81 116.55 119.46 3jyt n ASP 488 Ca -0.02 -2.77 -0.11 0.00 -0.53 0.00 0.00 54.79 51.36 3jyt n ASP 488 Cb 0.53 -0.78 -0.03 0.00 -0.64 0.00 0.00 41.12 40.21 3jyt n ASP 488 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 3jyt s SER 489 N 0.16 -0.44 0.00 -2.24 1.04 -0.94 -4.86 113.70 106.42 3jyt s SER 489 Ca 0.25 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.52 3jyt s SER 489 Cb 0.20 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.89 3jyt s SER 489 CO 0.03 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.89 3jyt n GLY 490 N -0.34 2.50 0.27 7.32 0.00 -1.26 -4.82 105.19 108.86 3jyt n GLY 490 Ca -0.16 -2.11 0.27 0.00 0.00 0.00 0.00 46.02 44.02 3jyt n GLY 490 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3jyt n LEU 491 N 0.00 0.28 -4.11 0.99 4.77 -1.26 -3.94 117.00 113.73 3jyt n LEU 491 Ca 0.00 1.36 -0.33 0.00 -0.03 0.00 0.00 56.01 57.01 3jyt n LEU 491 Cb 0.00 -0.66 -0.16 0.00 -2.33 0.00 0.00 43.42 40.26 3jyt n LEU 491 CO 0.00 -1.52 -0.53 -1.61 -1.33 0.00 0.00 177.39 172.40 3jyt s GLU 492 N -5.24 2.94 0.36 3.23 2.02 -1.26 -1.55 118.70 119.21 3jyt s GLU 492 Ca -0.07 -0.81 0.04 0.00 0.02 0.00 0.00 54.97 54.14 3jyt s GLU 492 Cb 0.28 -2.54 -0.03 0.00 0.10 0.00 0.00 34.13 31.94 3jyt s GLU 492 CO 0.65 -0.21 0.13 0.08 0.02 0.00 0.00 175.26 175.92 3jyt s VAL 493 N 1.30 0.62 -0.38 2.63 1.01 -1.11 -4.50 120.40 119.97 3jyt s VAL 493 Ca 0.05 -2.00 0.06 0.00 0.00 0.00 0.00 61.98 60.09 3jyt s VAL 493 Cb -0.13 -2.48 0.18 0.00 0.00 0.00 0.00 36.38 33.95 3jyt s VAL 493 CO -0.13 0.00 0.56 0.20 0.00 0.00 0.00 175.10 175.73 3jyt s ASN 494 N -3.52 -0.86 0.16 3.32 0.01 -1.22 -3.78 114.94 109.05 3jyt s ASN 494 Ca 0.30 -0.77 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 3jyt s ASN 494 Cb 0.04 1.63 -0.04 0.00 0.41 0.00 0.00 41.25 43.29 3jyt s ASN 494 CO 0.16 -0.22 0.32 -0.63 -1.51 0.00 0.00 177.10 175.22 3jyt s ILE 495 N 1.96 5.28 0.04 0.60 1.01 -1.13 -1.07 121.20 127.89 3jyt s ILE 495 Ca 0.15 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 3jyt s ILE 495 Cb -0.08 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 3jyt s ILE 495 CO -0.11 -0.08 -0.03 0.54 0.00 0.00 0.00 174.94 175.26 3jyt s VAL 496 N -1.75 0.17 0.07 2.92 0.11 -1.19 -3.37 120.40 117.35 3jyt s VAL 496 Ca 0.37 -1.42 -0.13 0.00 -2.93 0.00 0.00 61.98 57.87 3jyt s VAL 496 Cb -0.11 -0.97 0.02 0.00 -1.53 0.00 0.00 36.38 33.79 3jyt s VAL 496 CO 0.28 -0.78 0.30 0.28 -3.33 0.00 0.00 175.10 171.86 3jyt s THR 497 N -2.84 0.09 -1.97 5.04 -1.32 -0.72 -3.18 115.64 110.74 3jyt s THR 497 Ca -0.03 -0.75 0.21 0.00 -1.21 0.00 0.00 61.69 59.91 3jyt s THR 497 Cb 0.00 -1.06 0.01 0.00 -1.51 0.00 0.00 72.50 69.94 3jyt s THR 497 CO -0.06 -0.41 1.04 -0.90 -2.21 0.00 0.00 174.62 172.08 3jyt n ASP 498 N 0.30 2.01 -4.95 8.08 3.85 -1.24 -1.63 116.55 122.97 3jyt n ASP 498 Ca -0.17 -1.50 -0.23 0.00 -0.71 0.00 0.00 54.79 52.18 3jyt n ASP 498 Cb 0.61 0.44 -0.01 0.00 -1.35 0.00 0.00 41.12 40.81 3jyt n ASP 498 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 3jyt s SER 499 N -2.29 6.20 -0.00 -1.12 0.15 -1.26 -4.05 113.70 111.32 3jyt s SER 499 Ca 0.18 0.27 0.01 0.00 0.70 0.00 0.00 55.95 57.11 3jyt s SER 499 Cb 0.17 -1.83 -0.01 0.00 -1.71 0.00 0.00 66.02 62.63 3jyt s SER 499 CO 0.51 -0.32 0.01 0.00 1.20 0.00 0.00 173.24 174.64 3jyt n GLN 500 N -1.73 0.68 0.10 5.44 6.02 -1.26 -4.42 117.38 122.21 3jyt n GLN 500 Ca -0.04 -0.01 -0.15 0.00 -0.01 0.00 0.00 57.00 56.80 3jyt n GLN 500 Cb 0.57 -1.02 -0.08 0.00 1.02 0.00 0.00 30.24 30.73 3jyt n GLN 500 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 3jyt h TYR 501 N 0.00 -1.27 0.00 1.08 3.20 -2.00 0.46 116.97 118.43 3jyt h TYR 501 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3jyt h TYR 501 Cb 0.20 0.55 0.00 0.00 1.54 0.00 0.00 36.73 39.02 3jyt h TYR 501 CO 0.00 -0.54 0.00 0.00 -1.64 0.00 0.00 178.16 175.98 3jyt h ALA 502 N -0.24 1.00 -0.11 1.82 0.00 -1.96 -3.01 119.26 116.77 3jyt h ALA 502 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3jyt h ALA 502 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3jyt h ALA 502 CO -0.27 0.00 -0.27 1.25 0.00 0.00 0.00 179.25 179.96 3jyt h LEU 503 N 0.00 0.43 -0.29 0.00 5.85 -1.24 -2.89 115.31 117.17 3jyt h LEU 503 Ca 0.00 -0.58 -0.20 0.00 0.84 0.00 0.00 57.88 57.94 3jyt h LEU 503 Cb 0.56 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3jyt h LEU 503 CO 0.00 0.93 -0.69 1.23 -0.34 0.00 0.00 178.44 179.57 3jyt h GLY 504 N -0.06 0.77 0.36 3.75 0.00 -1.03 -0.79 103.07 106.07 3jyt h GLY 504 Ca -0.00 -1.02 0.06 0.00 0.00 0.00 0.00 47.33 46.37 3jyt h GLY 504 CO 0.06 0.91 -0.08 -2.22 0.00 0.00 0.00 176.54 175.21 3jyt h ILE 505 N 0.50 0.67 -0.09 2.60 2.04 -1.59 0.15 117.51 121.80 3jyt h ILE 505 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 3jyt h ILE 505 Cb 1.29 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3jyt h ILE 505 CO 0.14 0.00 0.00 -0.38 0.00 0.00 0.00 178.15 177.91 3jyt n ILE 506 N -5.27 0.11 0.84 -0.67 5.41 -1.09 -3.38 119.36 115.31 3jyt n ILE 506 Ca 0.00 -0.21 0.12 0.00 1.00 0.00 0.00 62.75 63.66 3jyt n ILE 506 Cb 0.18 0.13 0.20 0.00 -0.71 0.00 0.00 39.64 39.45 3jyt n ILE 506 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 3jyt n GLN 507 N -0.11 0.11 -0.11 0.38 -0.06 0.50 -3.62 117.38 114.46 3jyt n GLN 507 Ca 0.16 0.02 0.12 0.00 -2.00 0.00 0.00 57.00 55.30 3jyt n GLN 507 Cb 0.24 -1.56 0.17 0.00 -4.06 0.00 0.00 30.24 25.03 3jyt n GLN 507 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3jyt n ALA 508 N -1.62 2.44 -2.24 1.69 0.00 -1.03 -4.95 120.51 114.80 3jyt n ALA 508 Ca 0.04 -0.87 -0.15 0.00 0.00 0.00 0.00 53.44 52.46 3jyt n ALA 508 Cb 0.37 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.96 3jyt n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3jyt n GLN 509 N 1.45 -1.91 -1.58 0.00 6.02 -1.24 -4.84 117.38 115.28 3jyt n GLN 509 Ca 0.17 0.76 -0.40 0.00 -0.01 0.00 0.00 57.00 57.52 3jyt n GLN 509 Cb 0.61 -5.32 0.02 0.00 1.02 0.00 0.00 30.24 26.57 3jyt n GLN 509 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3jyt n PRO 510 N -2.71 1.09 0.00 -1.09 -0.02 -1.26 -4.81 135.00 126.21 3jyt n PRO 510 Ca -0.17 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 3jyt n PRO 510 Cb 0.61 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 3jyt n PRO 510 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3jyt n ASP 511 N 0.40 1.50 -3.67 2.55 5.68 -1.23 -4.87 116.55 116.90 3jyt n ASP 511 Ca 0.11 -1.74 -0.08 0.00 -0.50 0.00 0.00 54.79 52.57 3jyt n ASP 511 Cb 0.41 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.30 3jyt n ASP 511 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3jyt s LYS 512 N -0.74 0.41 0.06 0.11 1.02 -1.17 -5.01 119.74 114.42 3jyt s LYS 512 Ca 0.00 1.00 -0.03 0.00 0.02 0.00 0.00 55.97 56.96 3jyt s LYS 512 Cb 0.00 0.23 -0.03 0.00 -0.52 0.00 0.00 37.83 37.52 3jyt s LYS 512 CO 0.00 -0.20 0.04 0.45 -0.92 0.00 0.00 175.35 174.72 3jyt s SER 513 N 2.11 0.37 0.35 2.83 0.15 -1.26 -3.37 113.70 114.88 3jyt s SER 513 Ca -0.06 -0.90 0.18 0.00 0.70 0.00 0.00 55.95 55.88 3jyt s SER 513 Cb -0.10 0.24 0.46 0.00 -1.71 0.00 0.00 66.02 64.91 3jyt s SER 513 CO -0.14 -0.64 1.63 -0.33 1.20 0.00 0.00 173.24 174.95 3jyt h GLU 514 N 3.02 0.00 -5.42 5.44 5.08 -1.91 -3.42 114.58 117.38 3jyt h GLU 514 Ca -0.34 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.38 3jyt h GLU 514 Cb 1.16 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.26 3jyt h GLU 514 CO 0.63 0.40 0.39 0.45 -1.00 0.00 0.00 179.01 179.88 3jyt s SER 515 N -6.40 6.25 0.27 1.42 0.15 -1.26 -4.94 113.70 109.18 3jyt s SER 515 Ca 0.02 -0.77 0.07 0.00 0.70 0.00 0.00 55.95 55.97 3jyt s SER 515 Cb 0.09 -2.38 0.78 0.00 -1.71 0.00 0.00 66.02 62.80 3jyt s SER 515 CO 0.70 -1.20 1.26 1.21 1.20 0.00 0.00 173.24 176.42 3jyt n GLU 516 N 7.11 -0.06 -0.05 5.44 2.13 -1.26 0.92 120.64 134.88 3jyt n GLU 516 Ca -0.03 1.17 -0.08 0.00 0.66 