#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i0r n GLU 6 N 0.00 1.85 -3.84 0.38 0.00 -1.26 -4.82 120.64 112.95 3i0r n GLU 6 Ca 0.00 0.67 -0.37 0.00 0.00 0.00 0.00 57.16 57.46 3i0r n GLU 6 Cb 0.00 -2.54 -0.06 0.00 0.00 0.00 0.00 31.44 28.84 3i0r n GLU 6 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3i0r s THR 7 N -1.26 5.46 0.11 3.84 -4.23 -1.26 -5.04 115.64 113.26 3i0r s THR 7 Ca 0.67 0.26 -0.31 0.00 -1.18 0.00 0.00 61.69 61.14 3i0r s THR 7 Cb -0.44 -3.43 -0.08 0.00 1.34 0.00 0.00 72.50 69.89 3i0r s THR 7 CO 0.53 0.61 1.48 0.54 -0.54 0.00 0.00 174.62 177.23 3i0r s VAL 8 N -0.96 3.13 0.07 2.29 0.11 -1.26 -4.91 120.40 118.87 3i0r s VAL 8 Ca 0.15 0.76 -0.30 0.00 -2.93 0.00 0.00 61.98 59.66 3i0r s VAL 8 Cb -0.12 -3.49 -0.05 0.00 -1.53 0.00 0.00 36.38 31.19 3i0r s VAL 8 CO 0.05 0.04 1.04 -2.16 -3.33 0.00 0.00 175.10 170.74 3i0r s PRO 9 N 1.51 4.58 -0.13 1.54 0.05 -1.26 -4.40 135.00 136.88 3i0r s PRO 9 Ca 0.67 1.55 0.00 0.00 0.05 0.00 0.00 61.00 63.27 3i0r s PRO 9 Cb -0.38 -3.39 -0.01 0.00 0.05 0.00 0.00 34.50 30.77 3i0r s PRO 9 CO 0.30 -0.00 -0.14 0.08 0.05 0.00 0.00 177.00 177.29 3i0r s VAL 10 N 0.56 2.95 0.12 -0.36 1.01 -1.26 -5.11 120.40 118.31 3i0r s VAL 10 Ca 0.52 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.83 3i0r s VAL 10 Cb -0.25 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3i0r s VAL 10 CO 0.30 0.52 0.17 -1.59 0.00 0.00 0.00 175.10 174.50 3i0r s LYS 11 N 0.43 3.12 0.85 2.72 -2.85 -1.26 -4.81 119.74 117.94 3i0r s LYS 11 Ca -0.11 -0.68 -0.11 0.00 -1.00 0.00 0.00 55.97 54.08 3i0r s LYS 11 Cb -0.16 -2.82 0.14 0.00 -2.06 0.00 0.00 37.83 32.93 3i0r s LYS 11 CO 0.05 0.54 1.19 -0.51 0.10 0.00 0.00 175.35 176.72 3i0r s LEU 12 N -2.83 2.72 0.09 2.77 1.02 -1.26 -4.83 118.68 116.37 3i0r s LEU 12 Ca 0.32 0.34 -0.30 0.00 0.02 0.00 0.00 54.13 54.51 3i0r s LEU 12 Cb -0.11 -2.63 -0.06 0.00 0.02 0.00 0.00 46.19 43.41 3i0r s LEU 12 CO 0.25 -2.23 1.12 -0.54 0.02 0.00 0.00 176.35 174.97 3i0r s LYS 13 N -5.61 4.52 0.10 1.70 1.02 -1.12 -4.97 119.74 115.38 3i0r s LYS 13 Ca 0.68 1.69 -0.34 0.00 0.02 0.00 0.00 55.97 58.01 3i0r s LYS 13 Cb -0.07 -3.34 -0.18 0.00 -0.52 0.00 0.00 37.83 33.72 3i0r s LYS 13 CO 0.49 -0.10 0.86 -0.35 -0.92 0.00 0.00 175.35 175.34 3i0r n PRO 14 N 3.35 0.14 -0.31 -1.68 -0.04 -1.26 -2.18 135.00 133.02 3i0r n PRO 14 Ca 0.06 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 3i0r n PRO 14 Cb 0.47 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 3i0r n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i0r n GLY 15 N 1.76 1.61 3.41 0.55 0.00 -1.26 -4.97 105.19 106.29 3i0r n GLY 15 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 3i0r n GLY 15 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3i0r s MET 16 N -0.11 1.50 0.37 1.61 0.23 -0.93 -5.16 119.30 116.82 3i0r s MET 16 Ca 0.00 -1.68 0.05 0.00 -1.03 0.00 0.00 55.69 53.03 3i0r s MET 16 Cb 0.00 -1.43 -0.03 0.00 -1.53 0.00 0.00 34.83 31.84 3i0r s MET 16 CO 0.00 0.25 0.20 0.16 -2.03 0.00 0.00 175.02 173.61 3i0r s ASP 17 N -3.41 2.18 1.03 -1.18 3.84 -1.26 -4.60 116.67 113.27 3i0r s ASP 17 Ca 0.26 -1.71 -0.20 0.00 -0.00 0.00 0.00 52.55 50.90 3i0r s ASP 17 Cb -0.03 0.54 -0.04 0.00 -1.38 0.00 0.00 42.92 42.01 3i0r s ASP 17 CO 0.11 -1.00 -0.51 0.61 -0.00 0.00 0.00 175.17 174.37 3i0r n GLY 18 N -0.76 -2.96 3.78 2.12 0.00 -1.26 -4.92 105.19 101.20 3i0r n GLY 18 Ca 0.01 -0.59 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 3i0r n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i0r s PRO 19 N -2.80 4.19 -0.57 1.61 0.04 -1.26 -4.97 135.00 131.23 3i0r s PRO 19 Ca 0.47 1.48 0.05 0.00 0.04 0.00 0.00 61.00 63.04 3i0r s PRO 19 Cb -0.08 -2.53 0.18 0.00 0.04 0.00 0.00 34.50 32.11 3i0r s PRO 19 CO 0.70 -0.11 0.46 1.63 0.04 0.00 0.00 177.00 179.71 3i0r n LYS 20 N -0.08 1.22 -3.68 4.56 5.02 -1.25 -0.88 118.16 123.07 3i0r n LYS 20 Ca 0.05 -3.95 -0.36 0.00 -2.02 0.00 0.00 58.31 52.03 3i0r n LYS 20 Cb 0.50 -1.99 -0.07 0.00 -0.02 0.00 0.00 35.03 33.45 3i0r n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3i0r s VAL 21 N -0.98 5.35 0.50 -0.18 1.01 0.20 -4.83 120.40 121.46 3i0r s VAL 21 Ca 0.30 0.41 -0.23 0.00 0.00 0.00 0.00 61.98 62.46 3i0r s VAL 21 Cb 0.02 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.80 3i0r s VAL 21 CO -0.16 0.50 1.32 -0.75 0.00 0.00 0.00 175.10 176.00 3i0r s LYS 22 N -0.24 3.45 0.36 2.72 2.20 -1.26 -4.01 119.74 122.96 3i0r s LYS 22 Ca 0.15 2.15 -0.13 0.00 -0.36 0.00 0.00 55.97 57.78 3i0r s LYS 22 Cb -0.13 -2.41 -0.08 0.00 -1.51 0.00 0.00 37.83 33.70 3i0r s LYS 22 CO 0.04 -0.91 0.75 -1.14 -0.36 0.00 0.00 175.35 173.73 3i0r s GLN 23 N -2.71 3.92 -0.01 4.03 2.00 -1.26 -4.59 119.66 121.04 3i0r s GLN 23 Ca 0.66 0.61 -0.20 0.00 -2.00 0.00 0.00 55.36 54.43 3i0r s GLN 23 Cb -0.38 -2.41 -0.05 0.00 0.80 0.00 0.00 33.01 30.97 3i0r s GLN 23 CO 0.46 0.08 0.56 -1.58 -0.50 0.00 0.00 175.29 174.32 3i0r s TRP 24 N -2.13 3.68 0.20 1.67 0.52 -1.26 -5.01 118.94 116.61 3i0r s TRP 24 Ca 0.53 1.16 -0.30 0.00 0.02 0.00 0.00 56.10 57.51 3i0r s TRP 24 Cb -0.10 -2.57 -0.16 0.00 -1.15 0.00 0.00 33.47 29.49 3i0r s TRP 24 CO 0.22 0.38 0.87 -2.30 0.02 0.00 0.00 176.95 176.15 3i0r n PRO 25 N 2.65 0.67 -4.26 4.98 -0.02 -1.26 -4.93 135.00 132.82 3i0r n PRO 25 Ca -0.08 0.24 -0.21 0.00 -2.02 0.00 0.00 63.50 61.43 3i0r n PRO 25 Cb 0.51 -1.51 -0.12 0.00 -0.02 0.00 0.00 33.50 32.36 3i0r n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3i0r s LEU 26 N 1.40 2.35 0.39 2.45 1.02 -1.26 -5.10 118.68 119.93 3i0r s LEU 26 Ca 0.68 -0.75 -0.11 0.00 0.02 0.00 0.00 54.13 53.97 3i0r s LEU 26 Cb -0.88 -0.70 -0.07 0.00 0.02 0.00 0.00 46.19 44.56 3i0r s LEU 26 CO 0.56 -0.05 0.75 0.42 0.02 0.00 0.00 176.35 178.06 3i0r s THR 27 N -1.66 4.79 0.14 5.49 -4.23 -1.26 -4.85 115.64 114.06 3i0r s THR 27 Ca 0.07 0.62 -0.28 0.00 -1.18 0.00 0.00 61.69 60.92 3i0r s THR 27 Cb -0.08 -3.72 -0.07 0.00 1.34 0.00 0.00 72.50 69.98 3i0r s THR 27 CO 0.04 -0.48 1.48 -0.08 -0.54 0.00 0.00 174.62 175.04 3i0r h GLU 28 N 1.37 -0.05 -0.97 3.99 4.81 -2.00 0.10 114.58 121.83 3i0r h GLU 28 Ca -0.47 0.00 0.26 0.00 -0.13 0.00 0.00 59.36 59.02 3i0r h GLU 28 Cb 1.19 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.45 3i0r h GLU 28 CO 0.64 -0.03 0.53 1.05 -0.73 0.00 0.00 179.01 180.47 3i0r h GLU 29 N -0.05 0.45 -0.20 1.92 4.11 -2.00 0.19 114.58 119.01 3i0r h GLU 29 Ca 0.13 -0.03 -0.15 0.00 0.07 0.00 0.00 59.36 59.38 3i0r h GLU 29 Cb 0.39 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3i0r h GLU 29 CO -0.80 0.30 -0.50 0.87 0.07 0.00 0.00 179.01 178.95 3i0r h LYS 30 N 0.47 0.55 -0.22 1.06 6.56 -1.21 -1.83 116.57 121.95 3i0r h LYS 30 Ca 0.64 -0.33 -0.02 0.00 -1.06 0.00 0.00 60.65 59.88 3i0r h LYS 30 Cb 1.29 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.97 3i0r h LYS 30 CO -0.52 0.93 0.04 0.82 -2.06 0.00 0.00 179.45 178.65 3i0r h ILE 31 N 0.43 1.22 -0.18 1.86 2.04 0.29 -1.11 117.51 122.07 3i0r h ILE 31 Ca 0.02 -0.73 0.05 0.00 1.00 0.00 0.00 64.86 65.20 3i0r h ILE 31 Cb 1.03 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 38.35 3i0r h ILE 31 CO 0.10 0.23 -0.18 0.11 0.00 0.00 0.00 178.15 178.41 3i0r h LYS 32 N 0.16 -0.19 -1.00 2.37 1.57 -1.18 0.13 116.57 118.43 3i0r h LYS 32 Ca 0.07 0.01 0.16 0.00 -1.87 0.00 0.00 60.65 59.02 3i0r h LYS 32 Cb 0.31 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.57 3i0r h LYS 32 CO 0.00 -0.13 0.62 0.00 -0.57 0.00 0.00 179.45 179.38 3i0r h ALA 33 N 0.88 1.63 -0.01 3.86 0.00 -0.93 -0.51 119.26 124.18 3i0r h ALA 33 Ca 0.11 0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.89 3i0r h ALA 33 Cb 0.37 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3i0r h ALA 33 CO -0.30 0.06 -0.82 -0.07 0.00 0.00 0.00 179.25 178.13 3i0r h LEU 34 N 0.86 0.27 -0.82 0.00 3.38 -0.03 -1.78 115.31 117.19 3i0r h LEU 34 Ca 0.54 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 58.23 3i0r h LEU 34 Cb 0.72 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 3i0r h LEU 34 CO -0.32 0.97 0.11 0.58 0.09 0.00 0.00 178.44 179.88 3i0r h VAL 35 N 0.13 1.25 0.81 1.22 2.07 0.76 0.10 116.25 122.59 3i0r h VAL 35 Ca -0.04 -0.97 -0.04 0.00 0.82 0.00 0.00 66.70 66.48 3i0r h VAL 35 Cb 1.42 0.65 0.01 0.00 -1.52 0.00 0.00 31.29 31.85 3i0r h VAL 35 CO 0.13 0.36 -0.39 -0.33 0.02 0.00 0.00 177.57 177.36 3i0r h GLU 36 N 0.94 -1.04 -0.88 1.57 5.08 -1.03 -1.46 114.58 117.76 3i0r h GLU 36 Ca 0.19 0.07 0.22 0.00 -1.00 0.00 0.00 59.36 58.85 3i0r h GLU 36 Cb 0.39 0.24 -0.13 0.00 0.50 0.00 0.00 28.75 29.75 3i0r h GLU 36 CO 0.01 -0.70 0.35 0.82 -1.00 0.00 0.00 179.01 178.50 3i0r h ILE 37 N -1.29 0.44 0.00 3.13 2.04 -1.28 -0.75 117.51 119.80 3i0r h ILE 37 Ca -0.11 -0.12 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 3i0r h ILE 37 Cb 0.83 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3i0r h ILE 37 CO 0.18 0.06 -0.57 0.00 0.00 0.00 0.00 178.15 177.83 3i0r h THR 39 N 0.00 0.24 -0.39 0.00 2.02 -0.05 -2.61 112.91 112.13 3i0r h THR 39 Ca -0.01 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.23 3i0r h THR 39 Cb 1.38 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 3i0r h THR 39 CO 0.07 0.01 0.27 -0.08 0.37 0.00 0.00 175.52 176.16 3i0r h GLU 40 N -1.05 0.05 0.00 6.66 4.57 -1.26 -1.05 114.58 122.50 3i0r h GLU 40 Ca -0.10 -0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.87 3i0r h GLU 40 Cb 0.79 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.34 3i0r h GLU 40 CO 0.17 0.03 -1.02 0.52 -1.18 0.00 0.00 179.01 177.54 3i0r h MET 41 N 0.05 0.00 0.25 1.92 2.86 -1.36 -1.68 114.93 116.97 3i0r h MET 41 Ca 0.18 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 3i0r h MET 41 Cb 0.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 3i0r h MET 41 CO -0.01 0.81 -0.12 1.49 1.06 0.00 0.00 176.91 180.14 3i0r h GLU 42 N 0.00 -0.33 -0.93 1.72 4.81 -0.88 0.51 114.58 119.48 3i0r h GLU 42 Ca -0.05 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.29 3i0r h GLU 42 Cb 1.72 0.07 -0.12 0.00 0.63 0.00 0.00 28.75 31.06 3i0r h GLU 42 CO 0.11 0.03 -0.58 0.87 -0.73 0.00 0.00 179.01 178.70 3i0r h LYS 43 N -0.80 -0.04 0.00 1.92 1.57 -1.28 0.56 116.57 118.50 3i0r h LYS 43 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3i0r h LYS 43 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3i0r h LYS 43 CO 0.06 -0.03 0.00 0.39 -0.57 0.00 0.00 179.45 179.30 3i0r n GLU 44 N -5.25 0.33 -1.38 3.15 1.02 -0.63 -4.79 120.64 113.09 3i0r n GLU 44 Ca 0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 3i0r n GLU 44 Cb 0.27 -1.05 -0.06 0.00 -0.02 0.00 0.00 31.44 30.58 3i0r n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i0r n GLY 45 N -0.19 1.33 0.09 0.62 0.00 0.20 -4.90 105.19 102.34 3i0r n GLY 45 Ca 0.01 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 3i0r n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i0r h LYS 46 N 0.04 0.16 -4.25 1.61 1.79 -0.20 -3.43 116.57 112.29 3i0r h LYS 46 Ca -0.26 -0.27 -0.13 0.00 -2.18 0.00 0.00 60.65 57.81 3i0r h LYS 46 Cb 0.98 0.10 -0.15 0.00 -1.58 0.00 0.00 32.23 31.58 3i0r h LYS 46 CO 0.39 1.12 -0.67 0.96 -1.08 0.00 0.00 179.45 180.17 3i0r s ILE 47 N -2.69 0.21 -0.02 1.86 -4.36 -1.23 0.56 121.20 115.53 3i0r s ILE 47 Ca -0.02 -1.80 -0.01 0.00 -0.26 0.00 0.00 60.65 58.56 3i0r s ILE 47 Cb 0.08 -1.57 0.01 0.00 1.25 0.00 0.00 42.46 42.23 3i0r s ILE 47 CO 0.86 -0.94 0.04 -0.44 0.24 0.00 0.00 174.94 174.70 3i0r s SER 48 N -2.93 -0.03 0.59 4.36 0.01 0.81 -4.40 113.70 112.10 3i0r s SER 48 Ca 0.09 0.08 -0.18 0.00 1.31 0.00 0.00 55.95 57.24 3i0r s SER 48 Cb 0.08 0.07 -0.06 0.00 0.21 0.00 0.00 66.02 66.31 3i0r s SER 48 CO -0.09 -0.03 0.84 0.29 0.41 0.00 0.00 173.24 174.66 3i0r n LYS 49 N 3.19 0.79 -4.36 12.44 5.02 -1.26 -1.68 118.16 132.30 3i0r n LYS 49 Ca -0.14 0.31 -0.18 0.00 -2.02 0.00 0.00 58.31 56.28 3i0r n LYS 49 Cb 0.59 -2.03 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 3i0r n LYS 49 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3i0r s ILE 50 N -1.57 0.76 0.41 -0.18 -4.36 -0.87 -4.81 121.20 110.59 3i0r s ILE 50 Ca 0.73 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.20 3i0r s ILE 50 Cb -0.43 -2.69 -0.05 0.00 1.25 0.00 0.00 42.46 40.54 3i0r s ILE 50 CO 0.49 0.00 0.18 -0.83 0.24 0.00 0.00 174.94 175.02 3i0r s GLY 51 N -3.38 2.34 0.03 6.27 0.00 -1.26 -4.79 107.32 106.53 3i0r s GLY 51 Ca 0.37 -2.12 0.02 0.00 0.00 0.00 0.00 44.72 42.99 3i0r s GLY 51 CO 0.14 -1.92 0.97 -1.55 0.00 0.00 0.00 173.10 170.75 3i0r n PRO 52 N -1.23 0.01 0.00 2.90 -0.04 -1.26 -1.12 135.00 134.26 3i0r n PRO 52 Ca -0.01 0.44 0.08 0.00 -0.04 0.00 0.00 63.50 63.96 3i0r n PRO 52 Cb 0.65 -1.62 0.46 0.00 -0.04 0.00 0.00 33.50 32.95 3i0r n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3i0r n GLU 53 N -1.49 0.69 -3.66 0.54 0.00 -1.26 -4.44 120.64 111.02 3i0r n GLU 53 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 57.16 56.77 3i0r n GLU 53 Cb 0.08 -1.35 -0.11 0.00 0.00 0.00 0.00 31.44 30.06 3i0r n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3i0r s ASN 54 N -1.80 5.53 0.02 -1.84 3.84 -0.27 -4.97 114.94 115.46 3i0r s ASN 54 Ca 0.23 -1.20 0.26 0.00 0.21 0.00 0.00 52.86 52.36 3i0r s ASN 54 Cb 0.11 -1.95 0.72 0.00 -0.55 0.00 0.00 41.25 39.58 3i0r s ASN 54 CO 0.18 -0.40 1.58 -0.81 -2.79 0.00 0.00 177.10 174.85 3i0r n PRO 55 N 4.89 0.05 -2.04 0.43 -0.04 -1.26 -4.95 135.00 132.08 3i0r n PRO 55 Ca -0.11 0.02 -0.33 0.00 -0.04 0.00 0.00 63.50 63.03 3i0r n PRO 55 Cb 0.45 -1.54 0.01 0.00 -0.04 0.00 0.00 33.50 32.38 3i0r n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3i0r s TYR 56 N -3.03 2.88 -0.21 0.54 2.02 -1.26 -4.84 117.35 113.45 3i0r s TYR 56 Ca 0.11 1.53 -0.27 0.00 -0.37 0.00 0.00 57.07 58.07 3i0r s TYR 56 Cb 0.17 -3.07 0.08 0.00 -0.40 0.00 0.00 41.96 38.74 3i0r s TYR 56 CO 0.65 -1.26 0.77 1.21 -1.57 0.00 0.00 175.55 175.35 3i0r s ASN 57 N -2.58 -0.66 -0.01 2.29 2.47 -0.06 -4.59 114.94 111.81 3i0r s ASN 57 Ca 0.65 1.12 0.01 0.00 0.42 0.00 0.00 52.86 55.06 3i0r s ASN 57 Cb -0.18 1.08 0.00 0.00 -1.45 0.00 0.00 41.25 40.71 3i0r s ASN 57 CO 0.36 -0.33 -0.02 -0.89 -3.72 0.00 0.00 177.10 172.49 3i0r s THR 58 N -0.12 0.19 0.67 -5.21 2.01 -0.56 0.59 115.64 113.21 3i0r s THR 58 Ca -0.02 -0.08 -0.11 0.00 0.31 0.00 0.00 61.69 61.78 3i0r s THR 58 Cb -0.03 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 72.28 3i0r s THR 58 CO 0.02 0.07 1.05 -2.84 -0.69 0.00 0.00 174.62 172.23 3i0r s PRO 59 N 0.08 3.18 -0.09 4.92 0.02 -1.26 -4.25 135.00 137.61 3i0r s PRO 59 Ca -0.00 0.74 -0.08 0.00 0.02 0.00 0.00 61.00 61.68 3i0r s PRO 59 Cb -0.03 -2.03 0.02 0.00 0.02 0.00 0.00 34.50 32.48 3i0r s PRO 59 CO -0.00 -0.87 0.23 0.54 -0.33 0.00 0.00 177.00 176.57 3i0r s VAL 60 N -3.18 -0.00 0.22 3.83 0.11 -1.26 -1.54 120.40 118.58 3i0r s VAL 60 Ca 0.57 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.63 3i0r s VAL 60 Cb -0.12 -0.32 -0.05 0.00 -1.53 0.00 0.00 36.38 34.36 3i0r s VAL 60 CO 0.54 0.00 0.10 -0.36 -3.33 0.00 0.00 175.10 172.05 3i0r s PHE 61 N 0.17 1.33 -0.02 1.54 0.08 -0.15 -4.83 117.98 116.09 3i0r s PHE 61 Ca -0.00 -1.25 0.07 0.00 0.12 0.00 0.00 56.93 55.87 3i0r s PHE 61 Cb -0.02 -0.73 -0.02 0.00 -0.57 0.00 0.00 43.02 41.68 3i0r s PHE 61 CO -0.00 -0.45 -0.25 0.00 -0.10 0.00 0.00 175.22 174.42 3i0r s ALA 62 N -3.92 2.22 0.00 5.36 0.00 -1.26 0.05 121.76 124.21 3i0r s ALA 62 Ca 0.36 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.22 3i0r s ALA 62 Cb 0.07 -0.60 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 3i0r s ALA 62 CO 0.12 0.53 0.00 0.44 0.00 0.00 0.00 175.76 176.84 3i0r n ILE 63 N 2.44 0.00 0.00 0.00 -5.35 -0.23 -4.91 119.36 111.31 3i0r n ILE 63 Ca -0.16 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 3i0r n ILE 63 Cb 0.51 0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 3i0r n ILE 63 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 3i0r n LYS 64 N -0.01 0.95 -0.37 6.28 3.00 -1.26 -0.88 118.16 125.86 3i0r n LYS 64 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3i0r n LYS 64 Cb 0.01 -0.80 0.00 0.00 0.00 0.00 0.00 35.03 34.23 3i0r n LYS 64 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 3i0r n LYS 65 N -1.83 -1.06 -1.50 1.64 4.81 -1.26 -4.41 118.16 114.55 3i0r n LYS 65 Ca 0.00 0.77 -0.63 0.00 -0.87 0.00 0.00 58.31 57.58 3i0r n LYS 65 Cb 0.30 -0.85 -0.11 0.00 0.02 0.00 0.00 35.03 34.39 3i0r n LYS 65 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 3i0r n LYS 66 N -0.49 0.11 -3.32 1.64 4.81 -1.26 -1.49 118.16 118.15 3i0r n LYS 66 Ca 0.00 0.04 -0.16 0.00 -0.87 0.00 0.00 58.31 57.31 3i0r n LYS 66 Cb 0.00 -1.57 0.08 0.00 0.02 0.00 0.00 35.03 33.55 3i0r n LYS 66 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3i0r n ASP 67 N 5.99 -2.85 -3.85 3.14 10.43 -1.26 -5.04 116.55 123.11 3i0r n ASP 67 Ca 0.43 -0.54 -0.14 0.00 2.57 0.00 0.00 54.79 57.11 3i0r n ASP 67 Cb -0.03 -4.61 -0.15 0.00 1.84 0.00 0.00 41.12 38.18 3i0r n ASP 67 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3i0r s SER 68 N -4.02 0.13 0.14 -2.24 0.01 -0.56 -5.03 113.70 102.13 3i0r s SER 68 Ca 0.11 -0.00 0.19 0.00 1.31 0.00 0.00 55.95 57.56 3i0r s SER 68 Cb -0.05 -0.05 -0.05 0.00 0.21 0.00 0.00 66.02 66.08 3i0r s SER 68 CO 0.65 -0.03 0.97 0.71 0.41 0.00 0.00 173.24 175.95 3i0r h THR 69 N 5.51 0.31 -3.22 1.44 1.35 -1.86 -3.43 112.91 113.00 3i0r h THR 69 Ca -0.31 -1.58 -0.57 0.00 -0.55 0.00 0.00 66.41 63.39 3i0r h THR 69 Cb 1.18 1.85 -0.05 0.00 -1.73 0.00 0.00 68.15 69.39 3i0r h THR 69 CO 0.50 0.18 1.01 -0.75 -0.25 0.00 0.00 175.52 176.20 3i0r s LYS 70 N -3.11 3.78 0.36 4.72 2.20 -1.26 -4.99 119.74 121.45 3i0r s LYS 70 Ca -0.01 1.10 -0.25 0.00 -0.36 0.00 0.00 55.97 56.45 3i0r s LYS 70 Cb 0.09 -3.93 -0.13 0.00 -1.51 0.00 0.00 37.83 32.34 3i0r s LYS 70 CO 0.79 -1.30 0.78 0.91 -0.36 0.00 0.00 175.35 176.18 3i0r n TRP 71 N 8.07 0.40 -3.80 4.03 7.02 -1.26 -4.67 117.44 127.23 3i0r n TRP 71 Ca 0.15 0.66 -0.12 0.00 -1.02 0.00 0.00 57.50 57.16 3i0r n TRP 71 Cb 0.47 -2.12 -0.11 0.00 -2.42 0.00 0.00 31.31 27.14 3i0r n TRP 71 CO 0.00 0.00 0.00 -0.98 -2.02 0.00 0.00 177.69 174.69 3i0r s ARG 72 N -1.62 0.36 0.23 -0.99 1.04 -0.06 -4.97 118.95 112.94 3i0r s ARG 72 Ca 0.62 0.13 -0.30 0.00 -1.04 0.00 0.00 55.73 55.14 3i0r s ARG 72 Cb -0.65 0.17 -0.09 0.00 -2.04 0.00 0.00 34.95 32.34 3i0r s ARG 72 CO 0.58 -0.07 1.02 0.21 -0.04 0.00 0.00 175.30 177.00 3i0r s LYS 73 N -0.33 4.74 -0.17 3.89 2.47 -1.26 -1.07 119.74 128.00 3i0r s LYS 73 Ca -0.04 1.62 -0.03 0.00 -1.56 0.00 0.00 55.97 55.96 3i0r s LYS 73 Cb -0.03 -3.26 0.06 0.00 -1.46 0.00 0.00 37.83 33.13 3i0r s LYS 73 CO 0.01 0.33 0.04 -1.17 0.16 0.00 0.00 175.35 174.72 3i0r s LEU 74 N -1.03 0.93 0.05 5.43 2.96 0.11 -4.89 118.68 122.23 3i0r s LEU 74 Ca 0.44 -0.67 -0.13 0.00 -0.22 0.00 0.00 54.13 53.55 3i0r s LEU 74 Cb -0.28 -0.50 -0.06 0.00 0.50 0.00 0.00 46.19 45.85 3i0r s LEU 74 CO 0.35 -0.30 0.42 -0.69 -1.32 0.00 0.00 176.35 174.81 3i0r s VAL 75 N 1.93 5.04 -0.90 1.68 1.01 -1.26 -0.97 120.40 126.92 3i0r s VAL 75 Ca 0.00 0.67 -0.13 0.00 0.00 0.00 0.00 61.98 62.53 3i0r s VAL 75 Cb -0.16 -3.69 0.23 0.00 0.00 0.00 0.00 36.38 32.77 3i0r s VAL 75 CO -0.08 0.42 0.86 -0.62 0.00 0.00 0.00 175.10 175.68 3i0r s ASP 76 N -1.44 6.91 -0.09 3.32 3.68 -0.59 -4.87 116.67 123.60 3i0r s ASP 76 Ca 0.29 -2.93 0.01 0.00 2.13 0.00 0.00 52.55 52.06 3i0r s ASP 76 Cb -0.15 -2.21 0.16 0.00 -1.45 0.00 0.00 42.92 39.27 3i0r s ASP 76 CO 0.16 -0.50 1.11 0.49 0.13 0.00 0.00 175.17 176.56 3i0r n PHE 77 N 3.65 0.65 -0.24 -5.34 3.72 -1.26 -4.30 117.46 114.34 3i0r n PHE 77 Ca 0.17 -0.66 -0.07 0.00 -0.05 0.00 0.00 57.45 56.83 3i0r n PHE 77 Cb 0.45 -0.36 0.04 0.00 -0.94 0.00 0.00 39.48 38.67 3i0r n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3i0r h ARG 78 N 0.39 1.02 0.36 -1.08 3.08 -1.90 0.53 114.38 116.79 3i0r h ARG 78 Ca 0.11 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 3i0r h ARG 78 Cb 1.29 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.19 3i0r h ARG 78 CO 0.22 0.88 -0.17 1.49 -1.07 0.00 0.00 179.97 181.32 3i0r h GLU 79 N 0.96 -0.46 -0.99 0.04 4.57 -2.00 -3.01 114.58 113.68 3i0r h GLU 79 Ca 0.22 0.03 0.20 0.00 -1.18 0.00 0.00 59.36 58.63 3i0r h GLU 79 Cb 0.27 0.11 -0.11 0.00 -0.16 0.00 0.00 28.75 28.85 3i0r h GLU 79 CO -0.01 -0.15 0.59 1.25 -1.18 0.00 0.00 179.01 179.50 3i0r h LEU 80 N -0.80 0.72 -0.89 1.64 6.46 -1.86 -2.19 115.31 118.39 3i0r h LEU 80 Ca -0.05 0.11 -0.06 0.00 -0.12 0.00 0.00 57.88 57.76 3i0r h LEU 80 Cb 0.52 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.41 3i0r h LEU 80 CO 0.08 0.22 0.16 0.78 -0.62 0.00 0.00 178.44 179.06 3i0r h ASN 81 N 0.70 0.93 0.45 1.25 2.35 -0.76 -0.65 115.58 119.84 3i0r h ASN 81 Ca 0.59 -0.18 -0.07 0.00 -0.55 0.00 0.00 56.30 56.09 3i0r h ASN 81 Cb 0.97 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 3i0r h ASN 81 CO -0.41 0.89 -0.31 0.11 -1.65 0.00 0.00 177.43 176.06 3i0r h LYS 82 N 0.95 0.00 -0.85 0.81 1.57 -1.29 -0.23 116.57 117.53 3i0r h LYS 82 Ca 0.20 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 3i0r h LYS 82 Cb 0.32 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 3i0r h LYS 82 CO -0.00 0.31 0.10 0.54 -0.57 0.00 0.00 179.45 179.83 3i0r n ARG 83 N -3.90 2.58 0.00 3.15 1.74 -0.27 -3.82 116.66 116.14 3i0r n ARG 83 Ca -0.02 -1.57 0.00 0.00 -0.77 0.00 0.00 57.85 55.50 3i0r n ARG 83 Cb 0.38 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 3i0r n ARG 83 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3i0r n THR 84 N 0.13 0.00 -0.05 0.55 -2.24 -1.12 -2.79 114.28 108.75 3i0r n THR 84 Ca 0.19 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.01 3i0r n THR 84 Cb 0.84 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 69.14 3i0r n THR 84 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3i0r n GLN 85 N -0.40 -0.00 -0.24 -0.78 7.27 -0.11 0.21 117.38 123.33 3i0r n GLN 85 Ca 0.00 0.11 -0.06 0.00 0.07 0.00 0.00 57.00 57.13 3i0r n GLN 85 Cb 0.00 -0.24 0.05 0.00 2.41 0.00 0.00 30.24 32.46 3i0r n GLN 85 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 3i0r h ASP 86 N 0.00 0.78 0.56 1.69 1.82 -1.88 -2.07 116.42 117.33 3i0r h ASP 86 Ca 0.09 -0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.66 3i0r h ASP 86 Cb 0.31 -0.20 0.01 0.00 0.68 0.00 0.00 39.33 40.13 3i0r h ASP 86 CO -0.03 0.59 -0.27 0.15 -1.61 0.00 0.00 179.24 178.07 3i0r h PHE 87 N 0.90 -0.70 0.00 0.28 3.04 0.22 -2.98 116.94 117.70 3i0r h PHE 87 Ca 0.24 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.17 3i0r h PHE 87 Cb -0.06 0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.68 3i0r h PHE 87 CO -0.02 -0.38 0.00 0.11 -2.02 0.00 0.00 178.31 176.00 3i0r h TRP 88 N -1.10 0.00 0.00 0.41 5.08 -1.64 -2.28 115.95 116.42 3i0r h TRP 88 Ca -0.08 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.89 3i0r h TRP 88 Cb 0.63 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.79 3i0r h TRP 88 CO 0.01 0.00 -0.01 -1.91 -1.28 0.00 0.00 178.44 175.25 3i0r n GLU 89 N -3.04 0.00 0.00 0.12 2.13 -0.78 -3.82 120.64 115.26 3i0r n GLU 89 Ca -0.01 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.93 3i0r n GLU 89 Cb 0.22 -0.19 0.55 0.00 0.27 0.00 0.00 31.44 32.29 3i0r n GLU 89 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 3i0r n VAL 90 N -2.53 0.31 -0.03 6.31 0.24 -1.21 -1.95 118.33 119.48 3i0r n VAL 90 Ca -0.00 0.08 -0.03 0.00 -2.04 0.00 0.00 64.34 62.34 3i0r n VAL 90 Cb 0.00 -0.68 -0.03 0.00 -1.47 0.00 0.00 33.84 31.67 3i0r n VAL 90 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3i0r n GLN 91 N -1.40 1.23 -2.77 7.34 0.00 -1.13 -4.71 117.38 115.93 3i0r n GLN 91 Ca 0.08 0.02 -0.03 0.00 -0.00 0.00 0.00 57.00 57.08 3i0r n GLN 91 Cb 0.24 -1.12 0.05 0.00 0.00 0.00 0.00 30.24 29.41 3i0r n GLN 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3i0r n LEU 92 N -2.49 1.27 -4.72 1.69 4.77 -0.86 -5.03 117.00 111.62 3i0r n LEU 92 Ca -0.09 -3.25 -0.41 0.00 -0.03 0.00 0.00 56.01 52.23 3i0r n LEU 92 Cb 0.62 0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 42.10 3i0r n LEU 92 CO 0.07 1.25 0.69 -0.83 -1.33 0.00 0.00 177.39 177.24 3i0r s GLY 93 N -3.39 2.94 -0.14 -0.72 0.00 -0.82 -4.71 107.32 100.47 3i0r s GLY 93 Ca 0.26 0.60 -0.29 0.00 0.00 0.00 0.00 44.72 45.28 3i0r s GLY 93 CO -0.02 1.57 1.07 -0.42 0.00 0.00 0.00 173.10 175.29 3i0r s ILE 94 N 0.32 4.63 0.82 0.90 1.01 -1.26 -5.04 121.20 122.57 3i0r s ILE 94 Ca 0.49 1.93 -0.12 0.00 0.00 0.00 0.00 60.65 62.95 3i0r s ILE 94 Cb -0.23 -4.24 0.09 0.00 0.01 0.00 0.00 42.46 38.08 3i0r s ILE 94 CO 0.30 -0.07 1.15 -2.84 0.00 0.00 0.00 174.94 173.48 3i0r s PRO 95 N 2.57 1.69 -0.20 2.79 0.02 -1.26 -5.01 135.00 135.60 3i0r s PRO 95 Ca 0.49 1.54 0.01 0.00 0.02 0.00 0.00 61.00 63.06 3i0r s PRO 95 Cb -0.18 -1.80 0.03 0.00 0.02 0.00 0.00 34.50 32.57 3i0r s PRO 95 CO 0.14 -2.13 -0.16 -1.58 -0.33 0.00 0.00 177.00 172.95 3i0r s HIS 96 N -2.48 2.76 -0.49 6.54 2.46 -1.26 -4.98 115.29 117.85 3i0r s HIS 96 Ca 0.68 -1.75 -0.28 0.00 0.47 0.00 0.00 55.06 54.18 3i0r s HIS 96 Cb -0.24 -1.84 -0.00 0.00 -0.13 0.00 0.00 32.58 30.37 3i0r s HIS 96 CO 0.53 -0.80 1.61 -1.25 -2.47 0.00 0.00 174.74 172.35 3i0r s PRO 97 N 1.29 3.21 0.25 2.88 0.04 -1.26 -4.86 135.00 136.55 3i0r s PRO 97 Ca 0.01 0.81 0.16 0.00 0.04 0.00 0.00 61.00 62.02 3i0r s PRO 97 Cb -0.15 -4.18 0.88 0.00 0.04 0.00 0.00 34.50 31.09 3i0r s PRO 97 CO -0.10 -2.03 1.49 0.00 0.04 0.00 0.00 177.00 176.40 3i0r n ALA 98 N 10.31 1.01 -0.03 8.56 0.00 -1.26 -1.88 120.51 137.22 3i0r n ALA 98 Ca 0.17 0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.66 3i0r n ALA 98 Cb 0.49 -1.22 0.04 0.00 0.00 0.00 0.00 19.45 18.77 3i0r n ALA 98 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3i0r h GLY 99 N 0.00 0.73 -0.23 0.00 0.00 -1.96 -3.30 103.07 98.31 3i0r h GLY 99 Ca 0.00 -0.80 0.19 0.00 0.00 0.00 0.00 47.33 46.72 3i0r h GLY 99 CO 0.00 0.72 0.21 -2.00 0.00 0.00 0.00 176.54 175.46 3i0r h LEU 100 N 0.52 0.02 -0.44 3.11 5.85 -1.69 0.24 115.31 122.92 3i0r h LEU 100 Ca 0.03 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.91 3i0r h LEU 100 Cb 1.04 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3i0r h LEU 100 CO 0.10 -0.08 0.00 2.29 -0.34 0.00 0.00 178.44 180.41 3i0r n LYS 101 N -5.18 0.15 0.02 1.25 2.85 -1.24 -3.06 118.16 112.95 3i0r n LYS 101 Ca 0.17 0.35 -0.18 0.00 -1.05 0.00 0.00 58.31 57.59 3i0r n LYS 101 Cb 0.55 -1.76 -0.14 0.00 -0.65 0.00 0.00 35.03 33.03 3i0r n LYS 101 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 3i0r h LYS 102 N 0.00 0.26 -6.28 -1.58 1.57 -0.71 -3.15 116.57 106.68 3i0r h LYS 102 Ca 0.00 -0.41 -0.60 0.00 -1.87 0.00 0.00 60.65 57.78 3i0r h LYS 102 Cb 0.38 0.14 0.16 0.00 0.08 0.00 0.00 32.23 33.00 3i0r h LYS 102 CO 0.00 1.17 -0.62 1.63 -0.57 0.00 0.00 179.45 181.05 3i0r n LYS 103 N -4.23 0.36 0.23 3.15 4.76 -1.17 -3.67 118.16 117.58 3i0r n LYS 103 Ca -0.13 0.14 0.11 0.00 -2.87 0.00 0.00 58.31 55.56 3i0r n LYS 103 Cb 0.73 -1.41 0.46 0.00 -1.84 0.00 0.00 35.03 32.97 3i0r n LYS 103 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 3i0r h LYS 104 N 0.37 0.00 -3.05 1.97 1.57 -1.87 -3.22 116.57 112.34 3i0r h LYS 104 Ca -0.42 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.15 3i0r h LYS 104 Cb 1.42 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 33.42 3i0r h LYS 104 CO 0.47 0.18 -0.52 -1.12 -0.57 0.00 0.00 179.45 177.89 3i0r s SER 105 N -6.11 -0.11 -0.22 0.86 0.01 -0.98 -4.41 113.70 102.75 3i0r s SER 105 Ca 0.01 0.48 0.01 0.00 1.31 0.00 0.00 55.95 57.76 3i0r s SER 105 Cb 0.09 0.39 0.05 0.00 0.21 0.00 0.00 66.02 66.77 3i0r s SER 105 CO 0.63 -0.18 -0.08 -0.69 0.41 0.00 0.00 173.24 173.33 3i0r s VAL 106 N 1.44 1.65 0.11 3.43 1.01 0.23 -1.02 120.40 127.24 3i0r s VAL 106 Ca -0.07 -1.20 -0.15 0.00 0.00 0.00 0.00 61.98 60.56 3i0r s VAL 106 Cb -0.11 -1.83 -0.07 0.00 0.00 0.00 0.00 36.38 34.38 3i0r s VAL 106 CO -0.08 0.01 0.53 -0.89 0.00 0.00 0.00 175.10 174.67 3i0r s THR 107 N 1.36 4.87 -0.20 3.92 2.01 0.21 -1.27 115.64 126.54 3i0r s THR 107 Ca -0.05 0.87 -0.02 0.00 0.31 0.00 0.00 61.69 62.81 3i0r s THR 107 Cb -0.18 -3.75 0.00 0.00 0.01 0.00 0.00 72.50 68.58 3i0r s THR 107 CO -0.07 0.33 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.39 3i0r s VAL 108 N -1.36 2.76 -0.13 3.82 1.01 -0.64 -0.41 120.40 125.45 3i0r s VAL 108 Ca 0.34 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3i0r s VAL 108 Cb -0.16 