0.00 0.00 57.16 58.88 3jyt n GLU 516 Cb 0.46 -1.94 -0.01 0.00 0.27 0.00 0.00 31.44 30.22 3jyt n GLU 516 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3jyt h LEU 517 N 0.00 -0.41 -0.38 4.31 6.46 -1.96 -1.49 115.31 121.84 3jyt h LEU 517 Ca 0.56 0.10 0.07 0.00 -0.12 0.00 0.00 57.88 58.49 3jyt h LEU 517 Cb 1.29 0.22 -0.07 0.00 -0.73 0.00 0.00 40.66 41.38 3jyt h LEU 517 CO -0.70 -0.16 -0.05 0.58 -0.62 0.00 0.00 178.44 177.49 3jyt h VAL 518 N -0.10 0.66 -0.54 1.05 2.07 0.15 0.17 116.25 119.72 3jyt h VAL 518 Ca 0.13 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.74 3jyt h VAL 518 Cb 0.29 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3jyt h VAL 518 CO -0.30 0.01 0.37 0.78 0.02 0.00 0.00 177.57 178.45 3jyt h ASN 519 N 0.04 0.26 0.06 0.57 2.35 -1.20 0.39 115.58 118.06 3jyt h ASN 519 Ca 0.19 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.84 3jyt h ASN 519 Cb 0.28 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 3jyt h ASN 519 CO -0.36 0.16 -0.33 1.56 -1.65 0.00 0.00 177.43 176.81 3jyt h GLN 520 N 0.29 0.39 0.04 0.81 4.20 0.32 0.29 115.11 121.45 3jyt h GLN 520 Ca 0.25 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 3jyt h GLN 520 Cb 0.60 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.37 3jyt h GLN 520 CO -0.06 0.68 -0.02 0.82 -0.67 0.00 0.00 178.83 179.58 3jyt h ILE 521 N 0.33 1.26 0.58 2.54 2.04 -0.18 -2.28 117.51 121.80 3jyt h ILE 521 Ca 0.04 -0.99 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3jyt h ILE 521 Cb 0.75 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 3jyt h ILE 521 CO 0.06 0.25 -0.49 0.40 0.00 0.00 0.00 178.15 178.37 3jyt h ILE 522 N -0.49 0.04 -0.81 -0.67 2.04 -1.27 0.31 117.51 116.66 3jyt h ILE 522 Ca -0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.01 3jyt h ILE 522 Cb 0.45 0.04 -0.15 0.00 -0.74 0.00 0.00 36.82 36.41 3jyt h ILE 522 CO 0.01 0.00 -0.21 1.21 0.00 0.00 0.00 178.15 179.16 3jyt n GLU 523 N -5.58 -0.08 -0.03 2.37 2.13 0.10 1.00 120.64 120.55 3jyt n GLU 523 Ca -0.13 1.26 -0.14 0.00 0.66 0.00 0.00 57.16 58.81 3jyt n GLU 523 Cb 0.47 -1.88 -0.09 0.00 0.27 0.00 0.00 31.44 30.21 3jyt n GLU 523 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 3jyt h GLN 524 N 0.00 0.19 -1.10 5.31 1.08 -1.01 -3.23 115.11 116.34 3jyt h GLN 524 Ca 0.38 -0.13 0.32 0.00 -1.45 0.00 0.00 58.65 57.78 3jyt h GLN 524 Cb 0.59 0.02 -0.12 0.00 -0.05 0.00 0.00 27.48 27.92 3jyt h GLN 524 CO -0.83 0.73 0.69 -0.07 -0.95 0.00 0.00 178.83 178.41 3jyt h LEU 525 N -0.33 0.42 -0.84 1.46 3.38 0.45 0.49 115.31 120.34 3jyt h LEU 525 Ca -0.00 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 