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 3i0r s VAL 108 CO 0.18 0.48 -0.17 -0.76 0.00 0.00 0.00 175.10 174.83 3i0r s LEU 109 N 1.39 2.42 0.11 3.92 1.43 0.38 -3.83 118.68 124.50 3i0r s LEU 109 Ca 0.05 -0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 52.38 3i0r s LEU 109 Cb -0.14 -1.53 -0.08 0.00 0.03 0.00 0.00 46.19 44.48 3i0r s LEU 109 CO -0.08 0.13 1.36 -0.62 0.23 0.00 0.00 176.35 177.37 3i0r s ASP 110 N 0.55 6.86 -0.00 2.29 3.68 -1.26 -0.75 116.67 128.05 3i0r s ASP 110 Ca -0.11 2.28 0.00 0.00 2.13 0.00 0.00 52.55 56.86 3i0r s ASP 110 Cb -0.16 -2.59 0.00 0.00 -1.45 0.00 0.00 42.92 38.72 3i0r s ASP 110 CO 0.04 -0.63 0.58 0.52 0.13 0.00 0.00 175.17 175.82 3i0r n VAL 111 N 3.93 0.17 -0.36 1.11 0.31 0.23 -4.46 118.33 119.25 3i0r n VAL 111 Ca 0.11 -0.17 0.32 0.00 -0.01 0.00 0.00 64.34 64.59 3i0r n VAL 111 Cb 0.43 0.92 0.65 0.00 -0.91 0.00 0.00 33.84 34.93 3i0r n VAL 111 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3i0r h GLY 112 N 0.00 0.64 0.94 2.92 0.00 -1.87 -2.47 103.07 103.23 3i0r h GLY 112 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.25 3i0r h GLY 112 CO 0.00 -0.11 0.20 -0.55 0.00 0.00 0.00 176.54 176.08 3i0r h ASP 113 N 0.16 0.33 0.00 0.19 3.32 -1.92 -3.14 116.42 115.36 3i0r h ASP 113 Ca 0.64 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.69 3i0r h ASP 113 Cb 2.13 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.61 3i0r h ASP 113 CO -0.18 0.24 0.00 0.00 -1.72 0.00 0.00 179.24 177.58 3i0r n ALA 114 N -2.21 0.00 -0.32 3.45 0.00 -0.93 -0.35 120.51 120.15 3i0r n ALA 114 Ca -0.00 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.74 3i0r n ALA 114 Cb 0.05 0.01 0.56 0.00 0.00 0.00 0.00 19.45 20.07 3i0r n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3i0r h TYR 115 N 0.00 0.79 0.00 0.00 0.05 -1.76 -2.78 116.97 113.27 3i0r h TYR 115 Ca 0.00 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3i0r h TYR 115 Cb 0.00 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.56 3i0r h TYR 115 CO -0.01 -0.44 0.12 1.19 -1.05 0.00 0.00 178.16 177.96 3i0r n PHE 116 N -5.25 0.00 -2.28 4.88 0.99 0.53 -0.32 117.46 116.02 3i0r n PHE 116 Ca 0.36 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.65 3i0r n PHE 116 Cb 1.23 -0.26 0.03 0.00 -1.00 0.00 0.00 39.48 39.48 3i0r n PHE 116 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 3i0r n SER 117 N -1.22 3.90 -4.12 4.37 3.41 -1.05 -4.87 113.62 114.04 3i0r n SER 117 Ca 0.00 -3.23 -0.29 0.00 -0.26 0.00 0.00 58.87 55.09 3i0r n SER 117 Cb 0.12 -0.39 -0.17 0.00 -0.26 0.00 0.00 64.21 63.52 3i0r n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3i0r s VAL 118 N -4.37 1.67 0.41 -3.33 1.01 0.57 -5.06 120.40 111.28 3i0r s VAL 118 Ca 0.44 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 3i0r s VAL 118 Cb 0.38 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 35.20 3i0r s VAL 118 CO 0.01 0.47 1.32 -2.84 0.00 0.00 0.00 175.10 174.07 3i0r s PRO 119 N 0.60 3.96 -0.10 2.72 0.02 -1.26 -0.81 135.00 140.12 3i0r s PRO 119 Ca -0.14 2.20 -0.23 0.00 0.02 0.00 0.00 61.00 62.85 3i0r s PRO 119 Cb -0.17 -2.77 -0.03 0.00 0.02 0.00 0.00 34.50 31.56 3i0r s PRO 119 CO 0.05 -0.52 0.70 -1.17 -0.33 0.00 0.00 177.00 175.72 3i0r s LEU 120 N -2.42 4.27 -0.09 -5.54 0.20 0.68 -4.55 118.68 111.22 3i0r s LEU 120 Ca 0.57 1.12 -0.29 0.00 0.69 0.00 0.00 54.13 56.22 3i0r s LEU 120 Cb -0.39 -3.06 -0.14 0.00 -0.43 0.00 0.00 46.19 42.18 3i0r s LEU 120 CO 0.50 -0.17 0.83 -0.67 -0.29 0.00 0.00 176.35 176.55 3i0r n ASP 121 N 4.16 0.21 -0.35 3.68 4.64 -1.26 -4.76 116.55 122.87 3i0r n ASP 121 Ca -0.01 0.80 0.01 0.00 -1.38 0.00 0.00 54.79 54.21 3i0r n ASP 121 Cb 0.51 -0.62 0.15 0.00 -1.04 0.00 0.00 41.12 40.11 3i0r n ASP 121 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 3i0r h GLU 122 N 2.41 1.10 -0.05 -0.67 4.22 -1.93 -0.84 114.58 118.82 3i0r h GLU 122 Ca -0.34 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.04 3i0r h GLU 122 Cb 0.97 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3i0r h GLU 122 CO 0.50 0.73 0.00 -0.25 -2.18 0.00 0.00 179.01 177.81 3i0r n ASP 123 N -4.53 0.32 -0.05 1.04 10.43 -1.26 -3.47 116.55 119.04 3i0r n ASP 123 Ca 0.14 -1.75 -0.02 0.00 2.57 0.00 0.00 54.79 55.72 3i0r n ASP 123 Cb 0.15 -0.03 -0.11 0.00 1.84 0.00 0.00 41.12 42.97 3i0r n ASP 123 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 3i0r n PHE 124 N -0.44 0.00 -0.36 1.24 7.35 -0.33 -4.67 117.46 120.25 3i0r n PHE 124 Ca 0.08 0.00 0.32 0.00 -0.76 0.00 0.00 57.45 57.09 3i0r n PHE 124 Cb 0.08 -0.55 0.59 0.00 0.35 0.00 0.00 39.48 39.95 3i0r n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3i0r h ARG 125 N 0.00 0.09 0.00 -4.13 3.08 -1.56 0.21 114.38 112.06 3i0r h ARG 125 Ca -0.24 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 3i0r h ARG 125 Cb 1.44 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.47 3i0r h ARG 125 CO 0.01 0.06 -0.00 1.57 -1.07 0.00 0.00 179.97 180.54 3i0r h LYS 126 N 0.09 0.00 0.00 0.04 2.10 -1.83 0.68 116.57 117.65 3i0r h LYS 126 Ca 0.82 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.47 3i0r h LYS 126 Cb 2.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.57 3i0r h LYS 126 CO -0.63 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.48 3i0r n TYR 127 N -3.11 0.00 -1.04 0.07 4.01 0.73 -3.20 117.16 114.62 3i0r n TYR 127 Ca -0.02 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.78 3i0r n TYR 127 Cb 0.15 -0.45 0.28 0.00 -0.31 0.00 0.00 39.34 39.00 3i0r n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3i0r n THR 128 N -1.45 2.43 -1.72 -0.72 -2.24 0.23 -4.74 114.28 106.07 3i0r n THR 128 Ca 0.06 -1.89 -0.43 0.00 -2.27 0.00 0.00 64.05 59.52 3i0r n THR 128 Cb 0.22 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.16 3i0r n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i0r n ALA 129 N -0.42 1.90 -2.28 6.98 0.00 -1.19 -4.36 120.51 121.14 3i0r n ALA 129 Ca 0.25 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.92 3i0r n ALA 129 Cb 0.99 -2.37 -0.10 0.00 0.00 0.00 0.00 19.45 17.97 3i0r n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3i0r s PHE 130 N -0.21 1.42 0.03 0.00 -0.71 -0.68 -1.50 117.98 116.33 3i0r s PHE 130 Ca 0.64 -1.32 0.03 0.00 -1.04 0.00 0.00 56.93 55.24 3i0r s PHE 130 Cb -0.56 -0.76 -0.02 0.00 -1.21 0.00 0.00 43.02 40.48 3i0r s PHE 130 CO 0.51 -0.51 -0.11 0.99 -1.34 0.00 0.00 175.22 174.76 3i0r s THR 131 N -3.86 0.81 -0.30 -4.49 2.01 -1.26 -1.10 115.64 107.46 3i0r s THR 131 Ca 0.38 -0.89 -0.06 0.00 0.31 0.00 0.00 61.69 61.43 3i0r s THR 131 Cb 0.07 -0.77 0.02 0.00 0.01 0.00 0.00 72.50 71.83 3i0r s THR 131 CO 0.15 -0.10 0.07 -0.63 -0.69 0.00 0.00 174.62 173.42 3i0r s ILE 132 N -0.88 3.80 0.87 1.82 1.01 -0.12 -4.74 121.20 122.95 3i0r s ILE 132 Ca -0.02 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 59.69 3i0r s ILE 132 Cb -0.07 -3.00 0.11 0.00 0.01 0.00 0.00 42.46 39.51 3i0r s ILE 132 CO 0.01 0.04 1.14 -2.16 0.00 0.00 0.00 174.94 173.97 3i0r s PRO 133 N 1.46 1.49 0.15 2.79 0.04 -1.26 -1.69 135.00 137.98 3i0r s PRO 133 Ca 0.01 0.29 0.09 0.00 0.04 0.00 0.00 61.00 61.44 3i0r s PRO 133 Cb -0.18 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 3i0r s PRO 133 CO 0.02 -1.96 -0.21 -1.54 0.04 0.00 0.00 177.00 173.35 3i0r s SER 134 N -4.16 2.88 0.58 6.66 1.04 -1.26 -4.90 113.70 114.54 3i0r s SER 134 Ca 0.63 -0.81 -0.19 0.00 0.48 0.00 0.00 55.95 56.06 3i0r s SER 134 Cb -0.14 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.76 3i0r s SER 134 CO 0.52 0.04 1.23 -0.63 0.98 0.00 0.00 173.24 175.39 3i0r s ILE 135 N -1.65 2.53 -0.74 -1.02 1.01 -1.26 -2.44 121.20 117.63 3i0r s ILE 135 Ca 0.14 0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.14 3i0r s ILE 135 Cb -0.08 -3.14 0.00 0.00 0.01 0.00 0.00 42.46 39.25 3i0r s ILE 135 CO 0.07 -0.06 0.00 -3.20 0.00 0.00 0.00 174.94 171.75 3i0r n ASN 136 N -1.49 -2.39 -0.95 3.58 2.85 -1.26 -2.07 115.26 113.53 3i0r n ASN 136 Ca 0.13 0.25 -0.09 0.00 -0.11 0.00 0.00 54.58 54.76 3i0r n ASN 136 Cb 0.49 -2.26 -0.04 0.00 1.24 0.00 0.00 39.78 39.21 3i0r n ASN 136 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3i0r n ASN 137 N -0.75 -3.73 0.25 1.20 3.02 -1.02 -4.78 115.26 109.46 3i0r n ASN 137 Ca -0.08 0.23 0.17 0.00 -0.03 0.00 0.00 54.58 54.86 3i0r n ASN 137 Cb 0.40 -3.08 0.89 0.00 -0.61 0.00 0.00 39.78 37.38 3i0r n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3i0r h GLU 138 N 0.00 0.00 -3.43 3.52 5.08 -1.64 -3.42 114.58 114.68 3i0r h GLU 138 Ca -0.19 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.00 3i0r h GLU 138 Cb 0.82 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.84 3i0r h GLU 138 CO 0.28 0.00 -0.51 0.95 -1.00 0.00 0.00 179.01 178.73 3i0r s THR 139 N -4.59 0.04 0.54 1.13 -4.23 -1.26 -5.12 115.64 102.15 3i0r s THR 139 Ca -0.05 -0.37 -0.22 0.00 -1.18 0.00 0.00 61.69 59.87 3i0r s THR 139 Cb 0.15 -0.34 -0.05 0.00 1.34 0.00 0.00 72.50 73.59 3i0r s THR 139 CO 0.53 -0.20 1.31 -2.65 -0.54 0.00 0.00 174.62 173.07 3i0r n PRO 140 N 2.17 1.64 -1.25 3.99 -0.02 -1.26 -4.41 135.00 135.86 3i0r n PRO 140 Ca -0.18 0.60 -0.32 0.00 -2.02 0.00 0.00 63.50 61.58 3i0r n PRO 140 Cb 0.57 -2.51 0.10 0.00 -0.02 0.00 0.00 33.50 31.64 3i0r n PRO 140 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3i0r s GLY 141 N -0.90 1.96 -0.15 -1.23 0.00 -1.26 -4.87 107.32 100.87 3i0r s GLY 141 Ca 0.71 0.58 -0.29 0.00 0.00 0.00 0.00 44.72 45.72 3i0r s GLY 141 CO 0.50 0.97 1.08 -0.42 0.00 0.00 0.00 173.10 175.23 3i0r s ILE 142 N -2.47 4.60 -0.15 0.90 1.01 -0.68 -4.81 121.20 119.60 3i0r s ILE 142 Ca 0.67 1.90 -0.05 0.00 0.00 0.00 0.00 60.65 63.18 3i0r s ILE 142 Cb -0.23 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 37.98 3i0r s ILE 142 CO 0.51 -0.08 0.02 -0.13 0.00 0.00 0.00 174.94 175.26 3i0r s ARG 143 N 2.64 3.64 0.28 2.79 1.81 -1.26 -0.95 118.95 127.90 3i0r s ARG 143 Ca 0.49 -0.40 0.04 0.00 -1.72 0.00 0.00 55.73 54.14 3i0r s ARG 143 Cb -0.19 -3.03 -0.06 0.00 -0.45 0.00 0.00 34.95 31.23 3i0r s ARG 143 CO 0.14 0.38 0.01 0.71 -0.68 0.00 0.00 175.30 175.87 3i0r s TYR 144 N 0.02 1.79 0.04 -0.53 2.02 -0.26 -2.05 117.35 118.38 3i0r s TYR 144 Ca 0.04 -0.90 -0.07 0.00 -0.37 0.00 0.00 57.07 55.76 3i0r s TYR 144 Cb -0.13 -1.09 -0.00 0.00 -0.40 0.00 0.00 41.96 40.34 3i0r s TYR 144 CO 0.02 0.03 0.14 1.14 -1.57 0.00 0.00 175.55 175.31 3i0r s GLN 145 N -3.86 0.63 0.33 -0.62 -2.07 -0.68 -1.68 119.66 111.71 3i0r s GLN 145 Ca 0.32 -0.67 -0.26 0.00 -1.82 0.00 0.00 55.36 52.93 3i0r s GLN 145 Cb 0.07 0.25 -0.10 0.00 -1.09 0.00 0.00 33.01 32.14 3i0r s GLN 145 CO 0.12 -0.17 0.97 0.71 -1.32 0.00 0.00 175.29 175.61 3i0r s TYR 146 N -2.49 3.62 -0.12 9.60 1.51 -1.26 -0.14 117.35 128.07 3i0r s TYR 146 Ca -0.06 1.76 0.13 0.00 -1.01 0.00 0.00 57.07 57.89 3i0r s TYR 146 Cb -0.02 -2.99 -0.19 0.00 -0.11 0.00 0.00 41.96 38.65 3i0r s TYR 146 CO -0.04 0.01 0.11 0.09 -1.11 0.00 0.00 175.55 174.61 3i0r n ASN 147 N 0.52 1.44 -4.94 2.29 4.13 0.19 -4.71 115.26 114.18 3i0r n ASN 147 Ca 0.02 0.00 -0.19 0.00 1.68 0.00 0.00 54.58 56.09 3i0r n ASN 147 Cb 0.49 1.03 -0.01 0.00 -1.54 0.00 0.00 39.78 39.76 3i0r n ASN 147 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 3i0r s VAL 148 N -2.50 2.88 0.07 2.41 -7.23 -1.17 0.25 120.40 115.12 3i0r s VAL 148 Ca -0.07 -1.17 -0.32 0.00 -1.81 0.00 0.00 61.98 58.62 3i0r s VAL 148 Cb 0.05 -3.01 -0.11 0.00 0.56 0.00 0.00 36.38 33.87 3i0r s VAL 148 CO 0.60 -0.01 1.85 0.18 -0.31 0.00 0.00 175.10 177.41 3i0r n LEU 149 N -1.70 3.88 -4.87 1.32 4.77 0.01 -4.45 117.00 115.97 3i0r n LEU 149 Ca 0.06 0.98 -0.30 0.00 -0.03 0.00 0.00 56.01 56.71 3i0r n LEU 149 Cb 0.60 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.16 3i0r n LEU 149 CO 0.41 0.10 0.44 -2.16 -1.33 0.00 0.00 177.39 174.85 3i0r s PRO 150 N 3.12 3.80 0.29 3.23 0.04 -1.26 -4.26 135.00 139.96 3i0r s PRO 150 Ca 0.85 0.49 -0.22 0.00 0.04 0.00 0.00 61.00 62.15 3i0r s PRO 150 Cb -0.53 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.53 3i0r s PRO 150 CO 0.41 -0.01 0.84 -0.65 0.04 0.00 0.00 177.00 177.62 3i0r s GLN 151 N -3.75 4.37 0.00 4.56 -0.21 -1.26 -3.48 119.66 119.88 3i0r s GLN 151 Ca 0.51 1.07 0.00 0.00 0.02 0.00 0.00 55.36 56.97 3i0r s GLN 151 Cb -0.10 -2.75 0.00 0.00 1.00 0.00 0.00 33.01 31.16 3i0r s GLN 151 CO 0.30 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 174.17 3i0r n GLY 152 N 0.45 2.26 3.68 3.09 0.00 -1.26 -4.69 105.19 108.72 3i0r n GLY 152 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3i0r n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3i0r s TRP 153 N -2.67 3.47 -0.10 1.61 -0.00 -1.23 -4.47 118.94 115.55 3i0r s TRP 153 Ca 0.00 1.21 0.28 0.00 -0.00 0.00 0.00 56.10 57.58 3i0r s TRP 153 Cb 0.00 -2.91 1.35 0.00 -0.00 0.00 0.00 33.47 31.91 3i0r s TRP 153 CO 0.00 -0.12 1.83 0.87 -0.00 0.00 0.00 176.95 179.54 3i0r h LYS 154 N 7.16 0.00 -0.14 5.86 1.57 -1.90 -1.81 116.57 127.31 3i0r h LYS 154 Ca -0.34 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.36 3i0r h LYS 154 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 3i0r h LYS 154 CO 0.80 0.00 -0.29 0.78 -0.57 0.00 0.00 179.45 180.16 3i0r h GLY 155 N 0.93 0.28 0.97 3.86 0.00 -1.92 -3.32 103.07 103.87 3i0r h GLY 155 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3i0r h GLY 155 CO 0.00 0.21 -0.12 1.76 0.00 0.00 0.00 176.54 178.38 3i0r h SER 156 N 0.23 -0.30 -0.51 0.19 0.02 -1.58 -0.32 113.55 111.28 3i0r h SER 156 Ca 0.03 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 3i0r h SER 156 Cb 0.64 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 3i0r h SER 156 CO 0.05 -0.21 0.05 1.55 -1.14 0.00 0.00 176.83 177.13 3i0r h PRO 157 N -0.33 0.91 0.44 3.45 0.13 -1.76 0.59 132.00 135.44 3i0r h PRO 157 Ca -0.03 -0.24 -0.01 0.00 -0.87 0.00 0.00 66.00 64.85 3i0r h PRO 157 Cb 0.27 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 31.27 3i0r h PRO 157 CO 0.04 0.88 -0.36 0.00 -0.23 0.00 0.00 178.00 178.32 3i0r h ALA 158 N 1.19 -0.82 -0.48 -0.56 0.00 -1.48 -0.60 119.26 116.50 3i0r h ALA 158 Ca 0.17 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.00 3i0r h ALA 158 Cb 0.43 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 3i0r h ALA 158 CO 0.02 -0.99 0.17 0.82 0.00 0.00 0.00 179.25 179.27 3i0r h ILE 159 N -0.79 0.84 -0.09 0.00 2.04 -1.03 -2.76 117.51 115.72 3i0r h ILE 159 Ca -0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3i0r h ILE 159 Cb 0.69 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3i0r h ILE 159 CO -0.02 0.06 0.00 0.33 0.00 0.00 0.00 178.15 178.53 3i0r n PHE 160 N -5.00 0.18 0.34 1.37 7.35 0.19 -4.26 117.46 117.64 3i0r n PHE 160 Ca 0.05 -0.08 -0.16 0.00 -0.76 0.00 0.00 57.45 56.51 3i0r n PHE 160 Cb 0.19 -0.06 -0.08 0.00 0.35 0.00 0.00 39.48 39.88 3i0r n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 3i0r h GLN 161 N 0.55 -0.84 -0.80 -4.13 4.15 -0.83 -1.95 115.11 111.26 3i0r h GLN 161 Ca 0.00 0.06 0.12 0.00 0.77 0.00 0.00 58.65 59.60 3i0r h GLN 161 Cb 0.34 0.19 -0.06 0.00 0.21 0.00 0.00 27.48 28.17 3i0r h GLN 161 CO 0.02 -0.52 0.52 0.66 -1.93 0.00 0.00 178.83 177.59 3i0r h SER 162 N -1.10 0.59 -0.30 -0.69 4.64 -1.83 0.38 113.55 115.23 3i0r h SER 162 Ca -0.09 0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 3i0r h SER 162 Cb 0.71 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 3i0r h SER 162 CO 0.15 0.33 0.07 0.28 -0.87 0.00 0.00 176.83 176.79 3i0r h SER 163 N 0.64 0.46 -0.69 4.97 0.02 -1.84 -1.94 113.55 115.17 3i0r h SER 163 Ca 0.38 -0.23 0.15 0.00 -0.84 0.00 0.00 61.79 61.25 3i0r h SER 163 Cb 0.60 -0.12 -0.11 0.00 0.14 0.00 0.00 62.40 62.91 3i0r h SER 163 CO -0.15 0.57 0.08 -0.03 -1.14 0.00 0.00 176.83 176.16 3i0r h MET 164 N 0.32 0.18 -0.05 3.45 -1.53 0.42 -0.28 114.93 117.44 3i0r h MET 164 Ca 0.09 -0.01 -0.00 0.00 -3.44 0.00 0.00 59.70 56.34 3i0r h MET 164 Cb 0.29 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.30 3i0r h MET 164 CO 0.00 0.12 0.03 1.15 0.14 0.00 0.00 176.91 178.35 3i0r h THR 165 N 0.18 1.05 0.49 -0.77 2.02 -0.17 0.34 112.91 116.06 3i0r h THR 165 Ca 0.38 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.39 3i0r h THR 165 Cb 0.64 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 3i0r h THR 165 CO -0.54 0.05 -0.48 0.11 0.37 0.00 0.00 175.52 175.02 3i0r h LYS 166 N 0.02 -0.94 -1.00 6.66 1.79 -0.83 0.18 116.57 122.46 3i0r h LYS 166 Ca 0.02 0.06 0.21 0.00 -2.18 0.00 0.00 60.65 58.76 3i0r h LYS 166 Cb 0.05 0.21 -0.19 0.00 -1.58 0.00 0.00 32.23 30.72 3i0r h LYS 166 CO -0.00 -0.62 -0.22 -0.89 -1.08 0.00 0.00 179.45 176.63 3i0r n ILE 167 N -5.38 -0.42 0.96 1.86 5.41 -0.16 -0.82 119.36 120.81 3i0r n ILE 167 Ca -0.12 2.28 0.13 0.00 1.00 0.00 0.00 62.75 66.04 3i0r n ILE 167 Cb 0.44 -3.17 0.49 0.00 -0.71 0.00 0.00 39.64 36.70 3i0r n ILE 167 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3i0r n LEU 168 N -5.61 0.21 0.23 1.39 4.77 0.12 -4.47 117.00 113.63 3i0r n LEU 168 Ca 0.17 0.37 -0.15 0.00 -0.03 0.00 0.00 56.01 56.36 3i0r n LEU 168 Cb 0.53 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 41.13 3i0r n LEU 168 CO -0.11 0.02 0.65 -0.08 -1.33 0.00 0.00 177.39 176.53 3i0r h GLU 169 N 0.00 -0.68 0.14 3.23 4.22 0.14 -0.62 114.58 121.00 3i0r h GLU 169 Ca 0.00 0.05 0.01 0.00 0.08 0.00 0.00 59.36 59.49 3i0r h GLU 169 Cb 0.52 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3i0r h GLU 169 CO 0.00 -0.45 -0.15 -1.00 -2.18 0.00 0.00 179.01 175.23 3i0r h PRO 170 N -0.70 -0.30 -0.99 0.92 0.13 -1.78 0.25 132.00 129.52 3i0r h PRO 170 Ca -0.03 0.02 0.10 0.00 -0.87 0.00 0.00 66.00 65.22 3i0r h PRO 170 Cb 0.63 0.07 -0.08 0.00 0.13 0.00 0.00 31.00 31.75 3i0r h PRO 170 CO -0.04 -0.20 0.63 0.35 -0.23 0.00 0.00 178.00 178.51 3i0r h PHE 171 N -0.31 1.15 0.39 1.56 3.57 -1.82 -1.39 116.94 120.08 3i0r h PHE 171 Ca 0.01 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 3i0r h PHE 171 Cb 0.31 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.68 3i0r h PHE 171 CO -0.14 0.52 -0.19 0.00 -2.23 0.00 0.00 178.31 176.28 3i0r h ARG 172 N 1.06 -0.51 -0.81 1.11 3.08 -0.47 -2.13 114.38 115.71 3i0r h ARG 172 Ca 0.46 0.03 0.19 0.00 0.07 0.00 0.00 59.98 60.74 3i0r h ARG 172 Cb 0.35 0.11 -0.12 0.00 0.08 0.00 0.00 29.97 30.39 3i0r h ARG 172 CO -0.22 -0.32 0.22 -0.22 -1.07 0.00 0.00 179.97 178.36 3i0r h LYS 173 N -0.55 0.26 0.00 0.04 3.64 -0.31 -2.38 116.57 117.27 3i0r h LYS 173 Ca -0.05 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3i0r h LYS 173 Cb 0.42 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3i0r h LYS 173 CO 0.09 0.17 0.00 1.96 -2.27 0.00 0.00 179.45 179.40 3i0r h GLN 174 N 0.26 0.00 -2.08 1.90 4.20 -0.89 -3.33 115.11 115.17 3i0r h GLN 174 Ca 0.48 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.66 3i0r h GLN 174 Cb 0.89 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.27 3i0r h GLN 174 CO -0.57 0.00 -1.01 0.09 -0.67 0.00 0.00 178.83 176.67 3i0r n ASN 175 N -2.48 1.69 0.00 1.46 4.13 -0.83 -4.98 115.26 114.25 3i0r n ASN 175 Ca 0.05 -3.11 0.03 0.00 1.68 0.00 0.00 54.58 53.23 3i0r n ASN 175 Cb 0.43 -0.62 0.19 0.00 -1.54 0.00 0.00 39.78 38.24 3i0r n ASN 175 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 3i0r n PRO 176 N 0.49 0.20 -0.62 3.52 -0.02 -1.19 -1.32 135.00 136.07 3i0r n PRO 176 Ca 0.26 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.76 3i0r n PRO 176 Cb 0.55 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.76 3i0r n PRO 176 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3i0r n ASP 177 N -1.00 3.16 -4.32 2.55 8.00 -1.26 -4.90 116.55 118.78 3i0r n ASP 177 Ca 0.05 -3.39 -0.34 0.00 0.71 0.00 0.00 54.79 51.82 3i0r n ASP 177 Cb 0.02 -0.59 -0.14 0.00 -0.02 0.00 0.00 41.12 40.39 3i0r n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3i0r s ILE 178 N -3.04 3.17 0.14 0.53 1.01 -0.43 -4.58 121.20 117.99 3i0r s ILE 178 Ca 0.43 -0.58 -0.19 0.00 0.00 0.00 0.00 60.65 60.30 3i0r s ILE 178 Cb 0.37 -2.39 -0.07 0.00 0.01 0.00 0.00 42.46 40.38 3i0r s ILE 178 CO 0.04 0.47 0.64 -0.69 0.00 0.00 0.00 174.94 175.41 3i0r s VAL 179 N 1.02 4.65 -0.20 2.92 1.01 -0.51 -4.91 120.40 124.38 3i0r s VAL 179 Ca -0.00 1.24 -0.02 0.00 0.00 0.00 0.00 61.98 63.20 3i0r s VAL 179 Cb -0.15 -3.90 0.06 0.00 0.00 0.00 0.00 36.38 32.39 3i0r s VAL 179 CO -0.01 0.39 0.00 -0.63 0.00 0.00 0.00 175.10 174.86 3i0r s ILE 180 N -1.30 0.82 -0.09 2.22 1.01 -1.26 -1.15 121.20 121.46 3i0r s ILE 180 Ca 0.36 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.32 3i0r s ILE 180 Cb -0.18 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.04 3i0r s ILE 180 CO 0.21 -0.13 -0.14 -0.47 0.00 0.00 0.00 174.94 174.40 3i0r s TYR 181 N 1.73 2.74 -0.12 3.97 5.04 -0.07 -4.92 117.35 125.72 3i0r s TYR 181 Ca -0.02 -0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 54.15 3i0r s TYR 181 Cb -0.17 -1.73 -0.03 0.00 0.35 0.00 0.00 41.96 40.37 3i0r s TYR 181 CO -0.07 -0.03 0.01 -1.14 -1.34 0.00 0.00 175.55 172.97 3i0r s GLN 182 N -0.16 3.34 -0.26 4.97 0.74 -1.26 0.14 119.66 127.16 3i0r s GLN 182 Ca -0.01 -0.41 -0.02 0.00 0.05 0.00 0.00 55.36 54.97 3i0r s GLN 182 Cb -0.13 -2.91 0.09 0.00 1.10 0.00 0.00 33.01 31.15 3i0r s GLN 182 CO 0.03 0.52 0.08 -0.47 -0.55 0.00 0.00 175.29 174.90 3i0r s TYR 183 N -0.37 1.24 0.00 1.67 5.04 -0.58 -4.99 117.35 119.36 3i0r s TYR 183 Ca 0.07 -1.28 0.00 0.00 -2.44 0.00 0.00 57.07 53.42 3i0r s TYR 183 Cb -0.12 -1.33 0.00 0.00 0.35 0.00 0.00 41.96 40.86 3i0r s TYR 183 CO 0.02 -0.77 0.00 -1.33 -1.34 0.00 0.00 175.55 172.13 3i0r n MET 184 N 4.98 0.00 -0.04 4.97 2.81 -1.26 -2.67 117.12 125.92 3i0r n MET 184 Ca -0.05 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 55.96 3i0r n MET 184 Cb 0.44 0.00 0.44 0.00 -0.71 0.00 0.00 33.22 33.39 3i0r n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3i0r n ASP 185 N 9.00 1.62 -4.44 7.83 8.00 -1.26 -4.74 116.55 132.56 3i0r n ASP 185 Ca 0.00 -1.61 -0.28 0.00 0.71 0.00 0.00 54.79 53.61 3i0r n ASP 185 Cb 0.00 -0.06 -0.12 0.00 -0.02 0.00 0.00 41.12 40.93 3i0r n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3i0r s ASP 186 N -1.78 3.53 -0.09 -2.24 1.01 -1.09 0.76 116.67 116.77 3i0r s ASP 186 Ca 0.35 -0.78 0.01 0.00 0.71 0.00 0.00 52.55 52.84 3i0r s ASP 186 Cb 0.19 -0.32 -0.02 0.00 1.01 0.00 0.00 42.92 43.78 3i0r s ASP 186 CO 0.30 0.14 -0.12 -0.22 0.21 0.00 0.00 175.17 175.48 3i0r s LEU 187 N -2.50 2.85 -0.24 1.23 2.96 0.07 -1.53 118.68 121.52 3i0r s LEU 187 Ca 0.19 -0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 53.84 3i0r s LEU 187 Cb -0.09 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.97 3i0r s LEU 187 CO 0.10 0.26 0.01 -0.31 -1.32 0.00 0.00 176.35 175.09 3i0r s TYR 188 N -0.21 3.03 -0.24 5.38 1.51 0.36 -0.47 117.35 126.71 3i0r s TYR 188 Ca 0.01 -0.76 -0.01 0.00 -1.01 0.00 0.00 57.07 55.31 3i0r s TYR 188 Cb -0.13 -2.17 0.03 0.00 -0.11 0.00 0.00 41.96 39.58 3i0r s TYR 188 CO 0.03 -0.48 -0.08 0.08 -1.11 0.00 0.00 175.55 173.99 3i0r s VAL 189 N 1.53 2.71 -0.10 0.71 1.01 0.45 -0.89 120.40 125.82 3i0r s VAL 189 Ca 0.06 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 60.95 3i0r s VAL 189 Cb -0.15 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 3i0r s VAL 189 CO -0.00 0.19 -0.17 -0.83 0.00 0.00 0.00 175.10 174.29 3i0r s GLY 190 N 1.29 1.47 0.14 4.51 0.00 -0.30 -0.62 107.32 113.81 3i0r s GLY 190 Ca -0.01 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.78 3i0r s GLY 190 CO -0.05 -0.39 -0.02 -1.35 0.00 0.00 0.00 173.10 171.29 3i0r s SER 191 N 0.07 1.08 -0.09 1.64 1.04 -0.19 -1.43 113.70 115.82 3i0r s SER 191 Ca -0.07 -1.12 0.17 0.00 0.48 0.00 0.00 55.95 55.41 3i0r s SER 191 Cb -0.15 0.13 0.62 0.00 0.10 0.00 0.00 66.02 66.72 3i0r s SER 191 CO 0.05 -0.55 1.53 0.47 0.98 0.00 0.00 173.24 175.72 3i0r n ASP 192 N -0.15 4.25 -4.85 7.02 10.43 -1.26 -2.31 116.55 129.68 3i0r n ASP 192 Ca -0.08 -2.39 -0.31 0.00 2.57 0.00 0.00 54.79 54.57 3i0r n ASP 192 Cb 0.62 -0.50 0.01 0.00 1.84 0.00 0.00 41.12 43.09 3i0r n ASP 192 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3i0r s LEU 193 N -1.72 3.31 0.45 0.64 1.43 -1.26 -4.90 118.68 116.63 3i0r s LEU 193 Ca 0.45 1.52 -0.20 0.00 -1.03 0.00 0.00 54.13 54.87 3i0r s LEU 193 Cb 0.29 -4.49 -0.14 0.00 0.03 0.00 0.00 46.19 41.88 3i0r s LEU 193 CO 0.22 -0.94 0.16 1.21 0.23 0.00 0.00 176.35 177.23 3i0r n GLU 194 N -2.52 0.16 -0.31 1.70 0.00 -1.26 -4.60 120.64 113.81 3i0r n GLU 194 Ca 0.07 0.06 -0.03 0.00 0.00 0.00 0.00 57.16 57.26 3i0r n GLU 194 Cb 0.54 -1.17 0.09 0.00 0.00 0.00 0.00 31.44 30.89 3i0r n GLU 194 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.13 178.10 3i0r h ILE 195 N 0.31 1.19 -0.84 6.31 6.09 -1.99 0.43 117.51 129.01 3i0r h ILE 195 Ca -0.40 -0.38 -0.02 0.00 -1.37 0.00 0.00 64.86 62.70 3i0r h ILE 195 Cb 1.43 -0.02 -0.04 0.00 0.47 0.00 0.00 36.82 38.67 3i0r h ILE 195 CO 0.46 0.20 0.46 1.23 -3.07 0.00 0.00 178.15 177.44 3i0r h GLY 196 N 1.11 1.26 0.89 8.18 0.00 -1.99 0.22 103.07 112.74 3i0r h GLY 196 Ca 0.32 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 3i0r h GLY 196 CO -0.08 0.55 0.09 1.46 0.00 0.00 0.00 176.54 178.55 3i0r h GLN 197 N 1.17 0.37 -0.05 4.80 4.20 -1.73 0.33 115.11 124.21 3i0r h GLN 197 Ca 0.30 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.94 3i0r h GLN 197 Cb 0.03 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3i0r h GLN 197 CO -0.05 0.43 -0.12 1.25 -0.67 0.00 0.00 178.83 179.68 3i0r h HIS 198 N 0.24 -0.36 -0.93 2.96 2.76 -0.22 0.68 115.15 120.27 3i0r h HIS 198 Ca 0.08 0.01 0.27 0.00 -2.20 0.00 0.00 60.37 58.54 3i0r h HIS 198 Cb 0.21 0.16 -0.15 0.00 1.55 0.00 0.00 27.41 29.18 3i0r h HIS 198 CO -0.00 -0.12 0.29 0.00 -1.30 0.00 0.00 177.93 176.80 3i0r h ARG 199 N -0.12 0.17 0.25 5.26 3.08 -0.51 0.92 114.38 123.43 3i0r h ARG 199 Ca 0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3i0r h ARG 199 Cb 0.14 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3i0r h ARG 199 CO -0.11 0.11 -0.12 1.15 -1.07 0.00 0.00 179.97 179.94 3i0r h THR 200 N 0.17 0.77 -0.64 2.04 2.02 0.42 0.27 112.91 117.97 3i0r h THR 200 Ca 0.62 -0.10 0.10 0.00 0.77 0.00 0.00 66.41 67.80 3i0r h THR 200 Cb 1.34 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.54 3i0r h THR 200 CO -0.70 0.02 0.43 0.11 0.37 0.00 0.00 175.52 175.75 3i0r h LYS 201 N -0.39 0.43 0.03 6.66 1.79 0.68 0.19 116.57 125.97 3i0r h LYS 201 Ca -0.03 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3i0r h LYS 201 Cb 0.30 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3i0r h LYS 201 CO 0.06 0.29 -0.02 0.82 -1.08 0.00 0.00 179.45 179.52 3i0r h ILE 202 N 0.45 1.10 -0.27 1.86 1.08 -0.08 0.94 117.51 122.59 3i0r h ILE 202 Ca 0.30 -0.41 0.05 0.00 -0.39 0.00 0.00 64.86 64.41 3i0r h ILE 202 Cb 0.56 1.37 -0.05 0.00 -3.07 0.00 0.00 36.82 35.63 3i0r h ILE 202 CO -0.09 0.10 -0.07 -0.08 -0.69 0.00 0.00 178.15 177.33 3i0r h GLU 203 N -0.22 -0.00 -0.88 2.37 4.57 0.11 0.20 114.58 120.72 3i0r h GLU 203 Ca -0.00 0.00 0.17 0.00 -1.18 0.00 0.00 59.36 58.35 3i0r h GLU 203 Cb 0.20 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 28.69 3i0r h GLU 203 CO 0.01 -0.00 0.44 1.49 -1.18 0.00 0.00 179.01 179.77 3i0r h GLU 204 N -0.01 0.56 -0.46 1.92 4.81 -0.56 -0.61 114.58 120.24 3i0r h GLU 204 Ca 0.13 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 3i0r h GLU 204 Cb 0.20 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3i0r h GLU 204 CO -0.28 0.37 -0.12 1.25 -0.73 0.00 0.00 179.01 179.50 3i0r h LEU 205 N 0.58 0.89 -1.32 1.64 6.46 0.10 -2.96 115.31 120.70 3i0r h LEU 205 Ca 0.50 -0.36 0.19 0.00 -0.12 0.00 0.00 57.88 58.09 3i0r h LEU 205 Cb 0.79 -0.24 -0.08 0.00 -0.73 0.00 0.00 40.66 40.39 3i0r h LEU 205 CO -0.41 1.05 0.61 0.03 -0.62 0.00 0.00 178.44 179.10 3i0r h ARG 206 N 0.72 0.55 0.08 1.25 3.08 0.90 -1.63 114.38 119.33 3i0r h ARG 206 Ca 0.11 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 3i0r h ARG 206 Cb 0.67 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3i0r h ARG 206 CO 0.05 0.36 -0.04 1.96 -1.07 0.00 0.00 179.97 181.23 3i0r h GLN 207 N 0.56 -0.10 -0.17 0.04 1.08 -1.28 0.30 115.11 115.54 3i0r h GLN 207 Ca 0.51 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.77 3i0r h GLN 207 Cb 1.04 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 28.43 3i0r h GLN 207 CO -0.25 -0.04 -0.27 0.45 -0.95 0.00 0.00 178.83 177.77 3i0r h HIS 208 N -0.13 -0.72 -0.12 2.96 3.86 -1.34 -1.07 115.15 