3jyt h LEU 525 Cb 0.74 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 3jyt h LEU 525 CO 0.03 -0.03 0.23 0.40 0.09 0.00 0.00 178.44 179.16 3jyt h ILE 526 N 0.31 1.25 -0.61 1.22 2.04 -0.67 -3.16 117.51 117.90 3jyt h ILE 526 Ca 0.69 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 3jyt h ILE 526 Cb 1.80 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 3jyt h ILE 526 CO -0.40 0.34 0.13 0.11 0.00 0.00 0.00 178.15 178.33 3jyt h LYS 527 N 1.05 0.96 -6.83 2.37 1.57 -0.11 -3.44 116.57 112.14 3jyt h LYS 527 Ca 0.23 -0.22 -0.49 0.00 -1.87 0.00 0.00 60.65 58.30 3jyt h LYS 527 Cb 0.28 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3jyt h LYS 527 CO -0.01 0.86 0.42 0.15 -0.57 0.00 0.00 179.45 180.30 3jyt s LYS 528 N -5.22 4.59 0.00 3.15 -0.14 -1.12 -4.92 119.74 116.08 3jyt s LYS 528 Ca -0.11 1.61 0.26 0.00 -1.36 0.00 0.00 55.97 56.38 3jyt s LYS 528 Cb 0.15 -3.04 0.90 0.00 -1.68 0.00 0.00 37.83 34.16 3jyt s LYS 528 CO 0.82 0.23 1.65 0.39 -0.76 0.00 0.00 175.35 177.68 3jyt n GLU 529 N 0.94 1.76 -3.59 1.68 -0.58 -0.59 -4.85 120.64 115.41 3jyt n GLU 529 Ca 0.00 -1.11 -0.02 0.00 -0.42 0.00 0.00 57.16 55.61 3jyt n GLU 529 Cb 0.47 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 29.81 3jyt n GLU 529 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3jyt s LYS 530 N -1.95 0.38 -0.18 3.49 1.02 -0.68 -4.99 119.74 116.83 3jyt s LYS 530 Ca 0.36 0.71 -0.11 0.00 0.02 0.00 0.00 55.97 56.95 3jyt s LYS 530 Cb 0.20 0.17 0.06 0.00 -0.52 0.00 0.00 37.83 37.74 3jyt s LYS 530 CO 0.32 -0.09 0.45 0.08 -0.92 0.00 0.00 175.35 175.19 3jyt s VAL 531 N 1.62 -0.02 0.22 3.17 1.01 -1.26 -2.75 120.40 122.38 3jyt s VAL 531 Ca -0.08 0.06 0.10 0.00 0.00 0.00 0.00 61.98 62.07 3jyt s VAL 531 Cb -0.04 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 3jyt s VAL 531 CO -0.16 0.03 -0.15 -0.47 0.00 0.00 0.00 175.10 174.35 3jyt s TYR 532 N 1.20 2.47 -0.31 5.22 5.04 -1.25 -0.60 117.35 129.11 3jyt s TYR 532 Ca -0.08 -0.29 0.04 0.00 -2.44 0.00 0.00 57.07 54.31 3jyt s TYR 532 Cb -0.07 -1.17 0.17 0.00 0.35 0.00 0.00 41.96 41.24 3jyt s TYR 532 CO -0.11 0.56 0.49 -1.17 -1.34 0.00 0.00 175.55 173.98 3jyt s LEU 533 N -3.02 -1.07 0.51 6.97 2.96 -1.25 -2.84 118.68 120.93 3jyt s LEU 533 Ca 0.25 -0.35 0.09 0.00 -0.22 0.00 0.00 54.13 53.90 3jyt s LEU 533 Cb -0.07 1.44 0.05 0.00 0.50 0.00 0.00 46.19 48.10 3jyt s LEU 533 CO 0.14 -0.31 0.64 0.00 -1.32 0.00 0.00 176.35 175.50 3jyt s ALA 534 N 2.46 4.57 0.04 5.97 0.00 -1.22 -4.98 121.76 128.60 3jyt s ALA 534 Ca 0.11 -1.89 0.04 0.00 0.00 0.00 0.00 51.96 50.22 3jyt s ALA 534 Cb -0.11 -1.40 