118.58 3i0r h HIS 208 Ca -0.01 0.04 0.04 0.00 -1.16 0.00 0.00 60.37 59.27 3i0r h HIS 208 Cb 0.11 0.34 -0.04 0.00 1.06 0.00 0.00 27.41 28.88 3i0r h HIS 208 CO -0.06 -0.35 -0.15 -0.07 0.86 0.00 0.00 177.93 178.16 3i0r h LEU 209 N -0.32 -0.46 0.00 2.43 4.07 -1.28 -1.78 115.31 117.97 3i0r h LEU 209 Ca 0.11 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3i0r h LEU 209 Cb 0.49 0.22 0.00 0.00 1.08 0.00 0.00 40.66 42.44 3i0r h LEU 209 CO -0.35 -0.19 0.05 -0.11 -1.08 0.00 0.00 178.44 176.75 3i0r n LEU 210 N -5.29 0.00 -0.32 1.67 7.94 0.10 0.04 117.00 121.15 3i0r n LEU 210 Ca -0.03 0.38 0.12 0.00 -1.11 0.00 0.00 56.01 55.37 3i0r n LEU 210 Cb 0.21 -0.38 0.22 0.00 0.53 0.00 0.00 43.42 44.00 3i0r n LEU 210 CO 0.22 -0.38 0.50 0.54 -1.11 0.00 0.00 177.39 177.17 3i0r n ARG 211 N -1.37 0.92 -0.03 1.96 3.00 -0.67 -3.45 116.66 117.02 3i0r n ARG 211 Ca 0.00 -0.64 0.02 0.00 -0.01 0.00 0.00 57.85 57.22 3i0r n ARG 211 Cb 0.05 -1.49 0.03 0.00 0.00 0.00 0.00 32.46 31.05 3i0r n ARG 211 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 3i0r n TRP 212 N -0.48 0.07 0.00 -1.55 8.01 0.11 -4.99 117.44 118.60 3i0r n TRP 212 Ca 0.11 -0.25 0.00 0.00 -1.31 0.00 0.00 57.50 56.05 3i0r n TRP 212 Cb 0.39 -0.02 0.00 0.00 -2.01 0.00 0.00 31.31 29.67 3i0r n TRP 212 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3i0r n GLY 213 N -0.01 1.65 3.24 6.99 0.00 -1.09 -4.95 105.19 111.02 3i0r n GLY 213 Ca 0.03 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 3i0r n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i0r n LEU 214 N 0.00 -2.45 -3.61 0.99 4.77 -1.04 -4.80 117.00 110.86 3i0r n LEU 214 Ca 0.00 -0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 55.73 3i0r n LEU 214 Cb 0.00 -0.89 -0.07 0.00 -2.33 0.00 0.00 43.42 40.13 3i0r n LEU 214 CO 0.00 -2.99 0.55 -0.89 -1.33 0.00 0.00 177.39 172.74 3i0r s THR 215 N -2.20 0.00 0.00 -5.08 2.01 -1.26 -3.97 115.64 105.14 3i0r s THR 215 Ca 0.53 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.53 3i0r s THR 215 Cb -0.09 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.42 3i0r s THR 215 CO 0.66 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 3i0r n GLY 231 N 2.06 0.36 3.57 4.40 0.00 -1.26 -4.71 105.19 109.61 3i0r n GLY 231 Ca -0.14 -0.68 -0.59 0.00 0.00 0.00 0.00 46.02 44.61 3i0r n GLY 231 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3i0r n TYR 232 N 0.00 1.72 -3.88 1.61 9.36 -1.25 -4.85 117.16 119.87 3i0r n TYR 232 Ca 0.00 0.66 -0.35 0.00 3.32 0.00 0.00 57.90 61.53 3i0r n TYR 232 Cb 0.00 -2.39 -0.13 0.00 -0.63 0.00 0.00 39.34 36.19 3i0r n TYR 232 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 3i0r s GLU 233 N 4.52 2.20 0.04 2.98 2.12 -1.26 -1.63 118.70 127.66 3i0r s GLU 233 Ca 1.07 -1.50 0.06 0.00 0.36 0.00 0.00 54.97 54.95 3i0r s GLU 233 Cb -1.21 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 29.84 3i0r s GLU 233 CO 0.66 -0.80 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.93 3i0r s LEU 234 N 1.18 2.83 -0.57 2.70 1.43 -0.40 -4.98 118.68 120.88 3i0r s LEU 234 Ca 0.01 -0.34 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3i0r s LEU 234 Cb -0.21 -1.65 0.20 0.00 0.03 0.00 0.00 46.19 44.57 3i0r s LEU 234 CO -0.03 0.25 0.51 1.41 0.23 0.00 0.00 176.35 178.73 3i0r n HIS 235 N 1.45 1.71 0.00 0.29 8.25 -1.26 0.73 115.22 126.40 3i0r n HIS 235 Ca -0.16 -3.91 0.00 0.00 -0.26 0.00 0.00 57.72 53.40 3i0r n HIS 235 Cb 0.52 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 31.30 3i0r n HIS 235 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3i0r n PRO 236 N 1.88 0.00 0.00 -0.41 -0.02 -1.26 -2.55 135.00 132.64 3i0r n PRO 236 Ca 0.25 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3i0r n PRO 236 Cb 0.42 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.96 3i0r n PRO 236 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3i0r n ASP 237 N -0.63 0.00 -1.89 2.55 5.68 -1.19 0.37 116.55 121.44 3i0r n ASP 237 Ca 0.00 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 54.12 3i0r n ASP 237 Cb 0.00 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.03 3i0r n ASP 237 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3i0r n LYS 238 N -2.16 1.85 -4.55 0.11 5.02 -1.06 -4.76 118.16 112.62 3i0r n LYS 238 Ca 0.00 -1.69 -0.34 0.00 -2.02 0.00 0.00 58.31 54.26 3i0r n LYS 238 Cb 0.00 -1.66 -0.11 0.00 -0.02 0.00 0.00 35.03 33.24 3i0r n LYS 238 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3i0r s TRP 239 N -1.96 2.99 0.00 2.13 0.51 1.19 -5.05 118.94 118.76 3i0r s TRP 239 Ca 0.33 -0.00 0.00 0.00 -2.12 0.00 0.00 56.10 54.31 3i0r s TRP 239 Cb 0.26 -1.76 0.00 0.00 -0.81 0.00 0.00 33.47 31.16 3i0r s TRP 239 CO 0.00 0.29 0.00 0.25 -0.51 0.00 0.00 176.95 176.99 3i0r n THR 240 N 2.42 0.00 0.00 2.01 -2.24 -1.26 -5.08 114.28 110.13 3i0r n THR 240 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3i0r n THR 240 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3i0r n THR 240 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3i0r n VAL 241 N 0.00 0.00 0.00 2.28 0.24 -1.26 -4.99 118.33 114.60 3i0r n VAL 241 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3i0r n VAL 241 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3i0r n VAL 241 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3i0r n GLN 242 N 0.00 0.00 -1.65 7.34 -0.06 -1.26 -4.73 117.38 117.02 3i0r n GLN 242 Ca 0.00 0.00 -0.63 0.00 -2.00 0.00 0.00 57.00 54.37 3i0r n GLN 242 Cb 0.00 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.09 3i0r n GLN 242 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 3i0r n PRO 243 N 0.00 0.21 -1.61 3.69 -0.02 -1.26 -4.71 135.00 131.30 3i0r n PRO 243 Ca 0.00 0.07 -0.50 0.00 -2.02 0.00 0.00 63.50 61.05 3i0r n PRO 243 Cb 0.00 -1.61 -0.05 0.00 -0.02 0.00 0.00 33.50 31.82 3i0r n PRO 243 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3i0r n ILE 244 N 3.15 0.18 -3.91 4.25 5.41 -1.23 -4.88 119.36 122.33 3i0r n ILE 244 Ca 0.26 -0.05 -0.36 0.00 1.00 0.00 0.00 62.75 63.61 3i0r n ILE 244 Cb 0.02 -0.98 -0.12 0.00 -0.71 0.00 0.00 39.64 37.86 3i0r n ILE 244 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3i0r s VAL 245 N 0.43 4.45 -0.21 1.39 1.01 -1.26 -4.82 120.40 121.38 3i0r s VAL 245 Ca 0.81 -0.14 -0.18 0.00 0.00 0.00 0.00 61.98 62.47 3i0r s VAL 245 Cb -0.88 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 3i0r s VAL 245 CO 0.46 0.39 0.52 -0.76 0.00 0.00 0.00 175.10 175.71 3i0r s LEU 246 N 1.08 4.13 0.18 3.92 1.43 -1.26 -5.02 118.68 123.13 3i0r s LEU 246 Ca 0.04 0.65 -0.31 0.00 -1.03 0.00 0.00 54.13 53.49 3i0r s LEU 246 Cb -0.14 -2.71 -0.17 0.00 0.03 0.00 0.00 46.19 43.20 3i0r s LEU 246 CO 0.03 -0.20 0.79 -2.65 0.23 0.00 0.00 176.35 174.55 3i0r n PRO 247 N 4.92 0.39 -3.98 1.29 -0.01 -1.26 -4.99 135.00 131.37 3i0r n PRO 247 Ca -0.05 0.14 -0.30 0.00 -0.01 0.00 0.00 63.50 63.28 3i0r n PRO 247 Cb 0.50 -1.36 -0.05 0.00 -0.01 0.00 0.00 33.50 32.59 3i0r n PRO 247 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 175.50 174.28 3i0r s GLU 248 N -0.83 3.21 0.00 -0.52 2.02 -1.26 -5.11 118.70 116.22 3i0r s GLU 248 Ca 0.69 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 55.11 3i0r s GLU 248 Cb -0.94 -2.90 0.00 0.00 0.10 0.00 0.00 34.13 30.39 3i0r s GLU 248 CO 0.56 0.58 0.00 0.36 0.02 0.00 0.00 175.26 176.78 3i0r n LYS 249 N 0.24 0.00 -3.26 1.61 2.85 -1.26 -5.12 118.16 113.22 3i0r n LYS 249 Ca -0.07 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.81 3i0r n LYS 249 Cb 0.52 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.84 3i0r n LYS 249 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 3i0r s ASP 250 N 0.00 6.99 0.00 -5.58 3.84 -1.26 -4.88 116.67 115.78 3i0r s ASP 250 Ca 0.00 1.17 0.00 0.00 -0.00 0.00 0.00 52.55 53.72 3i0r s ASP 250 Cb 0.00 -2.35 0.00 0.00 -1.38 0.00 0.00 42.92 39.19 3i0r s ASP 250 CO 0.00 0.18 0.00 -1.20 -0.00 0.00 0.00 175.17 174.15 3i0r n SER 251 N 2.31 -0.39 -3.17 2.11 7.64 -1.26 -5.09 113.62 115.77 3i0r n SER 251 Ca -0.09 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.82 3i0r n SER 251 Cb 0.51 0.77 -0.01 0.00 -1.01 0.00 0.00 64.21 64.47 3i0r n SER 251 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3i0r s TRP 252 N -2.64 -1.65 0.92 1.43 0.52 -1.26 -5.06 118.94 111.20 3i0r s TRP 252 Ca 0.00 1.37 -0.11 0.00 0.02 0.00 0.00 56.10 57.39 3i0r s TRP 252 Cb 0.00 0.42 0.15 0.00 -1.15 0.00 0.00 33.47 32.88 3i0r s TRP 252 CO 0.00 -0.96 1.12 0.99 0.02 0.00 0.00 176.95 178.12 3i0r s THR 253 N 2.82 2.31 0.17 2.01 2.01 -1.26 -2.15 115.64 121.55 3i0r s THR 253 Ca 0.16 0.10 -0.18 0.00 0.31 0.00 0.00 61.69 62.08 3i0r s THR 253 Cb -0.13 -2.23 0.10 0.00 0.01 0.00 0.00 72.50 70.25 3i0r s THR 253 CO -0.23 -0.13 1.65 0.58 -0.69 0.00 0.00 174.62 175.80 3i0r h VAL 254 N -1.82 0.51 -0.85 3.82 2.07 -1.27 -1.92 116.25 116.79 3i0r h VAL 254 Ca -0.46 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.18 3i0r h VAL 254 Cb 1.27 0.51 -0.13 0.00 -1.52 0.00 0.00 31.29 31.42 3i0r h VAL 254 CO 0.45 0.00 -0.46 -1.13 0.02 0.00 0.00 177.57 176.45 3i0r h ASN 255 N -0.05 -1.66 -0.68 0.57 -0.73 -1.85 1.33 115.58 112.52 3i0r h ASN 255 Ca 0.20 0.29 0.04 0.00 1.87 0.00 0.00 56.30 58.70 3i0r h ASN 255 Cb 0.36 0.79 -0.05 0.00 0.27 0.00 0.00 38.32 39.69 3i0r h ASN 255 CO -0.45 -0.29 0.41 0.44 -0.37 0.00 0.00 177.43 177.17 3i0r h ASP 256 N -0.08 0.66 -0.36 1.15 3.45 -1.73 1.20 116.42 120.71 3i0r h ASP 256 Ca 0.24 0.01 -0.12 0.00 0.43 0.00 0.00 57.03 57.58 3i0r h ASP 256 Cb 0.53 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 3i0r h ASP 256 CO -0.87 0.45 -0.26 0.40 -1.57 0.00 0.00 179.24 177.39 3i0r h ILE 257 N 0.79 1.29 0.14 0.35 2.04 -0.18 2.73 117.51 124.67 3i0r h ILE 257 Ca 0.28 -1.41 -0.00 0.00 1.00 0.00 0.00 64.86 64.72 3i0r h ILE 257 Cb 0.06 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 3i0r h ILE 257 CO -0.13 0.47 -0.18 1.56 0.00 0.00 0.00 178.15 179.87 3i0r h GLN 258 N 0.60 -0.31 -0.95 2.37 4.20 0.26 0.87 115.11 122.15 3i0r h GLN 258 Ca 0.07 0.02 0.27 0.00 0.06 0.00 0.00 58.65 59.07 3i0r h GLN 258 Cb 0.83 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.64 3i0r h GLN 258 CO 0.07 -0.21 0.68 0.87 -0.67 0.00 0.00 178.83 179.57 3i0r h LYS 259 N -0.32 0.03 0.49 1.46 1.57 0.16 -0.40 116.57 119.56 3i0r h LYS 259 Ca -0.02 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3i0r h LYS 259 Cb 0.29 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3i0r h LYS 259 CO -0.04 0.02 -0.24 1.25 -0.57 0.00 0.00 179.45 179.87 3i0r h LEU 260 N 0.03 -0.56 -0.13 2.94 7.12 0.63 -2.36 115.31 122.99 3i0r h LEU 260 Ca 0.46 -0.01 0.04 0.00 0.13 0.00 0.00 57.88 58.50 3i0r h LEU 260 Cb 1.77 0.15 -0.05 0.00 -0.53 0.00 0.00 40.66 42.00 3i0r h LEU 260 CO -0.02 -0.15 -0.17 1.62 -0.13 0.00 0.00 178.44 179.59 3i0r h VAL 261 N -1.15 0.56 -0.90 1.05 3.04 0.11 -0.54 116.25 118.42 3i0r h VAL 261 Ca -0.07 0.00 0.11 0.00 -1.01 0.00 0.00 66.70 65.73 3i0r h VAL 261 Cb 0.54 0.56 -0.12 0.00 -2.01 0.00 0.00 31.29 30.25 3i0r h VAL 261 CO 0.11 0.00 -0.45 0.61 -1.01 0.00 0.00 177.57 176.83 3i0r n GLY 262 N -1.31 -2.12 0.35 3.17 0.00 -0.20 0.22 105.19 105.29 3i0r n GLY 262 Ca -0.03 1.04 -0.04 0.00 0.00 0.00 0.00 46.02 47.00 3i0r n GLY 262 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3i0r h LYS 263 N 0.00 1.18 -0.27 1.61 3.64 -0.81 -2.10 116.57 119.82 3i0r h LYS 263 Ca 0.22 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3i0r h LYS 263 Cb 0.44 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3i0r h LYS 263 CO -0.87 0.88 0.11 -0.07 -2.27 0.00 0.00 179.45 177.23 3i0r h LEU 264 N 1.17 0.37 -0.71 5.20 3.38 0.14 -2.44 115.31 122.43 3i0r h LEU 264 Ca 0.29 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 58.19 3i0r h LEU 264 Cb 0.07 -0.10 -0.12 0.00 0.09 0.00 0.00 40.66 40.61 3i0r h LEU 264 CO -0.04 0.44 -0.44 -1.13 0.09 0.00 0.00 178.44 177.35 3i0r h ASN 265 N 0.28 -1.56 -0.56 -0.43 -0.73 0.30 -1.01 115.58 111.88 3i0r h ASN 265 Ca 0.09 0.27 0.10 0.00 1.87 0.00 0.00 56.30 58.63 3i0r h ASN 265 Cb 0.18 0.72 -0.08 0.00 0.27 0.00 0.00 38.32 39.42 3i0r h ASN 265 CO -0.01 -0.31 0.11 -0.25 -0.37 0.00 0.00 177.43 176.60 3i0r h TRP 266 N -0.16 0.17 -0.48 0.67 7.01 -0.96 -3.24 115.95 118.97 3i0r h TRP 266 Ca 0.21 0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.26 3i0r h TRP 266 Cb 0.55 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.59 3i0r h TRP 266 CO -0.78 -0.02 0.29 0.00 -2.79 0.00 0.00 178.44 175.14 3i0r h ALA 267 N 1.44 0.61 -2.46 2.65 0.00 -0.73 -3.41 119.26 117.37 3i0r h ALA 267 Ca 0.29 -0.01 -0.52 0.00 0.00 0.00 0.00 54.91 54.66 3i0r h ALA 267 Cb 0.41 -0.15 0.13 0.00 0.00 0.00 0.00 17.79 18.18 3i0r h ALA 267 CO -0.37 -0.00 0.35 -1.54 0.00 0.00 0.00 179.25 177.68 3i0r s SER 268 N -5.58 4.54 0.00 0.00 1.04 -1.13 -0.53 113.70 112.03 3i0r s SER 268 Ca -0.13 2.06 0.00 0.00 0.48 0.00 0.00 55.95 58.36 3i0r s SER 268 Cb 0.12 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.69 3i0r s SER 268 CO 0.73 -2.02 0.00 0.00 0.98 0.00 0.00 173.24 172.93 3i0r n GLN 269 N -2.92 0.00 -0.08 4.02 6.02 -1.26 -4.59 117.38 118.57 3i0r n GLN 269 Ca 0.11 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 57.01 3i0r n GLN 269 Cb 0.52 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.66 3i0r n GLN 269 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 3i0r n ILE 270 N 0.00 1.08 -3.51 5.09 3.06 -1.10 -4.82 119.36 119.17 3i0r n ILE 270 Ca 0.00 -0.60 -0.42 0.00 -2.50 0.00 0.00 62.75 59.23 3i0r n ILE 270 Cb 0.00 -0.75 -0.10 0.00 0.54 0.00 0.00 39.64 39.32 3i0r n ILE 270 CO 0.00 0.00 0.00 -0.31 -2.50 0.00 0.00 176.55 173.74 3i0r s TYR 271 N -2.38 3.24 0.04 9.51 4.12 0.31 -4.80 117.35 127.38 3i0r s TYR 271 Ca -0.13 -0.57 -0.30 0.00 0.02 0.00 0.00 57.07 56.09 3i0r s TYR 271 Cb 0.05 -2.53 -0.06 0.00 -1.52 0.00 0.00 41.96 37.91 3i0r s TYR 271 CO 0.59 -0.54 1.30 -2.14 0.02 0.00 0.00 175.55 174.77 3i0r s PRO 272 N 1.66 4.35 0.00 -1.71 0.02 -1.26 -3.40 135.00 134.67 3i0r s PRO 272 Ca 0.05 1.87 0.00 0.00 0.02 0.00 0.00 61.00 62.94 3i0r s PRO 272 Cb -0.19 -3.42 0.00 0.00 0.02 0.00 0.00 34.50 30.91 3i0r s PRO 272 CO 0.09 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 3i0r n GLY 273 N 3.42 2.45 2.87 0.52 0.00 -1.26 -5.01 105.19 108.19 3i0r n GLY 273 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 3i0r n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3i0r n ILE 274 N -1.26 0.00 -3.63 -0.61 2.08 -1.22 -4.99 119.36 109.72 3i0r n ILE 274 Ca 0.00 -0.10 -0.13 0.00 0.56 0.00 0.00 62.75 63.07 3i0r n ILE 274 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 38.82 3i0r n ILE 274 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3i0r s LYS 275 N -1.91 0.80 0.00 0.38 -0.14 -1.26 -5.04 119.74 112.56 3i0r s LYS 275 Ca 0.35 0.96 0.00 0.00 -1.36 0.00 0.00 55.97 55.93 3i0r s LYS 275 Cb 0.04 0.38 0.00 0.00 -1.68 0.00 0.00 37.83 36.58 3i0r s LYS 275 CO 0.67 -0.10 0.00 1.55 -0.76 0.00 0.00 175.35 176.71 3i0r n VAL 276 N 2.70 0.00 -0.28 3.17 3.14 -1.26 -4.85 118.33 120.95 3i0r n VAL 276 Ca -0.14 0.00 0.23 0.00 -2.96 0.00 0.00 64.34 61.47 3i0r n VAL 276 Cb 0.55 -0.25 0.56 0.00 -1.06 0.00 0.00 33.84 33.64 3i0r n VAL 276 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 3i0r h ARG 277 N 0.00 0.31 0.97 1.45 2.43 -1.98 0.14 114.38 117.70 3i0r h ARG 277 Ca 0.00 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3i0r h ARG 277 Cb 0.00 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3i0r h ARG 277 CO 0.00 0.20 -0.47 1.96 -1.51 0.00 0.00 179.97 180.16 3i0r h GLN 278 N 0.32 -1.26 -1.18 0.20 1.08 -1.98 -0.31 115.11 111.97 3i0r h GLN 278 Ca 0.53 0.09 0.34 0.00 -1.45 0.00 0.00 58.65 58.15 3i0r h GLN 278 Cb 1.48 0.29 -0.09 0.00 -0.05 0.00 0.00 27.48 29.11 3i0r h GLN 278 CO -0.19 -0.84 0.79 1.25 -0.95 0.00 0.00 178.83 178.89 3i0r h LEU 279 N -1.33 0.26 0.51 1.46 7.12 -1.27 -3.21 115.31 118.86 3i0r h LEU 279 Ca -0.13 0.07 -0.03 0.00 0.13 0.00 0.00 57.88 57.92 3i0r h LEU 279 Cb 1.00 0.03 0.01 0.00 -0.53 0.00 0.00 40.66 41.17 3i0r h LEU 279 CO 0.22 -0.00 -0.25 0.00 -0.13 0.00 0.00 178.44 178.28 3i0r n LYS 281 N -4.23 0.02 0.23 0.00 5.02 -0.77 0.55 118.16 118.98 3i0r n LYS 281 Ca -0.09 0.46 0.06 0.00 -2.02 0.00 0.00 58.31 56.73 3i0r n LYS 281 Cb 0.27 -2.27 0.54 0.00 -0.02 0.00 0.00 35.03 33.55 3i0r n LYS 281 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3i0r h LEU 282 N 0.00 0.00 -9.82 -0.35 3.38 -1.65 -3.40 115.31 103.47 3i0r h LEU 282 Ca 0.00 -0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 3i0r h LEU 282 Cb 1.45 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.16 3i0r h LEU 282 CO 0.00 0.13 -0.34 -0.76 0.09 0.00 0.00 178.44 177.57 3i0r s LEU 283 N -8.77 4.35 0.00 1.67 1.43 2.17 -5.04 118.68 114.49 3i0r s LEU 283 Ca -0.04 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 3i0r s LEU 283 Cb 0.16 -2.87 0.00 0.00 0.03 0.00 0.00 46.19 43.51 3i0r s LEU 283 CO 0.69 0.20 0.00 0.54 0.23 0.00 0.00 176.35 178.01 3i0r n ARG 284 N 0.88 0.00 0.00 1.70 1.74 -1.26 -4.95 116.66 114.77 3i0r n ARG 284 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 3i0r n ARG 284 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 3i0r n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i0r n GLY 285 N 0.00 2.40 2.52 -0.13 0.00 -1.26 -4.85 105.19 103.87 3i0r n GLY 285 Ca 0.00 -1.70 -0.37 0.00 0.00 0.00 0.00 46.02 43.95 3i0r n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3i0r n THR 286 N 1.49 3.61 -1.77 2.61 -2.24 -1.26 -4.94 114.28 111.78 3i0r n THR 286 Ca 0.00 -2.41 -0.32 0.00 -2.27 0.00 0.00 64.05 59.06 3i0r n THR 286 Cb 0.00 -2.51 0.03 0.00 -2.10 0.00 0.00 70.33 65.75 3i0r n THR 286 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3i0r s LYS 287 N 2.83 3.10 0.40 -0.78 1.02 -1.26 -5.01 119.74 120.04 3i0r s LYS 287 Ca 0.58 1.06 -0.25 0.00 0.02 0.00 0.00 55.97 57.38 3i0r s LYS 287 Cb 0.15 -2.01 -0.08 0.00 -0.52 0.00 0.00 37.83 35.37 3i0r s LYS 287 CO -0.05 -0.98 1.19 0.00 -0.92 0.00 0.00 175.35 174.60 3i0r s ALA 288 N -2.80 3.17 0.09 5.17 0.00 -1.26 -4.95 121.76 121.19 3i0r s ALA 288 Ca 0.60 1.01 -0.24 0.00 0.00 0.00 0.00 51.96 53.33 3i0r s ALA 288 Cb -0.15 -3.40 -0.15 0.00 0.00 0.00 0.00 23.12 19.42 3i0r s ALA 288 CO 0.47 -0.58 1.73 -0.07 0.00 0.00 0.00 175.76 177.31 3i0r h LEU 289 N 2.66 -0.10 -1.98 0.00 3.38 -1.98 -2.99 115.31 114.30 3i0r h LEU 289 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3i0r h LEU 289 Cb 1.24 0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.01 3i0r h LEU 289 CO 0.63 -0.07 0.00 0.35 0.09 0.00 0.00 178.44 179.44 3i0r n THR 290 N -5.14 0.84 -3.71 0.22 -2.24 -1.26 -2.49 114.28 100.50 3i0r n THR 290 Ca -0.08 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.32 3i0r n THR 290 Cb 0.07 -0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 67.27 3i0r n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3i0r s GLU 291 N 0.13 2.67 0.37 -0.78 2.12 -1.13 -4.94 118.70 117.12 3i0r s GLU 291 Ca 0.00 -1.16 -0.28 0.00 0.36 0.00 0.00 54.97 53.88 3i0r s GLU 291 Cb 0.00 -3.54 -0.11 0.00 0.26 0.00 0.00 34.13 30.74 3i0r s GLU 291 CO 0.00 -0.68 1.45 0.08 -0.54 0.00 0.00 175.26 175.56 3i0r s VAL 292 N 1.44 2.20 -0.05 3.70 1.01 -1.26 -2.70 120.40 124.74 3i0r s VAL 292 Ca -0.01 0.21 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 3i0r s VAL 292 Cb -0.20 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.07 3i0r s VAL 292 CO 0.04 0.05 0.12 0.27 0.00 0.00 0.00 175.10 175.58 3i0r s ILE 293 N -1.12 -0.01 0.56 2.22 -4.36 -0.92 -4.95 121.20 112.63 3i0r s ILE 293 Ca 0.52 0.03 -0.15 0.00 -0.26 0.00 0.00 60.65 60.79 3i0r s ILE 293 Cb -0.45 -0.18 -0.13 0.00 1.25 0.00 0.00 42.46 42.95 3i0r s ILE 293 CO 0.61 0.01 -0.29 -2.65 0.24 0.00 0.00 174.94 172.86 3i0r n PRO 294 N 3.21 0.00 -3.85 0.37 -0.01 -1.26 -4.56 135.00 128.89 3i0r n PRO 294 Ca -0.15 0.00 -0.29 0.00 -0.01 0.00 0.00 63.50 63.06 3i0r n PRO 294 Cb 0.58 -0.86 -0.16 0.00 -0.01 0.00 0.00 33.50 33.05 3i0r n PRO 294 CO 0.00 0.00 0.00 -0.48 -0.01 0.00 0.00 175.50 175.01 3i0r s LEU 295 N 5.09 1.81 0.33 2.45 2.34 -1.26 -5.06 118.68 124.38 3i0r s LEU 295 Ca 0.44 -0.90 -0.28 0.00 0.06 0.00 0.00 54.13 53.46 3i0r s LEU 295 Cb -0.34 -0.90 -0.09 0.00 -0.56 0.00 0.00 46.19 44.30 3i0r s LEU 295 CO 0.61 -0.24 1.12 0.42 -1.06 0.00 0.00 176.35 177.20 3i0r s THR 296 N 1.63 3.38 -0.71 5.48 -4.23 -1.26 -4.97 115.64 114.96 3i0r s THR 296 Ca -0.02 1.29 0.14 0.00 -1.18 0.00 0.00 61.69 61.92 3i0r s THR 296 Cb -0.17 -3.78 0.70 0.00 1.34 0.00 0.00 72.50 70.58 3i0r s THR 296 CO -0.07 0.23 1.58 -0.62 -0.54 0.00 0.00 174.62 175.21 3i0r n GLU 297 N 0.74 4.04 -0.13 3.99 4.71 -1.26 -2.57 120.64 130.16 3i0r n GLU 297 Ca 0.01 -2.71 -0.25 0.00 -0.01 0.00 0.00 57.16 54.21 3i0r n GLU 297 Cb 0.46 -2.03 -0.10 0.00 -1.01 0.00 0.00 31.44 28.75 3i0r n GLU 297 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3i0r n GLU 298 N 0.75 0.59 0.23 3.49 4.71 -1.26 -3.70 120.64 125.45 3i0r n GLU 298 Ca 0.24 0.21 0.11 0.00 -0.01 0.00 0.00 57.16 57.71 3i0r n GLU 298 Cb 0.97 -1.47 0.56 0.00 -1.01 0.00 0.00 31.44 30.50 3i0r n GLU 298 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3i0r h ALA 299 N -0.61 1.22 0.00 0.62 0.00 -1.89 2.90 119.26 121.51 3i0r h ALA 299 Ca -0.63 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.27 3i0r h ALA 299 Cb 1.69 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 3i0r h ALA 299 CO -0.29 -0.22 -0.02 1.49 0.00 0.00 0.00 179.25 180.21 3i0r h GLU 300 N 0.00 0.00 0.19 0.00 4.57 -1.57 -3.22 114.58 114.54 3i0r h GLU 300 Ca 0.00 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.93 3i0r h GLU 300 Cb 0.55 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 29.17 3i0r h GLU 300 CO 0.00 0.02 -1.11 -0.07 -1.18 0.00 0.00 179.01 176.66 3i0r h LEU 301 N 0.00 0.62 0.19 1.64 3.38 0.51 -2.83 115.31 118.83 3i0r h LEU 301 Ca -0.00 -0.94 -0.00 0.00 0.09 0.00 0.00 57.88 57.03 3i0r h LEU 301 Cb 0.79 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3i0r h LEU 301 CO 0.00 1.54 -0.24 -0.33 0.09 0.00 0.00 178.44 179.50 3i0r h GLU 302 N -0.16 -0.42 -0.10 1.13 5.08 -1.59 0.90 114.58 119.41 3i0r h GLU 302 Ca -0.20 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3i0r h GLU 302 Cb 1.86 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 31.20 3i0r h GLU 302 CO 0.20 -0.28 -0.06 1.28 -1.00 0.00 0.00 179.01 179.15 3i0r n LEU 303 N -3.78 -0.11 0.45 1.33 4.77 -1.22 0.13 117.00 118.58 3i0r n LEU 303 Ca -0.05 0.26 -0.18 0.00 -0.03 0.00 0.00 56.01 56.02 3i0r n LEU 303 Cb 0.21 -0.06 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 3i0r n LEU 303 CO 0.11 -0.19 0.50 0.00 -1.33 0.00 0.00 177.39 176.48 3i0r h ALA 304 N -0.03 -1.25 0.00 -1.18 0.00 -1.07 0.24 119.26 115.98 3i0r h ALA 304 Ca 0.02 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 3i0r h ALA 304 Cb 0.04 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3i0r h ALA 304 CO -0.10 -1.17 -0.23 0.93 0.00 0.00 0.00 179.25 178.69 3i0r h GLU 305 N -1.20 0.00 0.35 0.00 5.08 0.18 3.20 114.58 122.20 3i0r h GLU 305 Ca -0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3i0r h GLU 305 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3i0r h GLU 305 CO 0.19 0.23 -0.17 -0.91 -1.00 0.00 0.00 179.01 177.35 3i0r h ASN 306 N 0.00 -0.39 -0.66 1.42 -0.26 0.11 0.82 115.58 116.61 3i0r h ASN 306 Ca -0.00 -0.12 0.12 0.00 -0.56 0.00 0.00 56.30 55.74 3i0r h ASN 306 Cb 0.77 0.10 -0.12 0.00 -1.06 0.00 0.00 38.32 38.01 3i0r h ASN 306 CO 0.03 -0.09 -0.30 0.03 -1.06 0.00 0.00 177.43 176.04 3i0r h ARG 307 N -0.71 -0.10 0.00 0.81 3.08 0.22 3.41 114.38 121.09 3i0r h ARG 307 Ca -0.05 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3i0r h ARG 307 Cb 0.49 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.57 3i0r h ARG 307 CO 0.08 -0.07 0.00 -1.91 -1.07 0.00 0.00 179.97 177.00 3i0r n GLU 308 N -5.45 0.00 -0.31 0.04 2.13 1.04 -1.68 120.64 116.41 3i0r n GLU 308 Ca 0.06 0.61 0.14 0.00 0.66 0.00 0.00 57.16 58.63 3i0r n GLU 308 Cb 0.36 -1.16 0.37 0.00 0.27 0.00 0.00 31.44 31.29 3i0r n GLU 308 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3i0r h ILE 309 N 0.00 0.75 0.00 6.31 2.04 0.94 -2.11 117.51 125.43 3i0r h ILE 309 Ca 0.00 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.63 3i0r h ILE 309 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 3i0r h ILE 309 CO 0.00 0.12 0.16 0.18 0.00 0.00 0.00 178.15 178.61 3i0r n LEU 310 N -4.64 0.45 0.00 1.44 4.32 1.12 0.11 117.00 119.80 3i0r n LEU 310 Ca 0.21 0.66 0.11 0.00 -0.02 0.00 0.00 56.01 56.96 3i0r n LEU 310 Cb 0.56 -0.66 -0.07 0.00 -1.62 0.00 0.00 43.42 41.64 3i0r n LEU 310 CO 0.26 -0.81 -0.12 2.29 -1.22 0.00 0.00 177.39 177.79 3i0r n LYS 311 N -2.15 0.17 -1.85 3.23 2.85 -0.79 -3.56 118.16 116.06 3i0r n LYS 311 Ca -0.01 -0.04 -0.30 0.00 -1.05 0.00 0.00 58.31 56.91 3i0r n LYS 311 Cb 0.18 -1.52 0.04 0.00 -0.65 0.00 0.00 35.03 33.08 3i0r n LYS 311 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3i0r s GLU 312 N -3.13 3.07 0.79 -1.58 0.41 0.30 -4.74 118.70 113.82 3i0r s GLU 312 Ca 0.05 0.59 -0.13 0.00 -0.41 0.00 0.00 54.97 55.07 3i0r s GLU 312 Cb 0.15 -2.03 0.08 0.00 -1.78 0.00 0.00 34.13 30.55 3i0r s GLU 312 CO 0.85 -0.91 1.16 -2.14 -0.49 0.00 0.00 175.26 173.73 3i0r s PRO 313 N -5.28 1.82 -0.01 0.39 0.02 -1.26 -4.92 135.00 125.76 3i0r s PRO 313 Ca 0.57 1.57 -0.30 0.00 0.02 0.00 0.00 61.00 62.86 3i0r s PRO 313 Cb -0.11 -1.82 -0.07 0.00 0.02 0.00 0.00 34.50 32.52 3i0r s PRO 313 CO 0.53 -2.04 1.78 0.08 -0.33 0.00 0.00 177.00 177.02 3i0r s VAL 314 N -2.38 3.34 0.09 3.83 1.01 -1.26 -4.95 120.40 120.09 3i0r s VAL 314 Ca 0.69 0.43 -0.31 0.00 0.00 0.00 0.00 61.98 62.79 3i0r s VAL 314 Cb -0.24 -3.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 3i0r s VAL 314 CO 0.51 -0.04 1.36 -2.28 0.00 0.00 0.00 175.10 174.65 3i0r s HIS 315 N 4.17 3.23 0.00 5.22 2.46 -1.26 -3.77 115.29 125.34 3i0r s HIS 315 Ca 0.79 1.00 0.00 0.00 0.47 0.00 0.00 55.06 57.32 3i0r s HIS 315 Cb -0.37 -3.63 0.00 0.00 -0.13 0.00 0.00 32.58 28.45 3i0r s HIS 315 CO 0.34 -2.19 0.00 0.41 -2.47 0.00 0.00 174.74 170.84 3i0r n GLY 316 N 3.46 0.77 3.53 1.59 0.00 -1.26 -4.84 105.19 108.45 3i0r n GLY 316 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3i0r n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i0r s VAL 317 N -2.00 5.07 0.20 1.61 1.01 -1.25 -5.09 120.40 119.96 3i0r s VAL 317 Ca 0.00 -0.06 0.10 0.00 0.00 0.00 0.00 61.98 62.02 3i0r s VAL 317 Cb 0.00 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 3i0r s VAL 317 CO 0.00 0.17 -0.19 -0.31 0.00 0.00 0.00 175.10 174.77 3i0r s TYR 318 N 1.71 2.00 -0.28 5.22 1.51 -1.26 -5.01 117.35 121.25 3i0r s TYR 318 Ca 0.06 -0.43 -0.28 0.00 -1.01 0.00 0.00 57.07 55.41 3i0r s TYR 318 Cb -0.16 -0.95 0.01 0.00 -0.11 0.00 0.00 41.96 40.75 3i0r s TYR 318 CO 0.09 0.46 1.02 -0.47 -1.11 0.00 0.00 175.55 175.54 3i0r s TYR 319 N -2.25 3.24 -0.54 2.71 5.04 -1.26 -4.99 117.35 119.30 3i0r s TYR 319 Ca 0.21 1.26 -0.19 0.00 -2.44 0.00 0.00 57.07 55.91 3i0r s TYR 319 Cb -0.05 -3.43 0.07 0.00 0.35 0.00 0.00 41.96 38.90 3i0r s TYR 319 CO 0.09 -0.61 0.68 0.34 -1.34 0.00 0.00 175.55 174.71 3i0r s ASP 320 N 1.45 6.22 0.29 4.32 2.15 -1.26 -4.91 116.67 124.92 3i0r s ASP 320 Ca 0.43 -1.04 0.16 0.00 0.43 0.00 0.00 52.55 52.53 3i0r s ASP 320 Cb -0.14 -2.31 0.85 0.00 -0.30 0.00 0.00 42.92 41.03 3i0r s ASP 320 CO 0.11 -1.00 1.42 -2.65 -0.17 0.00 0.00 175.17 172.88 3i0r n PRO 321 N 6.35 0.10 -0.12 4.34 -0.02 -1.26 -0.67 135.00 143.72 3i0r n PRO 321 Ca -0.07 0.58 0.09 0.00 -2.02 0.00 0.00 63.50 62.09 3i0r n PRO 321 Cb 0.45 -1.99 0.30 0.00 -0.02 0.00 0.00 33.50 32.24 3i0r n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3i0r n SER 322 N -2.08 1.87 -3.92 2.55 3.41 -1.26 -4.90 113.62 109.30 3i0r n SER 322 Ca -0.01 -1.81 -0.25 0.00 -0.26 0.00 0.00 58.87 56.54 3i0r n SER 322 Cb 0.17 -0.16 -0.17 0.00 -0.26 0.00 0.00 64.21 63.79 3i0r n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3i0r s LYS 323 N -1.68 1.34 0.30 4.33 -0.14 0.15 -5.13 119.74 118.91 3i0r s LYS 323 Ca 0.31 -0.22 -0.14 0.00 -1.36 0.00 0.00 55.97 54.56 3i0r s LYS 323 Cb 0.16 -1.34 -0.10 0.00 -1.68 0.00 0.00 37.83 34.87 3i0r s LYS 323 CO 0.24 -0.17 -0.00 -0.25 -0.76 0.00 0.00 175.35 174.41 3i0r n ASP 324 N 4.54 -2.19 -4.89 2.83 10.43 -1.26 -4.82 116.55 121.19 3i0r n ASP 324 Ca -0.16 0.51 -0.32 0.00 2.57 0.00 0.00 54.79 