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 3jyt s ALA 534 CO -0.24 -0.58 -0.12 -0.46 0.00 0.00 0.00 175.76 174.36 3jyt s TRP 535 N -2.56 1.00 -0.07 0.00 -0.00 -1.26 -1.75 118.94 114.30 3jyt s TRP 535 Ca 0.56 -0.37 -0.06 0.00 -0.00 0.00 0.00 56.10 56.22 3jyt s TRP 535 Cb -0.06 -0.59 0.02 0.00 -0.00 0.00 0.00 33.47 32.83 3jyt s TRP 535 CO 0.34 0.01 0.19 0.14 -0.00 0.00 0.00 176.95 177.63 3jyt s VAL 536 N -0.94 -0.01 0.32 5.86 -7.23 -0.65 -4.97 120.40 112.79 3jyt s VAL 536 Ca -0.02 0.02 -0.24 0.00 -1.81 0.00 0.00 61.98 59.93 3jyt s VAL 536 Cb -0.08 -0.28 -0.16 0.00 0.56 0.00 0.00 36.38 36.42 3jyt s VAL 536 CO 0.01 0.01 0.35 -0.81 -0.31 0.00 0.00 175.10 174.35 3jyt n PRO 537 N 3.15 0.13 -3.40 4.82 -0.04 -1.26 -3.66 135.00 134.73 3jyt n PRO 537 Ca -0.14 0.05 -0.36 0.00 -0.04 0.00 0.00 63.50 63.00 3jyt n PRO 537 Cb 0.58 -1.10 -0.06 0.00 -0.04 0.00 0.00 33.50 32.88 3jyt n PRO 537 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3jyt s ALA 538 N -1.36 3.62 -1.48 0.55 0.00 -1.26 -4.27 121.76 117.56 3jyt s ALA 538 Ca 0.62 -0.17 -0.10 0.00 0.00 0.00 0.00 51.96 52.31 3jyt s ALA 538 Cb -0.75 -2.47 0.06 0.00 0.00 0.00 0.00 23.12 19.96 3jyt s ALA 538 CO 0.59 0.47 0.85 0.72 0.00 0.00 0.00 175.76 178.40 3jyt n HIS 539 N 1.03 -2.11 -2.06 0.00 8.25 -1.26 -4.84 115.22 114.23 3jyt n HIS 539 Ca -0.07 0.87 0.05 0.00 -0.26 0.00 0.00 57.72 58.31 3jyt n HIS 539 Cb 0.52 -3.99 0.11 0.00 1.12 0.00 0.00 29.99 27.75 3jyt n HIS 539 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3jyt n LYS 540 N -4.54 0.72 -2.77 -0.41 4.76 -1.26 -5.04 118.16 109.63 3jyt n LYS 540 Ca -0.07 -2.55 -0.27 0.00 -2.87 0.00 0.00 58.31 52.54 3jyt n LYS 540 Cb 0.58 -0.76 0.03 0.00 -1.84 0.00 0.00 35.03 33.03 3jyt n LYS 540 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3jyt n GLY 541 N -0.27 0.10 3.54 0.72 0.00 -1.26 -4.98 105.19 103.05 3jyt n GLY 541 Ca 0.12 0.80 -0.28 0.00 0.00 0.00 0.00 46.02 46.65 3jyt n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jyt s ILE 542 N -1.06 3.10 0.18 -0.61 1.01 -1.26 -4.99 121.20 117.57 3jyt s ILE 542 Ca 0.26 -1.54 -0.31 0.00 0.00 0.00 0.00 60.65 59.06 3jyt s ILE 542 Cb -0.03 -2.48 -0.17 0.00 0.01 0.00 0.00 42.46 39.79 3jyt s ILE 542 CO 0.61 -0.00 0.78 0.61 0.00 0.00 0.00 174.94 176.94 3jyt n GLY 543 N 0.40 -1.01 4.60 6.18 0.00 -1.26 -0.26 105.19 113.84 3jyt n GLY 543 Ca -0.13 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.32 3jyt n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jyt n GLY 544 N 1.79 0.00 0.10 -0.02 0.00 -1.26 -4.72 105.19 101.08 3jyt n GLY 544 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 3jyt