57.38 3i0r n ASP 324 Cb 0.51 -0.59 -0.05 0.00 1.84 0.00 0.00 41.12 42.82 3i0r n ASP 324 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3i0r s LEU 325 N 3.16 4.28 0.07 0.64 1.43 -1.26 -4.61 118.68 122.38 3i0r s LEU 325 Ca 0.40 0.28 0.07 0.00 -1.03 0.00 0.00 54.13 53.84 3i0r s LEU 325 Cb -0.40 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.12 3i0r s LEU 325 CO 0.44 0.23 -0.18 -0.63 0.23 0.00 0.00 176.35 176.44 3i0r s ILE 326 N -1.37 1.46 -0.04 -0.59 1.01 0.53 0.31 121.20 122.52 3i0r s ILE 326 Ca 0.29 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.65 3i0r s ILE 326 Cb -0.13 -1.32 0.03 0.00 0.01 0.00 0.00 42.46 41.05 3i0r s ILE 326 CO 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 174.94 175.15 3i0r s ALA 327 N -1.01 0.41 0.00 9.38 0.00 -0.60 -1.18 121.76 128.76 3i0r s ALA 327 Ca 0.04 0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.14 3i0r s ALA 327 Cb -0.09 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 3i0r s ALA 327 CO 0.03 -0.20 -0.11 -2.00 0.00 0.00 0.00 175.76 173.47 3i0r s GLU 328 N 1.35 2.42 -0.04 0.00 2.12 -0.25 -1.45 118.70 122.85 3i0r s GLU 328 Ca -0.05 -0.78 0.04 0.00 0.36 0.00 0.00 54.97 54.53 3i0r s GLU 328 Cb -0.13 -2.39 0.00 0.00 0.26 0.00 0.00 34.13 31.87 3i0r s GLU 328 CO -0.02 0.59 -0.14 0.42 -0.54 0.00 0.00 175.26 175.57 3i0r s ILE 329 N -0.92 1.21 0.06 -3.70 1.01 -1.20 -1.84 121.20 115.82 3i0r s ILE 329 Ca 0.15 -0.58 0.07 0.00 0.00 0.00 0.00 60.65 60.29 3i0r s ILE 329 Cb -0.11 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.28 3i0r s ILE 329 CO 0.05 0.36 -0.17 -1.10 0.00 0.00 0.00 174.94 174.08 3i0r s GLN 330 N 0.16 2.04 -0.04 2.79 1.11 0.89 -4.37 119.66 122.24 3i0r s GLN 330 Ca -0.05 -1.01 -0.16 0.00 0.01 0.00 0.00 55.36 54.15 3i0r s GLN 330 Cb -0.11 -2.20 -0.05 0.00 -1.01 0.00 0.00 33.01 29.64 3i0r s GLN 330 CO 0.02 0.53 0.43 0.21 0.01 0.00 0.00 175.29 176.48 3i0r s LYS 331 N -1.65 4.08 -0.46 2.91 2.20 -1.26 -1.41 119.74 124.15 3i0r s LYS 331 Ca 0.16 0.41 0.09 0.00 -0.36 0.00 0.00 55.97 56.27 3i0r s LYS 331 Cb -0.11 -3.30 0.34 0.00 -1.51 0.00 0.00 37.83 33.25 3i0r s LYS 331 CO 0.07 0.50 0.81 1.04 -0.36 0.00 0.00 175.35 177.41 3i0r n GLN 332 N 2.50 1.89 0.00 4.03 1.13 0.78 -4.93 117.38 122.78 3i0r n GLN 332 Ca -0.12 -3.99 0.00 0.00 -1.94 0.00 0.00 57.00 50.96 3i0r n GLN 332 Cb 0.52 -1.91 0.00 0.00 0.11 0.00 0.00 30.24 28.96 3i0r n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3i0r n GLY 333 N 0.13 0.01 4.44 1.08 0.00 -1.26 -4.10 105.19 105.49 3i0r n GLY 333 Ca 0.27 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 3i0r n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i0r n GLN 334 N 0.00 -0.91 -2.43 1.61 3.00 -1.26 0.11 117.38 117.50 3i0r n GLN 334 Ca 0.00 0.13 -0.13 0.00 -0.01 0.00 0.00 57.00 56.98 3i0r n GLN 334 Cb 0.00 -4.24 -0.01 0.00 0.00 0.00 0.00 30.24 25.99 3i0r n GLN 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3i0r n GLY 335 N -1.73 -0.50 2.98 1.08 0.00 -1.26 -4.72 105.19 101.04 3i0r n GLY 335 Ca -0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.79 3i0r n GLY 335 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3i0r s GLN 336 N -5.03 0.44 -0.00 1.61 1.03 0.12 0.14 119.66 117.96 3i0r s GLN 336 Ca 0.00 -0.34 0.02 0.00 0.04 0.00 0.00 55.36 55.08 3i0r s GLN 336 Cb 0.00 -0.36 -0.01 0.00 0.03 0.00 0.00 33.01 32.68 3i0r s GLN 336 CO 0.00 0.09 -0.06 -1.58 -2.54 0.00 0.00 175.29 171.20 3i0r s TRP 337 N -0.47 0.51 0.21 9.60 0.52 -0.85 -0.16 118.94 128.31 3i0r s TRP 337 Ca -0.01 -0.12 0.06 0.00 0.02 0.00 0.00 56.10 56.05 3i0r s TRP 337 Cb -0.04 -0.33 -0.04 0.00 -1.15 0.00 0.00 33.47 31.91 3i0r s TRP 337 CO -0.00 -0.01 0.14 0.95 0.02 0.00 0.00 176.95 178.05 3i0r s THR 338 N -0.20 4.33 -0.04 2.01 -4.23 -0.50 -0.60 115.64 116.40 3i0r s THR 338 Ca 0.02 -1.32 -0.22 0.00 -1.18 0.00 0.00 61.69 58.99 3i0r s THR 338 Cb -0.03 -3.27 0.04 0.00 1.34 0.00 0.00 72.50 70.59 3i0r s THR 338 CO -0.00 -0.24 0.48 -0.72 -0.54 0.00 0.00 174.62 173.60 3i0r s TYR 339 N -1.96 -0.41 0.00 3.99 -0.85 -0.89 -0.07 117.35 117.17 3i0r s TYR 339 Ca 0.31 0.68 0.04 0.00 -0.52 0.00 0.00 57.07 57.59 3i0r s TYR 339 Cb -0.09 0.24 -0.01 0.00 0.38 0.00 0.00 41.96 42.48 3i0r s TYR 339 CO 0.23 -0.48 -0.12 -0.65 -1.52 0.00 0.00 175.55 173.01 3i0r s GLN 340 N -1.22 0.95 -0.09 -3.49 1.11 -0.77 -1.30 119.66 114.85 3i0r s GLN 340 Ca -0.12 -0.52 0.01 0.00 0.01 0.00 0.00 55.36 54.74 3i0r s GLN 340 Cb -0.03 -0.93 -0.02 0.00 -1.01 0.00 0.00 33.01 31.02 3i0r s GLN 340 CO 0.07 0.25 -0.12 0.42 0.01 0.00 0.00 175.29 175.92 3i0r s ILE 341 N -0.46 3.24 0.15 1.08 1.01 0.20 -1.09 121.20 125.33 3i0r s ILE 341 Ca 0.03 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.81 3i0r s ILE 341 Cb -0.06 -2.33 0.06 0.00 0.01 0.00 0.00 42.46 40.15 3i0r s ILE 341 CO 0.00 0.56 0.88 -0.72 0.00 0.00 0.00 174.94 175.66 3i0r s TYR 342 N -0.21 -0.19 -0.54 3.97 1.13 -0.32 0.21 117.35 121.39 3i0r s TYR 342 Ca 0.01 -0.11 0.10 0.00 -1.41 0.00 0.00 57.07 55.66 3i0r s TYR 342 Cb -0.13 0.63 -0.10 0.00 -1.10 0.00 0.00 41.96 41.26 3i0r s TYR 342 CO 0.03 -0.87 0.46 1.04 -2.51 0.00 0.00 175.55 173.70 3i0r n GLN 343 N -0.43 3.44 -3.50 -3.49 6.02 -1.26 -0.35 117.38 117.81 3i0r n GLN 343 Ca -0.07 -0.07 -0.07 0.00 -0.01 0.00 0.00 57.00 56.79 3i0r n GLN 343 Cb 0.61 -1.00 -0.08 0.00 1.02 0.00 0.00 30.24 30.79 3i0r n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3i0r s GLU 344 N -1.91 0.37 0.23 -1.09 0.41 -1.26 -4.91 118.70 110.53 3i0r s GLU 344 Ca 0.04 0.89 -0.23 0.00 -0.41 0.00 0.00 54.97 55.26 3i0r s GLU 344 Cb 0.08 0.11 -0.15 0.00 -1.78 0.00 0.00 34.13 32.39 3i0r s GLU 344 CO 0.41 -0.42 0.35 -2.30 -0.49 0.00 0.00 175.26 172.81 3i0r n PRO 345 N 5.39 0.00 0.00 0.39 -0.02 -1.26 -0.62 135.00 138.88 3i0r n PRO 345 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 3i0r n PRO 345 Cb 0.50 -0.88 0.00 0.00 -0.02 0.00 0.00 33.50 33.09 3i0r n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3i0r n PHE 346 N -0.26 0.00 -2.93 6.00 3.01 -1.26 -4.88 117.46 117.14 3i0r n PHE 346 Ca 0.14 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.16 3i0r n PHE 346 Cb 0.26 -0.24 -0.01 0.00 -0.01 0.00 0.00 39.48 39.48 3i0r n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3i0r s LYS 347 N 0.00 3.95 0.16 -1.08 3.01 0.21 -4.39 119.74 121.60 3i0r s LYS 347 Ca 0.00 -2.34 -0.31 0.00 -1.01 0.00 0.00 55.97 52.32 3i0r s LYS 347 Cb 0.00 -5.04 -0.08 0.00 -1.01 0.00 0.00 37.83 31.70 3i0r s LYS 347 CO 0.00 -1.79 1.36 -0.80 0.51 0.00 0.00 175.35 174.63 3i0r s ASN 348 N 3.10 6.84 0.33 2.83 0.01 -1.26 -4.31 114.94 122.48 3i0r s ASN 348 Ca 0.40 2.38 0.23 0.00 -0.71 0.00 0.00 52.86 55.17 3i0r s ASN 348 Cb -0.03 -2.60 0.32 0.00 0.41 0.00 0.00 41.25 39.35 3i0r s ASN 348 CO -0.02 -0.60 1.48 -0.07 -1.51 0.00 0.00 177.10 176.37 3i0r h LEU 349 N 6.08 0.00 0.00 0.60 4.07 -0.60 -3.45 115.31 122.00 3i0r h LEU 349 Ca -0.43 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.51 3i0r h LEU 349 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 3i0r h LEU 349 CO 0.82 0.01 0.00 1.17 -1.08 0.00 0.00 178.44 179.36 3i0r n LYS 350 N -2.82 0.00 -3.63 1.13 4.81 -0.98 -4.98 118.16 111.69 3i0r n LYS 350 Ca 0.03 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.43 3i0r n LYS 350 Cb 0.52 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.50 3i0r n LYS 350 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3i0r s THR 351 N -2.00 -0.17 0.00 3.15 -4.23 -1.26 0.62 115.64 111.74 3i0r s THR 351 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3i0r s THR 351 Cb 0.00 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.84 3i0r s THR 351 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 3i0r n GLY 352 N 4.35 4.49 3.16 3.99 0.00 -0.42 -4.61 105.19 116.14 3i0r n GLY 352 Ca -0.18 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 3i0r n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i0r s LYS 353 N 0.79 0.72 0.12 1.61 -2.85 -1.26 -2.08 119.74 116.78 3i0r s LYS 353 Ca 0.00 -0.97 0.10 0.00 -1.00 0.00 0.00 55.97 54.10 3i0r s LYS 353 Cb 0.00 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 36.01 3i0r s LYS 353 CO 0.00 -0.20 -0.23 -0.47 0.10 0.00 0.00 175.35 174.55 3i0r s TYR 354 N -3.55 2.40 -0.00 1.78 6.04 0.23 -4.99 117.35 119.26 3i0r s TYR 354 Ca 0.03 -0.33 0.03 0.00 0.04 0.00 0.00 57.07 56.84 3i0r s TYR 354 Cb 0.04 -1.30 -0.01 0.00 -1.04 0.00 0.00 41.96 39.65 3i0r s TYR 354 CO -0.09 0.34 -0.11 0.00 -1.54 0.00 0.00 175.55 174.15 3i0r s ALA 355 N -1.07 0.88 0.00 3.97 0.00 -1.26 -2.01 121.76 122.27 3i0r s ALA 355 Ca 0.15 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.61 3i0r s ALA 355 Cb -0.10 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.81 3i0r s ALA 355 CO 0.07 0.20 0.00 2.89 0.00 0.00 0.00 175.76 178.93 3i0r n ARG 356 N 2.66 0.00 0.00 0.00 1.85 0.38 -4.99 116.66 116.57 3i0r n ARG 356 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.71 3i0r n ARG 356 Cb 0.56 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.97 3i0r n ARG 356 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 3i0r n HIS 361 N 0.00 0.00 -5.13 2.89 1.44 -1.26 -5.11 115.22 108.05 3i0r n HIS 361 Ca 0.00 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.39 3i0r n HIS 361 Cb 0.00 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 29.96 3i0r n HIS 361 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 3i0r s THR 362 N 0.00 2.41 0.42 0.61 2.01 -1.26 -5.11 115.64 114.72 3i0r s THR 362 Ca 0.00 -0.95 0.05 0.00 0.31 0.00 0.00 61.69 61.10 3i0r s THR 362 Cb 0.00 -1.90 0.05 0.00 0.01 0.00 0.00 72.50 70.66 3i0r s THR 362 CO 0.00 0.57 0.42 -0.46 -0.69 0.00 0.00 174.62 174.46 3i0r n ASN 363 N 2.78 2.02 -0.16 3.53 0.23 -1.26 -5.01 115.26 117.39 3i0r n ASN 363 Ca -0.17 -2.30 -0.09 0.00 -0.53 0.00 0.00 54.58 51.49 3i0r n ASN 363 Cb 0.52 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 3i0r n ASN 363 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3i0r h ASP 364 N 0.32 0.66 0.24 0.53 3.32 -2.00 -2.51 116.42 116.99 3i0r h ASP 364 Ca -0.24 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 3i0r h ASP 364 Cb 0.94 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.32 3i0r h ASP 364 CO 0.36 0.68 -0.11 0.58 -1.72 0.00 0.00 179.24 179.03 3i0r h VAL 365 N 0.60 0.69 -0.98 -1.35 2.07 -1.99 -0.91 116.25 114.38 3i0r h VAL 365 Ca 0.15 -0.91 0.41 0.00 0.82 0.00 0.00 66.70 67.17 3i0r h VAL 365 Cb 0.26 1.11 -0.17 0.00 -1.52 0.00 0.00 31.29 30.97 3i0r h VAL 365 CO -0.01 0.16 0.54 1.17 0.02 0.00 0.00 177.57 179.45 3i0r n LYS 366 N -5.01 -0.06 -0.02 1.57 3.00 -1.23 -0.59 118.16 115.82 3i0r n LYS 366 Ca -0.08 1.32 -0.16 0.00 -0.00 0.00 0.00 58.31 59.40 3i0r n LYS 366 Cb 0.26 -2.39 -0.10 0.00 0.00 0.00 0.00 35.03 32.80 3i0r n LYS 366 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 3i0r h GLN 367 N 0.00 0.31 -0.90 1.64 4.20 -0.97 -1.89 115.11 117.51 3i0r h GLN 367 Ca 0.82 -0.29 0.04 0.00 0.06 0.00 0.00 58.65 59.28 3i0r h GLN 367 Cb 2.20 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 29.99 3i0r h GLN 367 CO -0.73 0.97 0.57 1.25 -0.67 0.00 0.00 178.83 180.23 3i0r h LEU 368 N -0.24 0.94 -0.13 1.46 5.85 0.48 0.12 115.31 123.79 3i0r h LEU 368 Ca -0.04 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 3i0r h LEU 368 Cb 1.08 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 3i0r h LEU 368 CO 0.08 0.63 0.06 0.74 -0.34 0.00 0.00 178.44 179.61 3i0r h THR 369 N 1.09 1.14 -0.79 1.05 2.02 -0.83 0.10 112.91 116.70 3i0r h THR 369 Ca 0.37 -0.40 0.03 0.00 0.77 0.00 0.00 66.41 67.18 3i0r h THR 369 Cb 0.05 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.59 3i0r h THR 369 CO -0.13 0.12 0.50 -0.33 0.37 0.00 0.00 175.52 176.05 3i0r h GLU 370 N 0.06 0.95 -0.37 6.66 5.08 -0.90 -2.47 114.58 123.58 3i0r h GLU 370 Ca 0.04 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3i0r h GLU 370 Cb 0.15 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3i0r h GLU 370 CO -0.00 0.63 0.20 0.00 -1.00 0.00 0.00 179.01 178.83 3i0r h ALA 371 N 1.33 0.47 -0.61 3.43 0.00 -0.38 -1.03 119.26 122.47 3i0r h ALA 371 Ca 0.32 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.19 3i0r h ALA 371 Cb 0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3i0r h ALA 371 CO -0.11 -0.01 0.36 0.28 0.00 0.00 0.00 179.25 179.77 3i0r h VAL 372 N 0.47 1.03 -0.07 0.00 2.07 -0.55 -0.54 116.25 118.66 3i0r h VAL 372 Ca 0.13 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3i0r h VAL 372 Cb 0.05 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3i0r h VAL 372 CO -0.02 0.13 0.01 1.56 0.02 0.00 0.00 177.57 179.27 3i0r h GLN 373 N 0.69 0.11 -0.29 1.57 4.20 -1.14 -0.50 115.11 119.74 3i0r h GLN 373 Ca 0.25 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.97 3i0r h GLN 373 Cb 0.08 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.79 3i0r h GLN 373 CO -0.13 0.32 -0.40 -0.22 -0.67 0.00 0.00 178.83 177.73 3i0r h LYS 374 N -0.13 -0.28 -0.96 1.46 3.11 -0.65 0.62 116.57 119.74 3i0r h LYS 374 Ca 0.02 0.02 0.07 0.00 -2.81 0.00 0.00 60.65 57.95 3i0r h LYS 374 Cb 0.27 0.06 -0.07 0.00 -1.00 0.00 0.00 32.23 31.49 3i0r h LYS 374 CO 0.00 -0.19 0.61 0.82 -2.81 0.00 0.00 179.45 177.89 3i0r h ILE 375 N -0.29 1.05 -0.61 2.00 2.04 -1.05 -0.45 117.51 120.19 3i0r h ILE 375 Ca 0.05 -0.37 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3i0r h ILE 375 Cb 0.43 -0.14 -0.05 0.00 -0.74 0.00 0.00 36.82 36.33 3i0r h ILE 375 CO -0.43 0.20 0.35 0.74 0.00 0.00 0.00 178.15 179.01 3i0r h THR 376 N 1.09 1.01 -0.06 -0.27 2.02 -0.08 0.32 112.91 116.95 3i0r h THR 376 Ca 0.43 -0.23 -0.18 0.00 0.77 0.00 0.00 66.41 67.20 3i0r h THR 376 Cb 0.22 0.28 0.01 0.00 -1.74 0.00 0.00 68.15 66.92 3i0r h THR 376 CO -0.19 0.12 -0.67 0.00 0.37 0.00 0.00 175.52 175.16 3i0r h THR 377 N 0.67 1.36 -0.69 3.16 1.03 0.64 0.25 112.91 119.32 3i0r h THR 377 Ca 0.26 -2.00 0.15 0.00 -0.01 0.00 0.00 66.41 64.81 3i0r h THR 377 Cb 0.11 2.33 -0.11 0.00 -1.07 0.00 0.00 68.15 69.42 3i0r h THR 377 CO -0.15 0.60 0.13 -0.33 -0.01 0.00 0.00 175.52 175.76 3i0r h GLU 378 N 0.15 0.22 -0.83 0.00 5.08 -1.09 -1.82 114.58 116.29 3i0r h GLU 378 Ca -0.07 