n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3jyt h ASN 545 N 0.00 -0.15 -0.77 1.61 -0.73 -1.04 -3.35 115.58 111.14 3jyt h ASN 545 Ca 0.00 0.01 0.16 0.00 1.87 0.00 0.00 56.30 58.34 3jyt h ASN 545 Cb 0.00 0.04 -0.11 0.00 0.27 0.00 0.00 38.32 38.52 3jyt h ASN 545 CO 0.00 0.23 0.27 -0.33 -0.37 0.00 0.00 177.43 177.23 3jyt h GLU 546 N -0.85 0.36 -0.41 6.67 5.08 -1.84 -2.03 114.58 121.56 3jyt h GLU 546 Ca -0.02 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.41 3jyt h GLU 546 Cb 0.14 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.21 3jyt h GLU 546 CO 0.03 0.24 -0.26 1.96 -1.00 0.00 0.00 179.01 179.98 3jyt h GLN 547 N 0.37 -0.18 -0.69 2.33 7.50 -1.89 -1.03 115.11 121.51 3jyt h GLN 547 Ca 0.44 0.01 0.08 0.00 0.50 0.00 0.00 58.65 59.69 3jyt h GLN 547 Cb 0.74 0.04 -0.07 0.00 0.05 0.00 0.00 27.48 28.24 3jyt h GLN 547 CO -0.47 -0.12 0.36 0.28 -1.50 0.00 0.00 178.83 177.38 3jyt h VAL 548 N -0.19 0.89 -0.03 -0.54 2.07 -1.50 -1.58 116.25 115.38 3jyt h VAL 548 Ca 0.19 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3jyt h VAL 548 Cb 0.49 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 3jyt h VAL 548 CO -0.52 0.11 -0.18 0.44 0.02 0.00 0.00 177.57 177.44 3jyt h ASP 549 N 0.63 -0.57 -0.17 0.57 3.32 -1.01 -2.53 116.42 116.66 3jyt h ASP 549 Ca 0.33 0.07 0.05 0.00 0.02 0.00 0.00 57.03 57.50 3jyt h ASP 549 Cb 0.31 0.22 -0.07 0.00 0.22 0.00 0.00 39.33 40.01 3jyt h ASP 549 CO -0.24 -0.17 -0.41 0.11 -1.72 0.00 0.00 179.24 176.81 3jyt h LYS 550 N -0.21 -0.44 -1.21 3.56 1.57 -1.30 4.30 116.57 122.84 3jyt h LYS 550 Ca 0.01 0.03 0.35 0.00 -1.87 0.00 0.00 60.65 59.17 3jyt h LYS 550 Cb 0.23 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 3jyt h LYS 550 CO -0.14 -0.29 1.07 -0.07 -0.57 0.00 0.00 179.45 179.45 3jyt h LEU 551 N -0.46 0.00 0.00 2.94 3.38 -1.14 -2.43 115.31 117.60 3jyt h LEU 551 Ca 0.09 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 3jyt h LEU 551 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3jyt h LEU 551 CO -0.42 0.00 -1.49 0.52 0.09 0.00 0.00 178.44 177.14 3jyt n VAL 552 N -3.69 0.49 0.20 1.22 0.31 0.43 -4.67 118.33 112.61 3jyt n VAL 552 Ca 0.27 -0.18 0.10 0.00 -0.01 0.00 0.00 64.34 64.51 3jyt n VAL 552 Cb 1.45 -0.86 0.28 0.00 -0.91 0.00 0.00 33.84 33.80 3jyt n VAL 552 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3jyt h SER 553 N -0.02 0.00 0.00 4.52 4.64 0.87 -3.46 113.55 120.10 3jyt h SER 553 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 3jyt h SER 553 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3jyt h SER 553 CO -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.92