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3i0r h GLU 378 Cb 1.33 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 3i0r h GLU 378 CO 0.13 0.15 0.41 1.03 -1.00 0.00 0.00 179.01 179.74 3i0r h SER 379 N 0.23 1.07 -0.44 1.42 0.87 0.91 -0.35 113.55 117.25 3i0r h SER 379 Ca 0.38 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 3i0r h SER 379 Cb 0.64 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 3i0r h SER 379 CO -0.51 0.89 0.25 0.40 -0.53 0.00 0.00 176.83 177.33 3i0r h ILE 380 N 1.18 1.15 0.06 2.23 2.04 0.21 -0.40 117.51 123.97 3i0r h ILE 380 Ca 0.29 -0.38 -0.24 0.00 1.00 0.00 0.00 64.86 65.53 3i0r h ILE 380 Cb 0.09 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3i0r h ILE 380 CO -0.04 0.16 -1.08 0.58 0.00 0.00 0.00 178.15 177.77 3i0r h VAL 381 N 0.65 1.58 0.16 1.67 2.07 -0.34 -0.23 116.25 121.81 3i0r h VAL 381 Ca 0.17 -3.12 -0.31 0.00 0.82 0.00 0.00 66.70 64.25 3i0r h VAL 381 Cb 0.03 2.82 0.01 0.00 -1.52 0.00 0.00 31.29 32.63 3i0r h VAL 381 CO -0.03 0.90 -1.54 0.40 0.02 0.00 0.00 177.57 177.32 3i0r h ILE 382 N 0.05 1.04 0.00 4.57 2.04 -0.97 -3.37 117.51 120.87 3i0r h ILE 382 Ca -0.07 -2.48 0.00 0.00 1.00 0.00 0.00 64.86 63.30 3i0r h ILE 382 Cb 1.81 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 40.69 3i0r h ILE 382 CO 0.16 0.79 -0.56 0.79 0.00 0.00 0.00 178.15 179.34 3i0r n TRP 383 N -3.76 0.00 -1.02 1.37 8.01 -0.17 -4.95 117.44 116.91 3i0r n TRP 383 Ca -0.24 0.00 -0.01 0.00 -1.31 0.00 0.00 57.50 55.95 3i0r n TRP 383 Cb 1.00 -0.01 -0.00 0.00 -2.01 0.00 0.00 31.31 30.28 3i0r n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3i0r n GLY 384 N 1.73 0.47 3.19 6.99 0.00 -0.10 -5.01 105.19 112.47 3i0r n GLY 384 Ca -0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 3i0r n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i0r s LYS 385 N -0.78 1.09 -0.01 1.61 -2.85 -1.26 -4.98 119.74 112.57 3i0r s LYS 385 Ca 0.00 -1.55 0.02 0.00 -1.00 0.00 0.00 55.97 53.44 3i0r s LYS 385 Cb 0.00 0.14 -0.03 0.00 -2.06 0.00 0.00 37.83 35.88 3i0r s LYS 385 CO 0.00 -0.29 -0.03 0.95 0.10 0.00 0.00 175.35 176.08 3i0r s THR 386 N -4.01 3.95 0.84 3.79 -4.23 -1.26 -3.53 115.64 111.19 3i0r s THR 386 Ca 0.31 -0.64 -0.12 0.00 -1.18 0.00 0.00 61.69 60.05 3i0r s THR 386 Cb 0.07 -2.74 0.10 0.00 1.34 0.00 0.00 72.50 71.27 3i0r s THR 386 CO 0.07 0.40 1.12 -2.16 -0.54 0.00 0.00 174.62 173.51 3i0r s PRO 387 N -1.44 1.72 -0.26 3.99 0.04 -1.26 -4.63 135.00 133.16 3i0r s PRO 387 Ca 0.18 0.42 -0.13 0.00 0.04 0.00 0.00 61.00 61.50 3i0r s PRO 387 Cb -0.11 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 3i0r s PRO 387 CO 0.08 -1.82 0.30 0.21 0.04 0.00 0.00 177.00 175.81 3i0r s LYS 388 N -5.27 4.02 0.02 4.56 2.47 0.15 -3.98 119.74 121.71 3i0r s LYS 388 Ca 0.62 -0.08 -0.20 0.00 -1.56 0.00 0.00 55.97 54.75 3i0r s LYS 388 Cb -0.14 -3.63 -0.06 0.00 -1.46 0.00 0.00 37.83 32.54 3i0r s LYS 388 CO 0.53 -0.19 0.58 -0.06 0.16 0.00 0.00 175.35 176.37 3i0r s PHE 389 N 1.79 3.73 -0.44 4.03 0.40 0.31 -1.56 117.98 126.24 3i0r s PHE 389 Ca 0.12 1.22 -0.12 0.00 -0.60 0.00 0.00 56.93 57.55 3i0r s PHE 389 Cb -0.15 -2.55 0.07 0.00 0.51 0.00 0.00 43.02 40.89 3i0r s PHE 389 CO 0.09 0.45 0.31 0.15 0.70 0.00 0.00 175.22 176.93 3i0r s LYS 390 N -0.57 2.79 -0.17 0.44 1.02 -0.53 -0.04 119.74 122.68 3i0r s LYS 390 Ca 0.30 -1.38 -0.10 0.00 0.02 0.00 0.00 55.97 54.82 3i0r s LYS 390 Cb -0.19 -3.93 -0.05 0.00 -0.52 0.00 0.00 37.83 33.15 3i0r s LYS 390 CO 0.18 -0.96 0.15 -0.51 -0.92 0.00 0.00 175.35 173.29 3i0r s LEU 391 N 1.53 4.27 -1.49 3.17 1.43 0.19 -3.26 118.68 124.53 3i0r s LEU 391 Ca 0.03 0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.35 3i0r s LEU 391 Cb -0.23 -2.12 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 3i0r s LEU 391 CO 0.05 0.24 2.46 -0.81 0.23 0.00 0.00 176.35 178.52 3i0r n PRO 392 N 3.06 3.09 -3.45 1.29 -0.04 -1.26 -0.79 135.00 136.90 3i0r n PRO 392 Ca -0.17 -2.44 -0.13 0.00 -0.04 0.00 0.00 63.50 60.72 3i0r n PRO 392 Cb 0.53 -3.11 -0.03 0.00 -0.04 0.00 0.00 33.50 30.84 3i0r n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3i0r s ILE 393 N 2.91 0.00 -0.03 0.52 2.07 -1.26 -5.01 121.20 120.39 3i0r s ILE 393 Ca 0.55 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.49 3i0r s ILE 393 Cb 0.15 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.70 3i0r s ILE 393 CO -0.08 0.00 1.28 -1.58 -1.91 0.00 0.00 174.94 172.65 3i0r s GLN 394 N -3.04 4.33 0.10 3.50 0.74 -1.26 -4.49 119.66 119.55 3i0r s GLN 394 Ca -0.02 1.79 -0.10 0.00 0.05 0.00 0.00 55.36 57.08 3i0r s GLN 394 Cb -0.01 -3.56 0.08 0.00 1.10 0.00 0.00 33.01 30.63 3i0r s GLN 394 CO -0.07 -0.49 0.74 1.17 -0.55 0.00 0.00 175.29 176.09 3i0r n LYS 395 N 5.23 -0.14 0.25 1.67 4.81 -1.26 -1.09 118.16 127.63 3i0r n LYS 395 Ca 0.12 0.73 -0.16 0.00 -0.87 0.00 0.00 58.31 58.13 3i0r n LYS 395 Cb 0.45 -1.09 -0.08 0.00 0.02 0.00 0.00 35.03 34.33 3i0r n LYS 395 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 3i0r h GLU 396 N 0.00 -0.56 0.04 1.64 3.07 -1.99 -1.77 114.58 115.02 3i0r h GLU 396 Ca 0.15 0.04 0.03 0.00 -0.50 0.00 0.00 59.36 59.07 3i0r h GLU 396 Cb 0.27 0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 28.26 3i0r h GLU 396 CO -0.47 -0.36 -0.31 1.15 -1.40 0.00 0.00 179.01 177.62 3i0r h THR 397 N -0.61 0.33 -0.50 1.13 2.02 -1.60 0.27 112.91 113.95 3i0r h THR 397 Ca -0.06 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.22 3i0r h THR 397 Cb 0.46 0.33 -0.09 0.00 -1.74 0.00 0.00 68.15 67.11 3i0r h THR 397 CO 0.10 0.00 -0.08 -0.25 0.37 0.00 0.00 175.52 175.66 3i0r h TRP 398 N -0.49 -0.18 0.30 3.16 2.91 -1.09 -0.53 115.95 120.03 3i0r h TRP 398 Ca 0.05 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.10 3i0r h TRP 398 Cb 0.55 0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.35 3i0r h TRP 398 CO -0.31 -0.18 -0.19 0.93 -1.03 0.00 0.00 178.44 177.65 3i0r h GLU 399 N 0.04 -0.46 -0.80 2.65 5.08 -0.51 -0.16 114.58 120.42 3i0r h GLU 399 Ca 0.25 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.68 3i0r h GLU 399 Cb 0.38 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 3i0r h GLU 399 CO -0.48 -0.31 0.50 0.00 -1.00 0.00 0.00 179.01 177.72 3i0r h THR 400 N -0.48 1.07 0.00 1.13 1.03 -0.26 -3.36 112.91 112.04 3i0r h THR 400 Ca -0.03 -0.32 -0.08 0.00 -0.01 0.00 0.00 66.41 65.98 3i0r h THR 400 Cb 0.40 0.05 -0.01 0.00 -1.07 0.00 0.00 68.15 67.52 3i0r h THR 400 CO 0.02 0.17 -1.58 0.79 -0.01 0.00 0.00 175.52 174.91 3i0r n TRP 401 N -4.63 0.54 0.09 0.00 7.02 -0.23 -4.64 117.44 115.59 3i0r n TRP 401 Ca 0.10 0.17 -0.03 0.00 -1.02 0.00 0.00 57.50 56.72 3i0r n TRP 401 Cb 0.13 -0.83 0.20 0.00 -2.42 0.00 0.00 31.31 28.39 3i0r n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 3i0r h TRP 402 N 0.00 0.31 0.00 -5.99 5.08 -1.19 -1.72 115.95 112.44 3i0r h TRP 402 Ca -0.09 -0.09 0.00 0.00 1.08 0.00 0.00 58.89 59.79 3i0r h TRP 402 Cb 1.26 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 27.35 3i0r h TRP 402 CO 0.00 0.66 0.00 0.25 -1.28 0.00 0.00 178.44 178.07 3i0r n THR 403 N -4.00 1.44 0.28 0.12 -2.24 -1.26 -1.46 114.28 107.15 3i0r n THR 403 Ca -0.02 0.46 0.17 0.00 -2.27 0.00 0.00 64.05 62.40 3i0r n THR 403 Cb 0.50 -1.40 0.74 0.00 -2.10 0.00 0.00 70.33 68.07 3i0r n THR 403 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3i0r h GLU 404 N 0.00 0.00 0.00 -0.78 4.39 -1.63 -3.31 114.58 113.25 3i0r h GLU 404 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3i0r h GLU 404 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3i0r h GLU 404 CO 0.00 0.03 -0.74 0.66 -1.16 0.00 0.00 179.01 177.80 3i0r n TYR 405 N -3.15 0.00 -1.65 4.33 4.01 -0.54 -4.99 117.16 115.17 3i0r n TYR 405 Ca -0.00 0.00 -0.47 0.00 -0.16 0.00 0.00 57.90 57.27 3i0r n TYR 405 Cb 0.28 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.27 3i0r n TYR 405 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 3i0r n TRP 406 N -1.29 2.10 -0.25 -0.72 -0.00 -0.57 -4.86 117.44 111.85 3i0r n TRP 406 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.50 57.88 3i0r n TRP 406 Cb 0.13 -2.48 0.00 0.00 -0.00 0.00 0.00 31.31 28.96 3i0r n TRP 406 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 3i0r n GLN 407 N 2.88 1.11 -2.04 5.87 6.02 -1.26 -4.40 117.38 125.56 3i0r n GLN 407 Ca 0.16 -0.20 -0.29 0.00 -0.01 0.00 0.00 57.00 56.66 3i0r n GLN 407 Cb 0.28 -0.63 0.04 0.00 1.02 0.00 0.00 30.24 30.96 3i0r n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i0r s ALA 408 N -0.21 3.01 -0.24 -1.58 0.00 -1.26 -4.59 121.76 116.89 3i0r s ALA 408 Ca 0.00 -0.48 0.22 0.00 0.00 0.00 0.00 51.96 51.71 3i0r s ALA 408 Cb 0.00 -2.89 -0.07 0.00 0.00 0.00 0.00 23.12 20.16 3i0r s ALA 408 CO 0.00 -1.07 0.91 0.25 0.00 0.00 0.00 175.76 175.85 3i0r n THR 409 N -2.90 0.41 -2.82 0.00 -2.24 -1.26 -4.91 114.28 100.56 3i0r n THR 409 Ca 0.06 -0.49 -0.19 0.00 -2.27 0.00 0.00 64.05 61.16 3i0r n THR 409 Cb 0.58 -0.18 0.03 0.00 -2.10 0.00 0.00 70.33 68.65 3i0r n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3i0r s TRP 410 N -3.38 2.73 -0.06 4.78 1.48 -1.26 -4.74 118.94 118.49 3i0r s TRP 410 Ca -0.02 -0.22 -0.03 0.00 -1.06 0.00 0.00 56.10 54.77 3i0r s TRP 410 Cb 0.11 -2.57 0.04 0.00 -1.16 0.00 0.00 33.47 29.88 3i0r s TRP 410 CO 0.82 -0.71 0.07 0.42 -4.06 0.00 0.00 176.95 173.48 3i0r s ILE 411 N -2.59 -0.11 0.00 0.66 1.01 -1.26 -5.04 121.20 113.88 3i0r s ILE 411 Ca 0.57 0.32 0.00 0.00 0.00 0.00 0.00 60.65 61.54 3i0r s ILE 411 Cb -0.10 -0.23 0.00 0.00 0.01 0.00 0.00 42.46 42.14 3i0r s ILE 411 CO 0.36 0.10 0.00 -0.81 0.00 0.00 0.00 174.94 174.59 3i0r n PRO 412 N 5.30 0.27 -3.98 2.79 -0.04 -1.26 -4.88 135.00 133.19 3i0r n PRO 412 Ca -0.04 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.09 3i0r n PRO 412 Cb 0.50 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.90 3i0r n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3i0r s GLU 413 N -2.47 3.30 0.08 0.54 2.02 -1.26 -5.01 118.70 115.91 3i0r s GLU 413 Ca 0.00 -0.35 -0.08 0.00 0.02 0.00 0.00 54.97 54.56 3i0r s GLU 413 Cb 0.00 -3.02 -0.01 0.00 0.10 0.00 0.00 34.13 31.20 3i0r s GLU 413 CO 0.00 0.68 0.16 1.67 0.02 0.00 0.00 175.26 177.79 3i0r s TRP 414 N -1.23 0.19 0.33 1.61 -2.14 -1.26 0.12 118.94 116.56 3i0r s TRP 414 Ca 0.24 -0.61 0.04 0.00 2.66 0.00 0.00 56.10 58.42 3i0r s TRP 414 Cb -0.12 -0.10 -0.03 0.00 -3.10 0.00 0.00 33.47 30.11 3i0r s TRP 414 CO 0.15 -0.51 0.17 -1.21 -2.66 0.00 0.00 176.95 172.89 3i0r s GLU 415 N -3.72 1.69 -0.07 3.25 2.02 0.94 -4.91 118.70 117.90 3i0r s GLU 415 Ca 0.04 -1.98 0.03 0.00 0.02 0.00 0.00 54.97 53.08 3i0r s GLU 415 Cb 0.05 -0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.13 3i0r s GLU 415 CO -0.10 -0.48 -0.15 -0.06 0.02 0.00 0.00 175.26 174.49 3i0r s PHE 416 N -3.50 1.71 0.15 1.61 0.08 -1.26 -0.63 117.98 116.14 3i0r s PHE 416 Ca 0.34 -0.64 -0.02 0.00 0.12 0.00 0.00 56.93 56.73 3i0r s PHE 416 Cb 0.04 -1.21 -0.04 0.00 -0.57 0.00 0.00 43.02 41.24 3i0r s PHE 416 CO 0.18 -0.30 0.11 0.14 -0.10 0.00 0.00 175.22 175.25 3i0r s VAL 417 N 0.53 0.07 -0.93 -0.44 -7.23 0.03 -4.87 120.40 107.57 3i0r s VAL 417 Ca -0.14 -1.86 -0.00 0.00 -1.81 0.00 0.00 61.98 58.16 3i0r s VAL 417 Cb -0.16 -2.13 0.29 0.00 0.56 0.00 0.00 36.38 34.95 3i0r s VAL 417 CO 0.05 -0.34 1.25 0.59 -0.31 0.00 0.00 175.10 176.34 3i0r n ASN 418 N -0.15 5.56 0.00 4.85 3.02 -1.26 -4.11 115.26 123.16 3i0r n ASN 418 Ca -0.04 -3.44 0.00 0.00 -0.03 0.00 0.00 54.58 51.07 3i0r n ASN 418 Cb 0.64 -1.06 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 3i0r n ASN 418 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3i0r n THR 419 N 1.09 0.00 -1.54 3.41 -1.04 -1.26 -4.75 114.28 110.20 3i0r n THR 419 Ca 0.28 0.00 -0.46 0.00 -2.04 0.00 0.00 64.05 61.83 3i0r n THR 419 Cb 0.36 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.84 3i0r n THR 419 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3i0r n PRO 420 N 0.00 0.97 -0.11 -2.82 -0.04 -1.26 -4.80 135.00 126.94 3i0r n PRO 420 Ca 0.00 0.34 0.19 0.00 -0.04 0.00 0.00 63.50 63.99 3i0r n PRO 420 Cb 0.00 -1.63 0.61 0.00 -0.04 0.00 0.00 33.50 32.44 3i0r n PRO 420 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 3i0r h PRO 421 N 1.89 0.19 0.00 0.54 0.13 -2.03 -3.17 132.00 129.54 3i0r h PRO 421 Ca -0.37 -0.01 -0.40 0.00 -0.87 0.00 0.00 66.00 64.35 3i0r h PRO 421 Cb 1.37 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.39 3i0r h PRO 421 CO 0.61 0.12 -2.46 1.28 -0.23 0.00 0.00 178.00 177.32 3i0r n LEU 422 N -4.41 2.67 -0.18 1.56 4.77 -1.26 -4.04 117.00 116.10 3i0r n LEU 422 Ca 0.13 -0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.29 3i0r n LEU 422 Cb 0.63 -0.86 0.32 0.00 -2.33 0.00 0.00 43.42 41.18 3i0r n LEU 422 CO 0.35 0.82 0.58 0.52 -1.33 0.00 0.00 177.39 178.33 3i0r n VAL 423 N -3.52 -0.22 -0.27 4.08 0.31 -1.20 0.71 118.33 118.21 3i0r n VAL 423 Ca -0.47 1.09 0.01 0.00 -0.01 0.00 0.00 64.34 64.96 3i0r n VAL 423 Cb 0.95 -1.78 0.14 0.00 -0.91 0.00 0.00 33.84 32.24 3i0r n VAL 423 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 3i0r h LYS 424 N 0.00 0.77 0.00 5.55 3.64 -1.69 -3.13 116.57 121.70 3i0r h LYS 424 Ca 0.46 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.71 3i0r h LYS 424 Cb 1.24 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 3i0r h LYS 424 CO -0.41 0.51 -0.67 1.37 -2.27 0.00 0.00 179.45 177.98 3i0r h LEU 425 N 0.79 0.00 0.00 5.20 -0.00 0.07 -2.64 115.31 118.73 3i0r h LEU 425 Ca 0.36 -0.32 0.00 0.00 -0.00 0.00 0.00 57.88 57.92 3i0r h LEU 425 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.92 3i0r h LEU 425 CO -0.21 1.04 0.81 0.79 -0.00 0.00 0.00 178.44 180.87 3i0r n TRP 426 N -4.57 0.00 0.21 0.17 8.01 -0.85 0.41 117.44 120.82 3i0r n TRP 426 Ca -0.16 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.06 3i0r n TRP 426 Cb 0.42 0.00 -0.04 0.00 -2.01 0.00 0.00 31.31 29.68 3i0r n TRP 426 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3i0r n TYR 427 N -1.99 0.00 0.52 -5.99 4.01 -1.18 -4.94 117.16 107.59 3i0r n TYR 427 Ca 0.00 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 3i0r n TYR 427 Cb 0.81 -0.04 0.24 0.00 -0.31 0.00 0.00 39.34 40.04 3i0r n TYR 427 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34